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 2ig9_1_A DATA FIRST_RESID 4 DATA SEQUENCE EIPKPVAPAP DILRCAYAEL VVTDLAKSRN FYVDVLGLHV SYEDENQIYL DATA SEQUENCE RSFEEFIHHN LVLTKGPVAA LKAMAFRVRT PEDVDKAEAY YQELGCRTER DATA SEQUENCE RKDGFVKGIG DALRVEDPLG FPYEFFFETT HVERLHMRYD LYSAGELVRL DATA SEQUENCE DHFNQVTPDV PRGRKYLEDL GFRVTEDIQD DEGTTYAAWM HRKGTVHDTA DATA SEQUENCE LTGGNGPRLH HVAFSTHEKH NIIQICDKMG ALRISDRIER GPGRHGVSNA DATA SEQUENCE FYLYILDPDN HRIEIYTQDY YTGDPDNPTI TWNVHDNQRR DWWGNPVVPS DATA SEQUENCE WYTEASKVLD LDGNVQEIIE RTDDSELEVT IGADGFSFTR AGDEDGSYHG DATA SEQUENCE QASKGFKLG VARS RESID RESNAME ATOMNAME SS_SHIFT SHIFT RC_SHIFT HM_SHIFT EF_SHIFT SIGMA FORMAT %4d %4s %4s %9.3f %9.3f %9.3f %9.3f %9.3f %9.3f 4 E HA 0.000 4.350 4.350 -0.000 0.000 0.291 4 E C 0.000 176.588 176.600 -0.021 0.000 1.382 4 E CA 0.000 56.392 56.400 -0.013 0.000 0.976 4 E CB 0.000 29.696 29.700 -0.006 0.000 0.812 5 I N 5.683 126.246 120.570 -0.012 0.000 2.337 5 I HA 0.244 4.399 4.170 -0.024 0.000 0.291 5 I C -1.877 174.235 176.117 -0.008 0.000 1.046 5 I CA -1.600 59.687 61.300 -0.023 0.000 1.324 5 I CB 0.601 38.588 38.000 -0.022 0.000 1.409 5 I HN 0.214 8.424 8.210 -0.000 0.000 0.494 6 P HA 0.020 4.440 4.420 -0.000 0.000 0.271 6 P C -0.790 176.473 177.300 -0.062 0.000 1.218 6 P CA -0.533 62.539 63.100 -0.047 0.000 0.780 6 P CB 0.744 32.404 31.700 -0.067 0.000 0.901 7 K N 4.022 124.394 120.400 -0.046 0.000 2.349 7 K HA 0.259 4.564 4.320 -0.024 0.000 0.289 7 K C -2.082 174.446 176.600 -0.121 0.000 1.064 7 K CA -1.597 54.659 56.287 -0.052 0.000 0.947 7 K CB -0.426 32.071 32.500 -0.004 0.000 1.007 7 K HN 0.283 8.533 8.250 -0.000 0.000 0.478 8 P HA -0.084 4.336 4.420 -0.000 0.000 0.269 8 P C 0.515 177.736 177.300 -0.132 0.000 1.217 8 P CA -0.463 62.456 63.100 -0.302 0.000 0.783 8 P CB 0.742 32.018 31.700 -0.707 0.000 0.898 9 V N 0.544 120.401 119.914 -0.096 0.000 2.453 9 V HA -0.121 3.985 4.120 -0.024 0.000 0.247 9 V C 1.231 177.320 176.094 -0.008 0.000 1.048 9 V CA 1.670 63.947 62.300 -0.040 0.000 1.049 9 V CB -1.226 30.576 31.823 -0.034 0.000 0.672 9 V HN 0.672 8.862 8.190 -0.000 0.000 0.457 10 A N 2.500 125.310 122.820 -0.017 0.000 2.511 10 A HA 0.342 4.647 4.320 -0.024 0.000 0.242 10 A C -1.951 175.738 177.584 0.174 0.000 1.069 10 A CA -0.766 51.304 52.037 0.055 0.000 0.763 10 A CB -0.484 18.546 19.000 0.049 0.000 1.001 10 A HN 0.321 8.471 8.150 -0.000 0.000 0.498 11 P HA 0.313 4.733 4.420 -0.000 0.000 0.271 11 P C -0.084 177.233 177.300 0.029 0.000 1.218 11 P CA 0.044 63.191 63.100 0.078 0.000 0.780 11 P CB 0.878 32.582 31.700 0.007 0.000 0.901 12 A N 5.177 127.894 122.820 -0.173 0.000 2.386 12 A HA 0.435 4.741 4.320 -0.024 0.000 0.248 12 A C -1.900 175.438 177.584 -0.410 0.000 1.082 12 A CA -1.236 50.405 52.037 -0.660 0.000 0.789 12 A CB -1.209 17.361 19.000 -0.717 0.000 1.025 12 A HN 0.463 8.613 8.150 -0.000 0.000 0.490 13 P HA 0.077 4.497 4.420 -0.000 0.000 0.272 13 P C -0.911 176.233 177.300 -0.261 0.000 1.223 13 P CA -0.146 62.771 63.100 -0.305 0.000 0.784 13 P CB 0.553 32.026 31.700 -0.378 0.000 0.923 14 D N 2.558 122.852 120.400 -0.176 0.000 2.402 14 D HA 0.183 4.808 4.640 -0.024 0.000 0.235 14 D C -0.128 176.094 176.300 -0.131 0.000 1.226 14 D CA -0.260 53.645 54.000 -0.158 0.000 0.918 14 D CB -0.639 40.092 40.800 -0.114 0.000 1.043 14 D HN 0.193 8.563 8.370 -0.000 0.000 0.506 15 I N 4.772 125.229 120.570 -0.187 0.000 2.416 15 I HA 0.034 4.189 4.170 -0.024 0.000 0.288 15 I C 1.614 177.648 176.117 -0.138 0.000 1.051 15 I CA -0.532 60.681 61.300 -0.144 0.000 1.375 15 I CB 1.461 39.294 38.000 -0.279 0.000 1.407 15 I HN 0.320 8.530 8.210 -0.000 0.000 0.516 16 L N 6.163 127.357 121.223 -0.047 0.000 2.102 16 L HA 0.124 4.450 4.340 -0.024 0.000 0.202 16 L C 0.731 177.597 176.870 -0.006 0.000 1.076 16 L CA 0.820 55.648 54.840 -0.020 0.000 0.761 16 L CB -0.176 41.895 42.059 0.019 0.000 0.921 16 L HN 0.706 8.936 8.230 -0.000 0.000 0.444 17 R N -1.444 119.080 120.500 0.041 0.000 3.033 17 R HA 0.236 4.561 4.340 -0.024 0.000 0.284 17 R C -0.871 175.516 176.300 0.146 0.000 0.997 17 R CA -0.826 55.321 56.100 0.077 0.000 0.851 17 R CB 0.059 30.371 30.300 0.019 0.000 1.297 17 R HN 0.047 8.317 8.270 -0.000 0.000 0.518 18 C N 0.230 119.561 119.300 0.051 0.000 2.657 18 C HA 0.716 5.161 4.460 -0.024 0.000 0.420 18 C C 1.299 176.153 174.990 -0.226 0.000 1.323 18 C CA 0.360 59.198 59.018 -0.299 0.000 1.894 18 C CB 0.216 27.430 27.740 -0.877 0.000 2.681 18 C HN 0.945 9.175 8.230 -0.000 0.000 0.613 19 A N 2.388 125.124 122.820 -0.140 0.000 1.933 19 A HA 0.597 4.903 4.320 -0.024 0.000 0.198 19 A C 0.224 177.920 177.584 0.187 0.000 1.617 19 A CA 0.636 52.712 52.037 0.065 0.000 1.039 19 A CB 0.117 19.296 19.000 0.298 0.000 1.066 19 A HN 1.697 9.847 8.150 -0.000 0.000 0.484 20 Y N -3.245 117.102 120.300 0.079 0.000 2.677 20 Y HA 0.722 5.258 4.550 -0.023 0.000 0.334 20 Y C -0.861 175.101 175.900 0.103 0.000 1.196 20 Y CA -1.213 56.952 58.100 0.107 0.000 1.059 20 Y CB 0.517 39.076 38.460 0.165 0.000 1.315 20 Y HN 0.427 8.707 8.280 -0.000 0.000 0.455 21 A N 1.661 124.575 122.820 0.157 0.000 2.350 21 A HA 0.625 4.930 4.320 -0.024 0.000 0.324 21 A C -1.236 176.371 177.584 0.038 0.000 1.118 21 A CA -0.771 51.198 52.037 -0.113 0.000 0.783 21 A CB 1.534 20.478 19.000 -0.094 0.000 1.236 21 A HN 0.782 8.932 8.150 -0.000 0.000 0.457 22 E N 2.592 122.743 120.200 -0.082 0.000 2.092 22 E HA 0.527 4.863 4.350 -0.024 0.000 0.271 22 E C -1.442 175.071 176.600 -0.145 0.000 0.919 22 E CA -0.276 56.089 56.400 -0.059 0.000 0.760 22 E CB 0.608 30.304 29.700 -0.007 0.000 1.106 22 E HN 0.634 8.994 8.360 -0.000 0.000 0.408 23 L N 4.430 125.557 121.223 -0.160 0.000 2.317 23 L HA 0.430 4.755 4.340 -0.024 0.000 0.281 23 L C -0.395 176.425 176.870 -0.084 0.000 1.024 23 L CA -1.174 53.549 54.840 -0.195 0.000 0.810 23 L CB 1.850 43.753 42.059 -0.261 0.000 1.240 23 L HN 0.346 8.576 8.230 -0.000 0.000 0.427 24 V N 3.847 123.752 119.914 -0.015 0.000 2.498 24 V HA 0.339 4.444 4.120 -0.024 0.000 0.279 24 V C 0.175 176.358 176.094 0.148 0.000 1.048 24 V CA -0.500 61.825 62.300 0.042 0.000 0.967 24 V CB 1.522 33.361 31.823 0.027 0.000 0.988 24 V HN 0.550 8.740 8.190 -0.000 0.000 0.473 25 V N 1.812 121.778 119.914 0.086 0.000 2.914 25 V HA 0.651 4.756 4.120 -0.024 0.000 0.314 25 V C 0.679 176.788 176.094 0.025 0.000 1.084 25 V CA 0.171 62.518 62.300 0.079 0.000 0.963 25 V CB 1.760 33.645 31.823 0.103 0.000 1.025 25 V HN 0.842 9.032 8.190 -0.000 0.000 0.432 26 T N -2.205 112.348 114.554 -0.002 0.000 3.044 26 T HA 0.169 4.504 4.350 -0.024 0.000 0.255 26 T C 0.394 175.090 174.700 -0.006 0.000 1.073 26 T CA 1.097 63.190 62.100 -0.012 0.000 1.125 26 T CB -0.064 68.785 68.868 -0.032 0.000 0.908 26 T HN 0.810 9.050 8.240 -0.000 0.000 0.480 27 D N 0.367 120.767 120.400 -0.001 0.000 2.389 27 D HA 0.267 4.892 4.640 -0.024 0.000 0.256 27 D C 0.668 176.981 176.300 0.022 0.000 1.239 27 D CA -0.590 53.412 54.000 0.005 0.000 0.925 27 D CB 1.477 42.275 40.800 -0.005 0.000 1.145 27 D HN 0.016 8.386 8.370 -0.000 0.000 0.542 28 L N 4.166 125.403 121.223 0.024 0.000 2.042 28 L HA -0.088 4.238 4.340 -0.024 0.000 0.210 28 L C 2.208 179.105 176.870 0.045 0.000 1.076 28 L CA 2.424 57.285 54.840 0.035 0.000 0.749 28 L CB -0.358 41.714 42.059 0.021 0.000 0.893 28 L HN 0.506 8.736 8.230 -0.000 0.000 0.432 29 A N -0.884 121.954 122.820 0.031 0.000 1.883 29 A HA -0.246 4.059 4.320 -0.024 0.000 0.217 29 A C 2.335 179.946 177.584 0.046 0.000 1.186 29 A CA 1.998 54.054 52.037 0.032 0.000 0.624 29 A CB -0.502 18.508 19.000 0.018 0.000 0.822 29 A HN 0.475 8.625 8.150 -0.000 0.000 0.444 30 K N -0.126 120.298 120.400 0.040 0.000 2.097 30 K HA -0.068 4.238 4.320 -0.024 0.000 0.205 30 K C 2.336 178.987 176.600 0.084 0.000 1.050 30 K CA 1.442 57.755 56.287 0.043 0.000 0.938 30 K CB -0.197 32.310 32.500 0.012 0.000 0.718 30 K HN 0.450 8.700 8.250 -0.000 0.000 0.442 31 S N 0.928 116.696 115.700 0.114 0.000 2.368 31 S HA -0.125 4.331 4.470 -0.024 0.000 0.224 31 S C 1.894 176.685 174.600 0.318 0.000 1.029 31 S CA 0.937 59.280 58.200 0.238 0.000 0.988 31 S CB -0.147 63.201 63.200 0.248 0.000 0.838 31 S HN 0.294 8.604 8.310 -0.000 0.000 0.462 32 R N 1.846 122.458 120.500 0.187 0.000 2.083 32 R HA -0.129 4.197 4.340 -0.024 0.000 0.237 32 R C 2.339 178.709 176.300 0.117 0.000 1.137 32 R CA 1.591 57.778 56.100 0.145 0.000 0.951 32 R CB -0.436 29.908 30.300 0.072 0.000 0.851 32 R HN 0.467 8.737 8.270 -0.000 0.000 0.434 33 N N -0.310 118.446 118.700 0.092 0.000 2.069 33 N HA -0.234 4.491 4.740 -0.024 0.000 0.191 33 N C 1.793 177.333 175.510 0.050 0.000 1.031 33 N CA 1.557 54.640 53.050 0.055 0.000 0.852 33 N CB -0.167 38.350 38.487 0.051 0.000 1.018 33 N HN 0.168 8.548 8.380 -0.000 0.000 0.423 34 F N 0.896 120.793 119.950 -0.087 0.000 2.051 34 F HA -0.169 4.344 4.527 -0.024 0.000 0.296 34 F C 1.844 177.490 175.800 -0.256 0.000 1.122 34 F CA 1.571 59.438 58.000 -0.222 0.000 1.201 34 F CB -0.688 38.090 39.000 -0.371 0.000 0.978 34 F HN 0.055 8.355 8.300 -0.000 0.000 0.472 35 Y N -0.882 119.446 120.300 0.046 0.000 2.286 35 Y HA -0.086 4.449 4.550 -0.025 0.000 0.293 35 Y C 2.300 178.088 175.900 -0.187 0.000 1.124 35 Y CA 1.386 59.425 58.100 -0.102 0.000 1.178 35 Y CB -0.777 37.698 38.460 0.025 0.000 1.010 35 Y HN -0.092 8.188 8.280 -0.000 0.000 0.536 36 V N -0.532 119.397 119.914 0.025 0.000 2.341 36 V HA -0.147 3.959 4.120 -0.024 0.000 0.240 36 V C 1.646 177.671 176.094 -0.116 0.000 1.035 36 V CA 1.736 63.998 62.300 -0.062 0.000 1.033 36 V CB -0.402 31.407 31.823 -0.024 0.000 0.678 36 V HN 0.241 8.431 8.190 -0.000 0.000 0.464 37 D N 0.236 120.583 120.400 -0.089 0.000 2.123 37 D HA -0.076 4.549 4.640 -0.024 0.000 0.200 37 D C 2.126 178.337 176.300 -0.149 0.000 0.976 37 D CA 1.154 55.095 54.000 -0.098 0.000 0.831 37 D CB -0.051 40.715 40.800 -0.057 0.000 0.974 37 D HN 0.296 8.666 8.370 -0.000 0.000 0.469 38 V N 0.953 120.739 119.914 -0.214 0.000 2.273 38 V HA -0.098 4.008 4.120 -0.024 0.000 0.242 38 V C 2.499 178.388 176.094 -0.343 0.000 1.035 38 V CA 0.997 63.122 62.300 -0.291 0.000 1.013 38 V CB -0.326 31.250 31.823 -0.412 0.000 0.652 38 V HN 0.122 8.312 8.190 -0.000 0.000 0.452 39 L N 0.252 121.215 121.223 -0.434 0.000 2.446 39 L HA 0.287 4.612 4.340 -0.024 0.000 0.219 39 L C 1.755 178.433 176.870 -0.319 0.000 1.116 39 L CA 0.904 55.504 54.840 -0.399 0.000 0.844 39 L CB -0.517 41.261 42.059 -0.467 0.000 0.970 39 L HN 0.613 8.843 8.230 -0.000 0.000 0.457 40 G N 1.020 109.646 108.800 -0.290 0.000 2.160 40 G HA2 -0.283 3.663 3.960 -0.024 0.000 0.251 40 G HA3 -0.283 3.663 3.960 -0.024 0.000 0.251 40 G C 0.215 174.843 174.900 -0.454 0.000 1.008 40 G CA -0.099 44.807 45.100 -0.323 0.000 0.724 40 G HN 0.210 8.500 8.290 -0.000 0.000 0.514 41 L N 0.849 121.860 121.223 -0.355 0.000 2.467 41 L HA 0.325 4.650 4.340 -0.024 0.000 0.270 41 L C 1.089 177.735 176.870 -0.374 0.000 1.205 41 L CA -0.530 54.108 54.840 -0.335 0.000 0.828 41 L CB 0.389 42.322 42.059 -0.210 0.000 1.101 41 L HN 0.233 8.463 8.230 -0.000 0.000 0.479 42 H N 1.304 120.366 119.070 -0.014 0.000 2.473 42 H HA 0.260 4.801 4.556 -0.024 0.000 0.327 42 H C -0.659 174.672 175.328 0.006 0.000 1.105 42 H CA -0.740 55.314 56.048 0.009 0.000 1.280 42 H CB 1.648 31.431 29.762 0.035 0.000 1.450 42 H HN 0.202 8.482 8.280 -0.000 0.000 0.492 43 V N 3.044 123.018 119.914 0.101 0.000 2.408 43 V HA -0.019 4.086 4.120 -0.024 0.000 0.267 43 V C 1.005 177.135 176.094 0.060 0.000 1.047 43 V CA 0.069 62.409 62.300 0.066 0.000 0.937 43 V CB 1.159 33.003 31.823 0.035 0.000 0.999 43 V HN 0.831 9.021 8.190 -0.000 0.000 0.472 44 S N 3.345 119.071 115.700 0.042 0.000 2.458 44 S HA 0.174 4.629 4.470 -0.024 0.000 0.223 44 S C -0.144 174.512 174.600 0.093 0.000 1.019 44 S CA 0.477 58.646 58.200 -0.052 0.000 0.937 44 S CB 0.035 63.011 63.200 -0.373 0.000 0.788 44 S HN 0.751 9.061 8.310 -0.000 0.000 0.511 45 Y N 0.904 121.215 120.300 0.018 0.000 2.522 45 Y HA 0.365 4.901 4.550 -0.025 0.000 0.326 45 Y C -1.893 174.089 175.900 0.137 0.000 1.198 45 Y CA -1.095 57.024 58.100 0.032 0.000 1.112 45 Y CB 0.673 39.073 38.460 -0.100 0.000 1.342 45 Y HN 0.183 8.463 8.280 -0.000 0.000 0.460 46 E N 3.178 123.033 120.200 -0.574 0.000 2.392 46 E HA 0.615 4.951 4.350 -0.024 0.000 0.279 46 E C -1.934 174.379 176.600 -0.478 0.000 0.964 46 E CA -0.882 55.350 56.400 -0.280 0.000 0.777 46 E CB 3.057 32.697 29.700 -0.101 0.000 1.249 46 E HN 0.480 8.840 8.360 -0.000 0.000 0.449 47 D N 0.208 120.530 120.400 -0.129 0.000 3.096 47 D HA 0.093 4.718 4.640 -0.024 0.000 0.277 47 D C 0.753 177.050 176.300 -0.005 0.000 1.256 47 D CA -0.437 53.526 54.000 -0.062 0.000 1.044 47 D CB -0.048 40.787 40.800 0.058 0.000 1.318 47 D HN 0.456 8.826 8.370 -0.000 0.000 0.622 48 E N -0.274 119.936 120.200 0.017 0.000 2.358 48 E HA -0.048 4.287 4.350 -0.024 0.000 0.195 48 E C 0.282 176.898 176.600 0.026 0.000 1.010 48 E CA 0.748 57.158 56.400 0.016 0.000 0.856 48 E CB -0.339 29.370 29.700 0.016 0.000 0.795 48 E HN 0.405 8.765 8.360 -0.000 0.000 0.504 49 N N 0.254 118.981 118.700 0.044 0.000 2.332 49 N HA 0.076 4.801 4.740 -0.024 0.000 0.190 49 N C -0.018 175.511 175.510 0.031 0.000 1.117 49 N CA 0.175 53.247 53.050 0.038 0.000 0.883 49 N CB 0.899 39.413 38.487 0.045 0.000 1.089 49 N HN 0.178 8.558 8.380 -0.000 0.000 0.480 50 Q N 0.525 120.363 119.800 0.062 0.000 2.315 50 Q HA 0.525 4.850 4.340 -0.024 0.000 0.273 50 Q C -1.134 174.904 176.000 0.064 0.000 1.053 50 Q CA -0.350 55.466 55.803 0.021 0.000 0.817 50 Q CB 2.954 31.728 28.738 0.060 0.000 1.326 50 Q HN 0.046 8.316 8.270 -0.000 0.000 0.423 51 I N 2.357 122.898 120.570 -0.049 0.000 2.362 51 I HA 0.346 4.501 4.170 -0.024 0.000 0.289 51 I C -1.103 174.960 176.117 -0.090 0.000 0.994 51 I CA -0.745 60.562 61.300 0.012 0.000 1.158 51 I CB 0.886 38.882 38.000 -0.007 0.000 1.315 51 I HN 0.516 8.726 8.210 -0.000 0.000 0.451 52 Y N 6.704 127.000 120.300 -0.006 0.000 2.335 52 Y HA 0.614 5.150 4.550 -0.024 0.000 0.339 52 Y C -0.203 175.681 175.900 -0.028 0.000 0.987 52 Y CA -0.637 57.435 58.100 -0.048 0.000 1.140 52 Y CB 1.229 39.716 38.460 0.045 0.000 1.173 52 Y HN 0.315 8.595 8.280 -0.000 0.000 0.486 53 L N 5.108 126.384 121.223 0.089 0.000 2.381 53 L HA 0.711 5.037 4.340 -0.024 0.000 0.268 53 L C -0.581 176.359 176.870 0.117 0.000 0.997 53 L CA -1.057 53.823 54.840 0.067 0.000 0.818 53 L CB 2.395 44.447 42.059 -0.012 0.000 1.310 53 L HN 0.647 8.877 8.230 -0.000 0.000 0.416 54 R N 0.350 120.918 120.500 0.113 0.000 2.867 54 R HA 0.777 5.102 4.340 -0.024 0.000 0.268 54 R C -0.692 175.718 176.300 0.183 0.000 1.014 54 R CA -0.735 55.446 56.100 0.136 0.000 0.946 54 R CB 1.779 32.118 30.300 0.065 0.000 1.208 54 R HN 0.608 8.878 8.270 -0.000 0.000 0.477 55 S N 0.402 116.222 115.700 0.200 0.000 2.669 55 S HA 0.166 4.622 4.470 -0.024 0.000 0.270 55 S C 0.629 175.388 174.600 0.265 0.000 1.225 55 S CA -0.789 57.553 58.200 0.236 0.000 0.991 55 S CB 0.476 63.836 63.200 0.267 0.000 0.987 55 S HN 0.600 8.910 8.310 -0.000 0.000 0.552 56 F N 1.221 121.240 119.950 0.114 0.000 2.161 56 F HA -0.047 4.465 4.527 -0.025 0.000 0.300 56 F C 2.058 177.884 175.800 0.043 0.000 1.089 56 F CA 1.791 59.810 58.000 0.032 0.000 1.282 56 F CB -0.310 38.742 39.000 0.088 0.000 1.010 56 F HN 0.767 9.067 8.300 -0.000 0.000 0.485 57 E N -0.684 119.600 120.200 0.139 0.000 2.481 57 E HA -0.005 4.330 4.350 -0.024 0.000 0.198 57 E C 0.134 176.762 176.600 0.047 0.000 1.027 57 E CA -0.170 56.270 56.400 0.065 0.000 0.900 57 E CB 0.172 29.973 29.700 0.168 0.000 0.993 57 E HN 0.177 8.537 8.360 -0.000 0.000 0.482 58 E N 0.337 120.563 120.200 0.044 0.000 2.331 58 E HA 0.027 4.363 4.350 -0.024 0.000 0.272 58 E C 0.055 176.667 176.600 0.019 0.000 1.036 58 E CA -0.205 56.204 56.400 0.015 0.000 0.864 58 E CB 0.444 30.137 29.700 -0.012 0.000 1.035 58 E HN 0.124 8.484 8.360 -0.000 0.000 0.408 59 F N 4.275 124.154 119.950 -0.120 0.000 2.727 59 F HA 0.323 4.835 4.527 -0.024 0.000 0.302 59 F C 0.551 176.246 175.800 -0.174 0.000 1.107 59 F CA -0.670 57.233 58.000 -0.162 0.000 1.277 59 F CB -0.512 38.347 39.000 -0.234 0.000 1.079 59 F HN 0.377 8.677 8.300 -0.000 0.000 0.594 60 I N -0.806 119.202 120.570 -0.936 0.000 3.079 60 I HA 0.138 4.294 4.170 -0.024 0.000 0.295 60 I C 2.113 178.070 176.117 -0.267 0.000 1.094 60 I CA -0.411 60.524 61.300 -0.608 0.000 1.295 60 I CB 0.296 37.950 38.000 -0.577 0.000 1.443 60 I HN 0.118 8.328 8.210 -0.000 0.000 0.607 61 H N 2.167 121.067 119.070 -0.282 0.000 2.352 61 H HA -0.130 4.412 4.556 -0.025 0.000 0.299 61 H C -0.181 175.111 175.328 -0.060 0.000 1.097 61 H CA 2.079 58.030 56.048 -0.162 0.000 1.311 61 H CB 0.145 29.822 29.762 -0.142 0.000 1.377 61 H HN 0.818 9.098 8.280 -0.000 0.000 0.504 62 H N -3.126 115.902 119.070 -0.071 0.000 3.037 62 H HA 0.152 4.693 4.556 -0.025 0.000 0.336 62 H C -0.691 174.650 175.328 0.021 0.000 1.323 62 H CA -0.573 55.450 56.048 -0.042 0.000 1.159 62 H CB 0.415 30.204 29.762 0.045 0.000 1.882 62 H HN 0.038 8.318 8.280 -0.000 0.000 0.535 63 N N -0.245 118.606 118.700 0.251 0.000 2.227 63 N HA 0.206 4.931 4.740 -0.024 0.000 0.196 63 N C -0.666 175.068 175.510 0.374 0.000 1.142 63 N CA 0.028 53.254 53.050 0.293 0.000 0.887 63 N CB 1.062 39.740 38.487 0.319 0.000 1.022 63 N HN 0.251 8.631 8.380 -0.000 0.000 0.500 64 L N 0.813 122.227 121.223 0.318 0.000 2.588 64 L HA 0.436 4.761 4.340 -0.024 0.000 0.263 64 L C -1.837 174.996 176.870 -0.062 0.000 0.935 64 L CA -0.714 54.224 54.840 0.164 0.000 0.891 64 L CB 1.910 44.043 42.059 0.124 0.000 1.318 64 L HN -0.299 7.931 8.230 -0.000 0.000 0.409 65 V N 5.812 125.620 119.914 -0.176 0.000 2.409 65 V HA 0.501 4.606 4.120 -0.024 0.000 0.291 65 V C -0.207 175.685 176.094 -0.336 0.000 1.020 65 V CA -0.547 61.462 62.300 -0.484 0.000 0.848 65 V CB 1.602 33.013 31.823 -0.687 0.000 0.990 65 V HN 0.577 8.767 8.190 -0.000 0.000 0.430 66 L N 4.389 125.415 121.223 -0.328 0.000 2.264 66 L HA 0.564 4.889 4.340 -0.024 0.000 0.289 66 L C 0.168 176.932 176.870 -0.177 0.000 1.044 66 L CA -0.040 54.675 54.840 -0.208 0.000 0.807 66 L CB 1.393 43.362 42.059 -0.149 0.000 1.192 66 L HN 0.563 8.793 8.230 -0.000 0.000 0.425 67 T N 3.049 117.532 114.554 -0.119 0.000 2.786 67 T HA 0.194 4.529 4.350 -0.024 0.000 0.283 67 T C -0.048 174.635 174.700 -0.029 0.000 0.992 67 T CA -0.643 61.408 62.100 -0.081 0.000 0.954 67 T CB 1.469 70.290 68.868 -0.080 0.000 0.934 67 T HN 0.400 8.640 8.240 -0.000 0.000 0.440 68 K N 2.242 122.633 120.400 -0.014 0.000 2.489 68 K HA 0.431 4.736 4.320 -0.024 0.000 0.278 68 K C 0.240 176.841 176.600 0.002 0.000 1.000 68 K CA 0.131 56.419 56.287 0.001 0.000 1.012 68 K CB 0.181 32.685 32.500 0.006 0.000 0.903 68 K HN 0.881 9.131 8.250 -0.000 0.000 0.485 69 G N 3.316 112.118 108.800 0.004 0.000 2.523 69 G HA2 0.240 4.185 3.960 -0.024 0.000 0.291 69 G HA3 0.240 4.185 3.960 -0.024 0.000 0.291 69 G C -2.488 172.411 174.900 -0.002 0.000 1.450 69 G CA -0.882 44.219 45.100 0.002 0.000 0.790 69 G HN 0.403 8.693 8.290 -0.000 0.000 0.496 70 P HA 0.081 4.501 4.420 -0.000 0.000 0.220 70 P C 0.356 177.647 177.300 -0.015 0.000 1.152 70 P CA 0.716 63.810 63.100 -0.010 0.000 0.812 70 P CB 0.433 32.127 31.700 -0.010 0.000 0.792 71 V N 0.395 120.302 119.914 -0.012 0.000 2.443 71 V HA 0.548 4.653 4.120 -0.024 0.000 0.293 71 V C 0.168 176.263 176.094 0.001 0.000 1.021 71 V CA -1.547 60.744 62.300 -0.016 0.000 0.848 71 V CB 1.156 32.968 31.823 -0.019 0.000 0.998 71 V HN 0.097 8.287 8.190 -0.000 0.000 0.424 72 A N 3.913 126.727 122.820 -0.010 0.000 2.520 72 A HA 0.748 5.053 4.320 -0.024 0.000 0.245 72 A C 0.504 178.162 177.584 0.123 0.000 1.072 72 A CA 0.849 52.906 52.037 0.033 0.000 0.761 72 A CB 0.057 18.957 19.000 -0.168 0.000 1.004 72 A HN 1.948 10.098 8.150 -0.000 0.000 0.499 73 A N 1.807 124.771 122.820 0.241 0.000 2.567 73 A HA 0.536 4.841 4.320 -0.024 0.000 0.291 73 A C -1.030 176.551 177.584 -0.005 0.000 1.048 73 A CA -0.622 51.500 52.037 0.141 0.000 0.661 73 A CB 0.255 19.271 19.000 0.028 0.000 1.288 73 A HN 1.917 10.067 8.150 -0.000 0.000 0.424 74 L N 0.892 122.067 121.223 -0.080 0.000 2.361 74 L HA 0.499 4.825 4.340 -0.024 0.000 0.278 74 L C 1.111 177.910 176.870 -0.118 0.000 1.113 74 L CA 0.555 55.304 54.840 -0.152 0.000 0.849 74 L CB 0.529 42.510 42.059 -0.130 0.000 1.155 74 L HN 0.868 9.098 8.230 -0.000 0.000 0.452 75 K N 4.036 124.356 120.400 -0.134 0.000 2.242 75 K HA 0.466 4.771 4.320 -0.024 0.000 0.200 75 K C -0.159 176.348 176.600 -0.156 0.000 1.050 75 K CA 0.663 56.879 56.287 -0.118 0.000 0.981 75 K CB 0.352 32.797 32.500 -0.092 0.000 0.795 75 K HN 0.754 9.004 8.250 -0.000 0.000 0.477 76 A N 0.825 123.521 122.820 -0.206 0.000 2.555 76 A HA 0.478 4.783 4.320 -0.024 0.000 0.297 76 A C -1.505 175.808 177.584 -0.452 0.000 1.060 76 A CA -0.799 51.070 52.037 -0.281 0.000 0.710 76 A CB 1.019 19.846 19.000 -0.287 0.000 1.282 76 A HN 0.147 8.297 8.150 -0.000 0.000 0.399 77 M N 2.117 121.385 119.600 -0.554 0.000 2.129 77 M HA 0.592 5.057 4.480 -0.024 0.000 0.348 77 M C 0.203 175.911 176.300 -0.986 0.000 1.116 77 M CA -0.078 54.588 55.300 -1.057 0.000 1.022 77 M CB 1.819 33.657 32.600 -1.269 0.000 1.599 77 M HN 0.900 9.190 8.290 -0.000 0.000 0.449 78 A N 3.873 126.078 122.820 -1.025 0.000 2.317 78 A HA 0.891 5.196 4.320 -0.024 0.000 0.327 78 A C -1.278 175.932 177.584 -0.624 0.000 1.178 78 A CA -0.469 51.108 52.037 -0.765 0.000 0.817 78 A CB 0.520 18.893 19.000 -1.045 0.000 1.189 78 A HN 0.734 8.884 8.150 -0.000 0.000 0.489 79 F N 0.851 120.614 119.950 -0.313 0.000 2.495 79 F HA 0.588 5.100 4.527 -0.025 0.000 0.327 79 F C 0.649 176.271 175.800 -0.297 0.000 1.103 79 F CA -0.518 57.357 58.000 -0.208 0.000 0.949 79 F CB 1.936 40.809 39.000 -0.212 0.000 1.142 79 F HN 0.658 8.958 8.300 -0.000 0.000 0.457 80 R N 2.095 122.461 120.500 -0.222 0.000 2.410 80 R HA 0.721 5.046 4.340 -0.024 0.000 0.288 80 R C -1.015 175.186 176.300 -0.166 0.000 1.051 80 R CA -0.587 55.149 56.100 -0.607 0.000 1.021 80 R CB 1.147 31.125 30.300 -0.537 0.000 1.032 80 R HN 0.626 8.896 8.270 -0.000 0.000 0.481 81 V N 1.372 121.224 119.914 -0.103 0.000 3.096 81 V HA 0.456 4.562 4.120 -0.024 0.000 0.319 81 V C 1.155 177.309 176.094 0.100 0.000 1.103 81 V CA -0.898 61.423 62.300 0.036 0.000 1.016 81 V CB 1.779 33.646 31.823 0.074 0.000 1.090 81 V HN 0.922 9.112 8.190 -0.000 0.000 0.449 82 R N 0.570 121.086 120.500 0.027 0.000 2.092 82 R HA 0.046 4.371 4.340 -0.024 0.000 0.231 82 R C 0.838 177.040 176.300 -0.164 0.000 1.119 82 R CA 1.681 57.788 56.100 0.011 0.000 0.970 82 R CB -0.023 30.255 30.300 -0.037 0.000 0.864 82 R HN 1.059 9.329 8.270 -0.000 0.000 0.440 83 T N -4.914 109.463 114.554 -0.296 0.000 2.864 83 T HA 0.372 4.707 4.350 -0.024 0.000 0.299 83 T C -2.437 171.992 174.700 -0.452 0.000 1.166 83 T CA -1.917 59.811 62.100 -0.619 0.000 1.007 83 T CB 2.199 70.863 68.868 -0.339 0.000 1.219 83 T HN -0.242 7.998 8.240 -0.000 0.000 0.506 84 P HA -0.116 4.304 4.420 -0.000 0.000 0.216 84 P C 1.472 178.757 177.300 -0.024 0.000 1.150 84 P CA 1.391 64.445 63.100 -0.076 0.000 0.837 84 P CB 0.005 31.689 31.700 -0.027 0.000 0.786 85 E N -0.120 120.035 120.200 -0.074 0.000 2.204 85 E HA -0.224 4.111 4.350 -0.024 0.000 0.195 85 E C 1.183 177.768 176.600 -0.025 0.000 0.990 85 E CA 1.180 57.558 56.400 -0.038 0.000 0.821 85 E CB -0.988 28.680 29.700 -0.055 0.000 0.750 85 E HN 0.240 8.600 8.360 -0.000 0.000 0.477 86 D N 0.853 121.227 120.400 -0.044 0.000 2.310 86 D HA -0.089 4.536 4.640 -0.024 0.000 0.212 86 D C 2.020 178.320 176.300 -0.000 0.000 0.965 86 D CA 0.885 54.860 54.000 -0.041 0.000 0.879 86 D CB 0.350 41.117 40.800 -0.055 0.000 0.921 86 D HN 0.181 8.551 8.370 -0.000 0.000 0.510 87 V N 1.277 121.230 119.914 0.064 0.000 2.453 87 V HA -0.170 3.935 4.120 -0.024 0.000 0.247 87 V C 1.969 178.120 176.094 0.097 0.000 1.048 87 V CA 1.378 63.754 62.300 0.127 0.000 1.049 87 V CB -0.246 31.698 31.823 0.201 0.000 0.672 87 V HN 0.003 8.193 8.190 -0.000 0.000 0.457 88 D N 0.289 120.732 120.400 0.071 0.000 2.117 88 D HA -0.141 4.485 4.640 -0.024 0.000 0.198 88 D C 2.253 178.583 176.300 0.050 0.000 0.982 88 D CA 1.170 55.208 54.000 0.063 0.000 0.828 88 D CB -0.142 40.685 40.800 0.045 0.000 0.967 88 D HN 0.361 8.731 8.370 -0.000 0.000 0.464 89 K N 0.586 120.996 120.400 0.017 0.000 2.063 89 K HA -0.070 4.235 4.320 -0.024 0.000 0.208 89 K C 2.051 178.660 176.600 0.014 0.000 1.048 89 K CA 1.264 57.553 56.287 0.003 0.000 0.928 89 K CB -0.105 32.367 32.500 -0.046 0.000 0.713 89 K HN 0.029 8.279 8.250 -0.000 0.000 0.442 90 A N 0.981 123.778 122.820 -0.037 0.000 1.972 90 A HA -0.226 4.079 4.320 -0.024 0.000 0.219 90 A C 2.067 179.764 177.584 0.188 0.000 1.169 90 A CA 1.632 53.635 52.037 -0.056 0.000 0.635 90 A CB -0.372 18.443 19.000 -0.309 0.000 0.810 90 A HN 0.399 8.549 8.150 -0.000 0.000 0.446 91 E N -0.160 120.132 120.200 0.152 0.000 2.028 91 E HA -0.079 4.256 4.350 -0.024 0.000 0.191 91 E C 2.231 178.938 176.600 0.179 0.000 0.988 91 E CA 0.914 57.423 56.400 0.182 0.000 0.799 91 E CB -0.264 29.520 29.700 0.140 0.000 0.755 91 E HN 0.509 8.869 8.360 -0.000 0.000 0.447 92 A N 0.527 123.427 122.820 0.133 0.000 1.892 92 A HA -0.251 4.054 4.320 -0.024 0.000 0.218 92 A C 2.087 179.741 177.584 0.116 0.000 1.188 92 A CA 1.787 53.886 52.037 0.103 0.000 0.631 92 A CB -1.161 17.884 19.000 0.076 0.000 0.822 92 A HN 0.578 8.728 8.150 -0.000 0.000 0.447 93 Y N -1.209 119.092 120.300 0.002 0.000 2.097 93 Y HA -0.300 4.236 4.550 -0.024 0.000 0.282 93 Y C 2.276 178.123 175.900 -0.089 0.000 1.152 93 Y CA 2.397 60.450 58.100 -0.079 0.000 1.136 93 Y CB -0.492 37.871 38.460 -0.161 0.000 0.975 93 Y HN 0.396 8.676 8.280 -0.000 0.000 0.498 94 Y N -0.009 120.409 120.300 0.196 0.000 2.373 94 Y HA -0.197 4.336 4.550 -0.028 0.000 0.293 94 Y C 2.537 178.462 175.900 0.042 0.000 1.129 94 Y CA 1.529 59.707 58.100 0.130 0.000 1.226 94 Y CB -0.356 38.216 38.460 0.188 0.000 1.000 94 Y HN 0.243 8.523 8.280 -0.000 0.000 0.549 95 Q N -0.082 119.823 119.800 0.175 0.000 2.079 95 Q HA -0.230 4.096 4.340 -0.024 0.000 0.200 95 Q C 2.127 178.138 176.000 0.017 0.000 0.974 95 Q CA 1.486 57.343 55.803 0.090 0.000 0.840 95 Q CB -0.122 28.665 28.738 0.081 0.000 0.898 95 Q HN 0.527 8.797 8.270 -0.000 0.000 0.430 96 E N 0.274 120.455 120.200 -0.032 0.000 2.118 96 E HA -0.211 4.124 4.350 -0.024 0.000 0.195 96 E C 1.411 177.935 176.600 -0.127 0.000 0.992 96 E CA 0.660 57.003 56.400 -0.096 0.000 0.804 96 E CB 0.151 29.757 29.700 -0.158 0.000 0.741 96 E HN 0.162 8.522 8.360 -0.000 0.000 0.458 97 L N -0.099 121.034 121.223 -0.150 0.000 2.551 97 L HA 0.055 4.381 4.340 -0.024 0.000 0.228 97 L C 1.575 178.415 176.870 -0.051 0.000 1.153 97 L CA 1.620 56.382 54.840 -0.130 0.000 0.851 97 L CB -0.684 41.286 42.059 -0.149 0.000 0.959 97 L HN 0.376 8.606 8.230 -0.000 0.000 0.451 98 G N -1.511 107.280 108.800 -0.015 0.000 2.160 98 G HA2 -0.282 3.663 3.960 -0.024 0.000 0.244 98 G HA3 -0.282 3.663 3.960 -0.024 0.000 0.244 98 G C 0.382 175.295 174.900 0.022 0.000 1.022 98 G CA 0.244 45.344 45.100 -0.001 0.000 0.741 98 G HN 0.344 8.634 8.290 -0.000 0.000 0.508 99 C N 0.311 119.653 119.300 0.070 0.000 2.370 99 C HA 0.609 5.055 4.460 -0.024 0.000 0.354 99 C C 1.316 176.355 174.990 0.081 0.000 1.218 99 C CA -0.970 58.102 59.018 0.089 0.000 2.154 99 C CB 0.926 28.786 27.740 0.199 0.000 2.391 99 C HN 0.548 8.778 8.230 -0.000 0.000 0.540 100 R N 1.835 122.363 120.500 0.047 0.000 2.458 100 R HA 0.244 4.569 4.340 -0.024 0.000 0.303 100 R C 0.436 176.770 176.300 0.057 0.000 1.013 100 R CA 0.606 56.732 56.100 0.043 0.000 1.026 100 R CB 0.392 30.704 30.300 0.019 0.000 0.948 100 R HN 0.945 9.215 8.270 -0.000 0.000 0.417 101 T N -0.053 114.549 114.554 0.080 0.000 2.912 101 T HA 0.449 4.784 4.350 -0.024 0.000 0.288 101 T C -0.509 174.267 174.700 0.126 0.000 1.030 101 T CA -1.024 61.137 62.100 0.102 0.000 1.020 101 T CB 2.527 71.474 68.868 0.131 0.000 1.056 101 T HN 0.338 8.578 8.240 -0.000 0.000 0.480 102 E N 1.240 121.550 120.200 0.183 0.000 2.260 102 E HA 0.391 4.726 4.350 -0.024 0.000 0.266 102 E C -1.142 175.674 176.600 0.361 0.000 0.887 102 E CA -0.783 55.777 56.400 0.267 0.000 0.777 102 E CB 2.776 32.702 29.700 0.376 0.000 1.205 102 E HN 0.620 8.980 8.360 -0.000 0.000 0.414 103 R N 2.460 123.095 120.500 0.226 0.000 2.338 103 R HA 0.361 4.687 4.340 -0.024 0.000 0.317 103 R C -0.795 175.519 176.300 0.023 0.000 0.968 103 R CA -0.371 55.837 56.100 0.180 0.000 0.849 103 R CB 0.674 31.051 30.300 0.128 0.000 1.128 103 R HN 0.273 8.543 8.270 -0.000 0.000 0.448 104 R N 4.649 125.099 120.500 -0.083 0.000 2.435 104 R HA 0.149 4.474 4.340 -0.024 0.000 0.308 104 R C 0.342 176.580 176.300 -0.103 0.000 0.975 104 R CA -0.572 55.371 56.100 -0.262 0.000 0.867 104 R CB 1.568 31.417 30.300 -0.753 0.000 1.171 104 R HN 0.794 9.064 8.270 -0.000 0.000 0.470 105 K N 1.071 121.439 120.400 -0.054 0.000 2.280 105 K HA -0.097 4.209 4.320 -0.024 0.000 0.202 105 K C -0.094 176.501 176.600 -0.009 0.000 1.047 105 K CA 1.415 57.700 56.287 -0.002 0.000 0.942 105 K CB 0.334 32.835 32.500 0.002 0.000 0.739 105 K HN 0.326 8.576 8.250 -0.000 0.000 0.457 106 D N 1.027 121.394 120.400 -0.055 0.000 2.501 106 D HA 0.179 4.804 4.640 -0.024 0.000 0.226 106 D C 0.384 176.637 176.300 -0.079 0.000 1.198 106 D CA 0.581 54.547 54.000 -0.058 0.000 0.830 106 D CB 0.715 41.473 40.800 -0.069 0.000 1.014 106 D HN 0.468 8.838 8.370 -0.000 0.000 0.496 107 G N 0.510 109.264 108.800 -0.078 0.000 2.860 107 G HA2 -0.307 3.639 3.960 -0.024 0.000 0.553 107 G HA3 -0.307 3.639 3.960 -0.024 0.000 0.553 107 G C 0.162 174.987 174.900 -0.125 0.000 1.439 107 G CA -0.624 44.461 45.100 -0.025 0.000 0.879 107 G HN 0.217 8.507 8.290 -0.000 0.000 0.545 108 F N -0.064 119.906 119.950 0.033 0.000 2.656 108 F HA 0.392 4.906 4.527 -0.023 0.000 0.291 108 F C 1.618 177.434 175.800 0.026 0.000 1.122 108 F CA 1.001 59.023 58.000 0.036 0.000 1.427 108 F CB 0.666 39.702 39.000 0.061 0.000 1.125 108 F HN 0.687 8.987 8.300 -0.000 0.000 0.583 109 V N -2.668 117.364 119.914 0.197 0.000 3.040 109 V HA 0.475 4.580 4.120 -0.024 0.000 0.312 109 V C -0.391 175.718 176.094 0.024 0.000 1.115 109 V CA -1.805 60.578 62.300 0.139 0.000 0.998 109 V CB 1.564 33.449 31.823 0.104 0.000 1.042 109 V HN -0.116 8.074 8.190 -0.000 0.000 0.433 110 K N 1.140 121.512 120.400 -0.046 0.000 2.469 110 K HA 0.450 4.756 4.320 -0.024 0.000 0.274 110 K C 1.252 177.513 176.600 -0.565 0.000 0.983 110 K CA 1.096 57.116 56.287 -0.445 0.000 0.974 110 K CB 0.364 32.336 32.500 -0.880 0.000 0.913 110 K HN 1.664 9.914 8.250 -0.000 0.000 0.493 111 G N 1.234 109.620 108.800 -0.690 0.000 2.199 111 G HA2 -0.213 3.733 3.960 -0.024 0.000 0.254 111 G HA3 -0.213 3.733 3.960 -0.024 0.000 0.254 111 G C 0.011 174.681 174.900 -0.383 0.000 0.982 111 G CA -0.157 44.462 45.100 -0.801 0.000 0.632 111 G HN 0.409 8.699 8.290 -0.000 0.000 0.529 112 I N 1.385 121.781 120.570 -0.291 0.000 2.441 112 I HA 0.618 4.774 4.170 -0.024 0.000 0.295 112 I C 1.266 177.312 176.117 -0.118 0.000 0.994 112 I CA -0.122 61.016 61.300 -0.270 0.000 1.144 112 I CB 0.879 38.682 38.000 -0.329 0.000 1.314 112 I HN 0.121 8.331 8.210 -0.000 0.000 0.445 113 G N 3.656 112.436 108.800 -0.034 0.000 2.829 113 G HA2 0.060 4.006 3.960 -0.024 0.000 0.173 113 G HA3 0.060 4.006 3.960 -0.024 0.000 0.173 113 G C -0.480 174.484 174.900 0.105 0.000 1.476 113 G CA -0.178 44.941 45.100 0.032 0.000 1.072 113 G HN 0.567 8.857 8.290 -0.000 0.000 0.577 114 D N 0.654 121.138 120.400 0.140 0.000 2.581 114 D HA 0.386 5.011 4.640 -0.024 0.000 0.238 114 D C 0.100 176.568 176.300 0.279 0.000 1.145 114 D CA 0.852 54.955 54.000 0.171 0.000 0.866 114 D CB 0.211 41.112 40.800 0.168 0.000 1.151 114 D HN 0.545 8.915 8.370 -0.000 0.000 0.500 115 A N 3.709 126.705 122.820 0.293 0.000 2.449 115 A HA 0.615 4.921 4.320 -0.024 0.000 0.302 115 A C -1.544 176.321 177.584 0.469 0.000 1.048 115 A CA -0.842 51.458 52.037 0.438 0.000 0.708 115 A CB 1.422 20.736 19.000 0.524 0.000 1.274 115 A HN 0.547 8.697 8.150 -0.000 0.000 0.410 116 L N 1.655 123.153 121.223 0.458 0.000 2.333 116 L HA 0.702 5.028 4.340 -0.024 0.000 0.280 116 L C -0.155 176.894 176.870 0.299 0.000 1.004 116 L CA -0.131 54.953 54.840 0.407 0.000 0.820 116 L CB 1.308 43.577 42.059 0.349 0.000 1.247 116 L HN 0.775 9.005 8.230 -0.000 0.000 0.416 117 R N 3.813 124.408 120.500 0.158 0.000 2.532 117 R HA 0.829 5.154 4.340 -0.024 0.000 0.295 117 R C -1.249 175.044 176.300 -0.012 0.000 0.968 117 R CA -0.799 55.242 56.100 -0.098 0.000 0.916 117 R CB 2.138 32.106 30.300 -0.553 0.000 1.124 117 R HN 0.571 8.841 8.270 -0.000 0.000 0.463 118 V N -1.313 118.569 119.914 -0.053 0.000 2.925 118 V HA 0.472 4.577 4.120 -0.024 0.000 0.311 118 V C -0.675 175.372 176.094 -0.079 0.000 1.104 118 V CA -1.092 61.161 62.300 -0.078 0.000 0.954 118 V CB 2.195 33.848 31.823 -0.283 0.000 1.022 118 V HN 0.715 8.905 8.190 -0.000 0.000 0.427 119 E N 3.334 123.502 120.200 -0.053 0.000 2.044 119 E HA 0.292 4.627 4.350 -0.024 0.000 0.282 119 E C -0.694 175.876 176.600 -0.050 0.000 1.031 119 E CA -0.427 55.936 56.400 -0.062 0.000 0.824 119 E CB 0.844 30.511 29.700 -0.055 0.000 1.076 119 E HN 0.927 9.287 8.360 -0.000 0.000 0.395 120 D N 3.363 123.713 120.400 -0.082 0.000 2.398 120 D HA 0.063 4.688 4.640 -0.024 0.000 0.247 120 D C -1.766 174.459 176.300 -0.125 0.000 1.227 120 D CA -2.098 51.880 54.000 -0.038 0.000 0.980 120 D CB 0.624 41.355 40.800 -0.114 0.000 1.106 120 D HN 0.028 8.398 8.370 -0.000 0.000 0.493 121 P HA -0.061 4.359 4.420 -0.000 0.000 0.220 121 P C 0.908 178.054 177.300 -0.256 0.000 1.144 121 P CA 1.185 64.090 63.100 -0.324 0.000 0.800 121 P CB 0.082 31.426 31.700 -0.593 0.000 0.772 122 L N -3.426 117.668 121.223 -0.215 0.000 2.640 122 L HA 0.349 4.674 4.340 -0.024 0.000 0.230 122 L C 1.330 178.147 176.870 -0.088 0.000 1.123 122 L CA 0.464 55.276 54.840 -0.046 0.000 0.900 122 L CB -0.489 41.662 42.059 0.154 0.000 1.146 122 L HN 0.083 8.313 8.230 -0.000 0.000 0.484 123 G N -0.019 108.688 108.800 -0.155 0.000 2.131 123 G HA2 -0.274 3.671 3.960 -0.024 0.000 0.223 123 G HA3 -0.274 3.671 3.960 -0.024 0.000 0.223 123 G C -0.069 174.605 174.900 -0.376 0.000 0.990 123 G CA -0.490 44.451 45.100 -0.266 0.000 0.671 123 G HN 0.156 8.446 8.290 -0.000 0.000 0.521 124 F N 1.599 121.440 119.950 -0.183 0.000 2.404 124 F HA 0.522 5.034 4.527 -0.025 0.000 0.339 124 F C -1.619 174.091 175.800 -0.150 0.000 1.105 124 F CA -2.444 55.459 58.000 -0.162 0.000 1.087 124 F CB 1.879 40.782 39.000 -0.161 0.000 1.143 124 F HN -0.139 8.161 8.300 -0.000 0.000 0.491 125 P HA 0.054 4.474 4.420 -0.000 0.000 0.273 125 P C -1.265 176.099 177.300 0.107 0.000 1.428 125 P CA 0.040 63.145 63.100 0.008 0.000 0.995 125 P CB -0.073 31.583 31.700 -0.074 0.000 1.286 126 Y N 1.497 121.724 120.300 -0.122 0.000 2.310 126 Y HA 0.368 4.907 4.550 -0.018 0.000 0.326 126 Y C 1.056 176.758 175.900 -0.330 0.000 1.151 126 Y CA -1.350 56.624 58.100 -0.210 0.000 1.195 126 Y CB 1.256 39.634 38.460 -0.137 0.000 1.210 126 Y HN 0.385 8.665 8.280 -0.000 0.000 0.483 127 E N 2.974 122.971 120.200 -0.339 0.000 2.212 127 E HA 0.540 4.875 4.350 -0.024 0.000 0.268 127 E C -1.922 174.435 176.600 -0.405 0.000 0.902 127 E CA -0.524 55.722 56.400 -0.256 0.000 0.779 127 E CB 0.991 30.587 29.700 -0.174 0.000 1.172 127 E HN 0.402 8.761 8.360 -0.000 0.000 0.409 128 F N 4.402 124.489 119.950 0.229 0.000 2.520 128 F HA 0.556 5.067 4.527 -0.027 0.000 0.322 128 F C -0.425 175.574 175.800 0.332 0.000 1.103 128 F CA -0.806 57.330 58.000 0.227 0.000 0.926 128 F CB 1.237 40.334 39.000 0.162 0.000 1.154 128 F HN 0.408 8.708 8.300 -0.000 0.000 0.453 129 F N 1.109 121.261 119.950 0.338 0.000 2.713 129 F HA 0.616 5.128 4.527 -0.025 0.000 0.311 129 F C -1.058 174.927 175.800 0.308 0.000 1.141 129 F CA -1.201 56.974 58.000 0.291 0.000 0.939 129 F CB 1.242 40.387 39.000 0.241 0.000 1.325 129 F HN 0.396 8.696 8.300 -0.000 0.000 0.453 130 F N 0.664 120.736 119.950 0.203 0.000 2.532 130 F HA 0.477 4.989 4.527 -0.025 0.000 0.276 130 F C 0.484 176.491 175.800 0.345 0.000 0.911 130 F CA 0.384 58.445 58.000 0.103 0.000 1.196 130 F CB -0.049 39.001 39.000 0.083 0.000 1.087 130 F HN 0.528 8.828 8.300 -0.000 0.000 0.775 131 E N 2.008 122.292 120.200 0.140 0.000 2.558 131 E HA 0.235 4.570 4.350 -0.024 0.000 0.255 131 E C -0.513 176.120 176.600 0.054 0.000 0.968 131 E CA 0.700 57.100 56.400 0.000 0.000 0.939 131 E CB 0.411 30.206 29.700 0.158 0.000 0.921 131 E HN 0.222 8.582 8.360 -0.000 0.000 0.477 132 T N 1.798 116.326 114.554 -0.043 0.000 2.885 132 T HA 0.171 4.506 4.350 -0.024 0.000 0.322 132 T C -0.956 173.758 174.700 0.023 0.000 1.387 132 T CA -0.776 61.303 62.100 -0.035 0.000 1.041 132 T CB 1.439 70.305 68.868 -0.004 0.000 1.287 132 T HN 0.264 8.504 8.240 -0.000 0.000 0.491 133 T N 4.071 118.623 114.554 -0.003 0.000 2.752 133 T HA 0.276 4.611 4.350 -0.024 0.000 0.295 133 T C 0.165 174.997 174.700 0.220 0.000 0.923 133 T CA -0.033 62.106 62.100 0.066 0.000 1.112 133 T CB -0.343 68.530 68.868 0.009 0.000 0.884 133 T HN 0.503 8.743 8.240 -0.000 0.000 0.525 134 H N 1.390 120.497 119.070 0.061 0.000 2.732 134 H HA 0.394 4.935 4.556 -0.025 0.000 0.351 134 H C 0.630 176.014 175.328 0.094 0.000 1.090 134 H CA -0.773 55.352 56.048 0.127 0.000 1.431 134 H CB 0.798 30.671 29.762 0.184 0.000 1.447 134 H HN 0.437 8.717 8.280 -0.000 0.000 0.582 135 V N -0.032 119.990 119.914 0.181 0.000 3.164 135 V HA 0.276 4.381 4.120 -0.024 0.000 0.313 135 V C 0.076 176.218 176.094 0.081 0.000 1.188 135 V CA -1.266 61.091 62.300 0.095 0.000 1.058 135 V CB 1.881 33.709 31.823 0.009 0.000 1.110 135 V HN 0.778 8.968 8.190 -0.000 0.000 0.453 136 E N 1.285 121.507 120.200 0.037 0.000 2.328 136 E HA 0.107 4.443 4.350 -0.024 0.000 0.265 136 E C 0.063 176.658 176.600 -0.009 0.000 1.057 136 E CA -0.250 56.159 56.400 0.015 0.000 0.916 136 E CB 0.451 30.146 29.700 -0.008 0.000 0.993 136 E HN 0.607 8.967 8.360 -0.000 0.000 0.446 137 R N 5.113 125.623 120.500 0.017 0.000 2.351 137 R HA 0.054 4.380 4.340 -0.024 0.000 0.318 137 R C 0.525 176.793 176.300 -0.054 0.000 1.055 137 R CA -0.112 55.993 56.100 0.009 0.000 0.968 137 R CB 0.319 30.636 30.300 0.029 0.000 0.974 137 R HN 0.662 8.932 8.270 -0.000 0.000 0.439 138 L N 5.477 126.555 121.223 -0.241 0.000 2.653 138 L HA 0.030 4.355 4.340 -0.024 0.000 0.232 138 L C 1.685 177.926 176.870 -1.049 0.000 1.169 138 L CA -0.279 54.238 54.840 -0.539 0.000 0.951 138 L CB -0.528 41.156 42.059 -0.624 0.000 1.181 138 L HN 0.737 8.967 8.230 -0.000 0.000 0.460 139 H N -0.231 118.382 119.070 -0.762 0.000 2.489 139 H HA -0.081 4.461 4.556 -0.024 0.000 0.293 139 H C 1.299 176.237 175.328 -0.651 0.000 1.066 139 H CA 0.976 56.593 56.048 -0.718 0.000 1.305 139 H CB -0.034 29.588 29.762 -0.232 0.000 1.386 139 H HN 0.433 8.713 8.280 -0.000 0.000 0.551 140 M N 0.718 119.718 119.600 -1.000 0.000 2.496 140 M HA 0.226 4.691 4.480 -0.024 0.000 0.330 140 M C 0.088 176.067 176.300 -0.535 0.000 1.133 140 M CA -0.186 54.652 55.300 -0.770 0.000 0.964 140 M CB 0.938 33.219 32.600 -0.532 0.000 1.401 140 M HN -0.109 8.181 8.290 -0.000 0.000 0.520 141 R N 0.496 120.686 120.500 -0.516 0.000 4.496 141 R HA 0.123 4.448 4.340 -0.024 0.000 0.211 141 R C 0.004 176.428 176.300 0.207 0.000 1.738 141 R CA 0.027 56.055 56.100 -0.120 0.000 1.528 141 R CB -0.870 29.349 30.300 -0.133 0.000 1.414 141 R HN 0.377 8.647 8.270 -0.000 0.000 0.812 142 Y N 0.584 121.061 120.300 0.294 0.000 2.574 142 Y HA -0.182 4.354 4.550 -0.024 0.000 0.294 142 Y C 1.930 177.950 175.900 0.201 0.000 1.142 142 Y CA 1.070 59.325 58.100 0.258 0.000 1.314 142 Y CB -0.030 38.475 38.460 0.075 0.000 0.991 142 Y HN 0.366 8.646 8.280 -0.000 0.000 0.555 143 D N -0.079 120.488 120.400 0.278 0.000 2.264 143 D HA -0.149 4.476 4.640 -0.024 0.000 0.208 143 D C 1.385 177.802 176.300 0.195 0.000 0.966 143 D CA 1.111 55.226 54.000 0.191 0.000 0.864 143 D CB -0.457 40.421 40.800 0.130 0.000 0.933 143 D HN 0.394 8.764 8.370 -0.000 0.000 0.499 144 L N -1.353 120.025 121.223 0.259 0.000 2.590 144 L HA 0.172 4.497 4.340 -0.024 0.000 0.227 144 L C 0.411 177.437 176.870 0.260 0.000 1.099 144 L CA -0.606 54.397 54.840 0.272 0.000 0.872 144 L CB -0.199 42.055 42.059 0.326 0.000 1.088 144 L HN -0.111 8.119 8.230 -0.000 0.000 0.479 145 Y N 1.950 122.300 120.300 0.083 0.000 2.650 145 Y HA 0.036 4.571 4.550 -0.024 0.000 0.331 145 Y C 0.928 176.778 175.900 -0.083 0.000 1.165 145 Y CA 0.075 58.063 58.100 -0.186 0.000 1.473 145 Y CB 0.685 39.066 38.460 -0.131 0.000 1.224 145 Y HN -0.084 8.196 8.280 -0.000 0.000 0.533 146 S N 4.170 119.585 115.700 -0.475 0.000 2.601 146 S HA 0.470 4.925 4.470 -0.024 0.000 0.271 146 S C 1.119 175.493 174.600 -0.378 0.000 1.305 146 S CA -0.237 57.763 58.200 -0.334 0.000 1.022 146 S CB 1.041 64.047 63.200 -0.323 0.000 0.940 146 S HN 0.958 9.268 8.310 -0.000 0.000 0.525 147 A N 3.093 125.835 122.820 -0.131 0.000 2.070 147 A HA 0.155 4.461 4.320 -0.024 0.000 0.220 147 A C 1.525 179.060 177.584 -0.081 0.000 1.159 147 A CA 1.357 53.377 52.037 -0.028 0.000 0.656 147 A CB -0.811 18.203 19.000 0.023 0.000 0.800 147 A HN 1.032 9.182 8.150 -0.000 0.000 0.453 148 G N -0.485 108.208 108.800 -0.179 0.000 3.936 148 G HA2 0.381 4.327 3.960 -0.024 0.000 0.296 148 G HA3 0.381 4.327 3.960 -0.024 0.000 0.296 148 G C -0.101 174.629 174.900 -0.284 0.000 1.121 148 G CA -0.163 44.828 45.100 -0.181 0.000 0.899 148 G HN 0.358 8.648 8.290 -0.000 0.000 0.542 149 E N 1.055 120.961 120.200 -0.490 0.000 2.585 149 E HA 0.053 4.388 4.350 -0.024 0.000 0.252 149 E C 0.313 176.712 176.600 -0.335 0.000 0.981 149 E CA 0.135 56.178 56.400 -0.594 0.000 0.943 149 E CB 0.155 29.082 29.700 -1.288 0.000 0.923 149 E HN 0.203 8.563 8.360 -0.000 0.000 0.486 150 L N 5.962 127.048 121.223 -0.228 0.000 2.278 150 L HA 0.107 4.433 4.340 -0.024 0.000 0.287 150 L C 1.247 178.122 176.870 0.008 0.000 1.072 150 L CA -0.526 54.252 54.840 -0.104 0.000 0.819 150 L CB 0.712 42.651 42.059 -0.200 0.000 1.176 150 L HN 0.606 8.836 8.230 -0.000 0.000 0.435 151 V N 0.812 120.743 119.914 0.028 0.000 3.125 151 V HA 0.251 4.356 4.120 -0.024 0.000 0.249 151 V C 0.849 177.047 176.094 0.174 0.000 1.113 151 V CA 0.218 62.580 62.300 0.103 0.000 1.106 151 V CB -0.201 31.540 31.823 -0.136 0.000 0.768 151 V HN 0.810 9.000 8.190 -0.000 0.000 0.468 152 R N -0.176 120.433 120.500 0.183 0.000 2.739 152 R HA 0.625 4.950 4.340 -0.024 0.000 0.271 152 R C -1.734 174.672 176.300 0.177 0.000 1.010 152 R CA -0.940 55.258 56.100 0.163 0.000 0.897 152 R CB 2.280 32.644 30.300 0.107 0.000 1.236 152 R HN 0.217 8.487 8.270 -0.000 0.000 0.466 153 L N 1.127 122.369 121.223 0.031 0.000 2.331 153 L HA 0.184 4.509 4.340 -0.024 0.000 0.278 153 L C 0.241 176.915 176.870 -0.327 0.000 1.106 153 L CA 0.688 55.341 54.840 -0.310 0.000 0.824 153 L CB 1.037 42.883 42.059 -0.354 0.000 1.142 153 L HN 0.752 8.982 8.230 -0.000 0.000 0.443 154 D N 1.933 122.053 120.400 -0.466 0.000 2.490 154 D HA 0.092 4.718 4.640 -0.024 0.000 0.244 154 D C -0.226 175.780 176.300 -0.490 0.000 0.979 154 D CA 1.050 54.822 54.000 -0.380 0.000 0.924 154 D CB 0.310 40.929 40.800 -0.302 0.000 1.075 154 D HN 0.772 9.142 8.370 -0.000 0.000 0.488 155 H N -3.248 115.381 119.070 -0.735 0.000 2.917 155 H HA 0.239 4.780 4.556 -0.025 0.000 0.299 155 H C -1.489 173.342 175.328 -0.828 0.000 1.418 155 H CA -0.866 54.680 56.048 -0.837 0.000 1.138 155 H CB -0.196 29.040 29.762 -0.878 0.000 1.830 155 H HN -0.106 8.174 8.280 -0.000 0.000 0.514 156 F N 0.401 120.256 119.950 -0.158 0.000 2.483 156 F HA 0.448 4.960 4.527 -0.024 0.000 0.329 156 F C 0.584 176.308 175.800 -0.127 0.000 1.064 156 F CA -0.868 57.008 58.000 -0.208 0.000 0.986 156 F CB 1.317 40.156 39.000 -0.268 0.000 1.218 156 F HN 0.496 8.796 8.300 -0.000 0.000 0.484 157 N N 1.238 119.859 118.700 -0.130 0.000 2.430 157 N HA 0.225 4.951 4.740 -0.024 0.000 0.290 157 N C -1.775 173.591 175.510 -0.241 0.000 1.063 157 N CA -0.445 52.426 53.050 -0.298 0.000 0.883 157 N CB 1.664 39.738 38.487 -0.689 0.000 1.465 157 N HN 0.695 9.075 8.380 -0.000 0.000 0.493 158 Q N 1.373 121.019 119.800 -0.257 0.000 2.282 158 Q HA 0.479 4.804 4.340 -0.024 0.000 0.260 158 Q C -0.396 175.551 176.000 -0.088 0.000 0.964 158 Q CA -0.940 54.698 55.803 -0.275 0.000 0.880 158 Q CB 2.588 30.858 28.738 -0.780 0.000 1.286 158 Q HN 0.255 8.525 8.270 -0.000 0.000 0.445 159 V N 1.969 121.958 119.914 0.125 0.000 2.432 159 V HA 0.464 4.570 4.120 -0.024 0.000 0.275 159 V C 0.025 176.249 176.094 0.217 0.000 1.043 159 V CA -0.131 62.245 62.300 0.126 0.000 0.925 159 V CB 1.396 33.288 31.823 0.116 0.000 0.985 159 V HN 0.803 8.993 8.190 -0.000 0.000 0.466 160 T N 6.279 120.905 114.554 0.120 0.000 2.956 160 T HA 0.449 4.785 4.350 -0.024 0.000 0.312 160 T C -2.060 172.669 174.700 0.047 0.000 1.151 160 T CA -1.328 60.846 62.100 0.123 0.000 1.024 160 T CB 2.363 71.326 68.868 0.159 0.000 1.140 160 T HN 0.435 8.675 8.240 -0.000 0.000 0.473 161 P HA 0.026 4.446 4.420 -0.000 0.000 0.217 161 P C 0.072 177.365 177.300 -0.011 0.000 1.150 161 P CA 1.063 64.164 63.100 0.002 0.000 0.832 161 P CB 0.232 31.927 31.700 -0.009 0.000 0.787 162 D N -0.421 119.974 120.400 -0.008 0.000 2.446 162 D HA 0.144 4.769 4.640 -0.024 0.000 0.251 162 D C 1.086 177.381 176.300 -0.009 0.000 1.137 162 D CA -0.635 53.354 54.000 -0.018 0.000 0.890 162 D CB 1.117 41.907 40.800 -0.016 0.000 1.071 162 D HN -0.296 8.075 8.370 -0.000 0.000 0.528 163 V N 4.879 124.780 119.914 -0.022 0.000 2.307 163 V HA -0.070 4.035 4.120 -0.024 0.000 0.245 163 V C -0.826 175.268 176.094 0.001 0.000 1.045 163 V CA 1.274 63.565 62.300 -0.016 0.000 1.024 163 V CB -1.129 30.678 31.823 -0.027 0.000 0.651 163 V HN 0.472 8.662 8.190 -0.000 0.000 0.449 164 P HA -0.175 4.245 4.420 -0.000 0.000 0.216 164 P C 1.758 179.074 177.300 0.027 0.000 1.150 164 P CA 1.454 64.563 63.100 0.015 0.000 0.837 164 P CB -0.066 31.638 31.700 0.007 0.000 0.786 165 R N -0.281 120.231 120.500 0.021 0.000 2.080 165 R HA -0.106 4.219 4.340 -0.024 0.000 0.236 165 R C 2.404 178.747 176.300 0.073 0.000 1.137 165 R CA 2.135 58.254 56.100 0.032 0.000 0.943 165 R CB -1.336 28.970 30.300 0.010 0.000 0.846 165 R HN 0.149 8.419 8.270 -0.000 0.000 0.431 166 G N 0.637 109.482 108.800 0.074 0.000 2.440 166 G HA2 -0.324 3.621 3.960 -0.024 0.000 0.218 166 G HA3 -0.324 3.621 3.960 -0.024 0.000 0.218 166 G C 1.488 176.470 174.900 0.136 0.000 1.154 166 G CA 0.823 46.010 45.100 0.144 0.000 0.767 166 G HN 0.366 8.656 8.290 -0.000 0.000 0.552 167 R N 0.461 120.996 120.500 0.058 0.000 2.091 167 R HA -0.079 4.246 4.340 -0.024 0.000 0.238 167 R C 2.456 178.780 176.300 0.039 0.000 1.136 167 R CA 1.676 57.792 56.100 0.027 0.000 0.959 167 R CB -0.311 30.005 30.300 0.028 0.000 0.856 167 R HN 0.245 8.515 8.270 -0.000 0.000 0.437 168 K N 0.060 120.501 120.400 0.067 0.000 2.026 168 K HA -0.225 4.081 4.320 -0.024 0.000 0.208 168 K C 2.091 178.746 176.600 0.093 0.000 1.048 168 K CA 1.720 58.049 56.287 0.069 0.000 0.929 168 K CB -0.585 31.956 32.500 0.068 0.000 0.713 168 K HN 0.264 8.514 8.250 -0.000 0.000 0.439 169 Y N 1.883 122.192 120.300 0.015 0.000 2.081 169 Y HA -0.245 4.295 4.550 -0.016 0.000 0.280 169 Y C 1.962 177.899 175.900 0.061 0.000 1.163 169 Y CA 1.825 59.941 58.100 0.028 0.000 1.135 169 Y CB -0.667 37.798 38.460 0.009 0.000 0.970 169 Y HN 0.023 8.303 8.280 -0.000 0.000 0.498 170 L N 0.090 121.052 121.223 -0.436 0.000 2.141 170 L HA -0.162 4.163 4.340 -0.024 0.000 0.209 170 L C 2.413 179.235 176.870 -0.079 0.000 1.094 170 L CA 1.574 56.150 54.840 -0.440 0.000 0.763 170 L CB -0.581 41.203 42.059 -0.458 0.000 0.908 170 L HN 0.295 8.525 8.230 -0.000 0.000 0.437 171 E N 0.097 120.277 120.200 -0.033 0.000 2.077 171 E HA -0.213 4.122 4.350 -0.024 0.000 0.193 171 E C 1.680 178.280 176.600 0.001 0.000 0.989 171 E CA 1.200 57.609 56.400 0.014 0.000 0.800 171 E CB -0.023 29.690 29.700 0.023 0.000 0.746 171 E HN 0.434 8.794 8.360 -0.000 0.000 0.452 172 D N 0.575 120.980 120.400 0.010 0.000 2.178 172 D HA -0.134 4.492 4.640 -0.024 0.000 0.201 172 D C 1.718 178.029 176.300 0.019 0.000 0.980 172 D CA 0.620 54.652 54.000 0.052 0.000 0.842 172 D CB -0.049 40.825 40.800 0.123 0.000 0.948 172 D HN 0.072 8.442 8.370 -0.000 0.000 0.472 173 L N -0.710 120.479 121.223 -0.057 0.000 2.552 173 L HA 0.186 4.511 4.340 -0.024 0.000 0.227 173 L C 1.462 178.217 176.870 -0.192 0.000 1.146 173 L CA 1.246 55.971 54.840 -0.192 0.000 0.858 173 L CB 0.025 41.985 42.059 -0.165 0.000 0.969 173 L HN 0.206 8.436 8.230 -0.000 0.000 0.451 174 G N -2.378 106.347 108.800 -0.126 0.000 2.211 174 G HA2 -0.257 3.688 3.960 -0.024 0.000 0.201 174 G HA3 -0.257 3.688 3.960 -0.024 0.000 0.201 174 G C 0.309 175.046 174.900 -0.272 0.000 0.997 174 G CA -0.120 44.847 45.100 -0.221 0.000 0.652 174 G HN 0.198 8.488 8.290 -0.000 0.000 0.500 175 F N 1.438 121.260 119.950 -0.214 0.000 2.518 175 F HA 0.616 5.130 4.527 -0.022 0.000 0.359 175 F C 1.193 176.882 175.800 -0.184 0.000 1.118 175 F CA -0.022 57.847 58.000 -0.218 0.000 1.287 175 F CB 0.649 39.542 39.000 -0.177 0.000 1.132 175 F HN -0.061 8.239 8.300 -0.000 0.000 0.587 176 R N 1.674 122.129 120.500 -0.075 0.000 2.343 176 R HA 0.464 4.789 4.340 -0.024 0.000 0.320 176 R C -1.213 175.156 176.300 0.115 0.000 0.956 176 R CA -0.687 55.393 56.100 -0.033 0.000 0.836 176 R CB 1.208 31.429 30.300 -0.132 0.000 1.151 176 R HN 0.373 8.643 8.270 -0.000 0.000 0.450 177 V N 3.091 123.081 119.914 0.126 0.000 2.585 177 V HA 0.006 4.112 4.120 -0.024 0.000 0.296 177 V C 1.176 177.384 176.094 0.191 0.000 1.035 177 V CA 0.925 63.323 62.300 0.162 0.000 1.084 177 V CB 1.042 32.943 31.823 0.131 0.000 0.953 177 V HN 1.075 9.265 8.190 -0.000 0.000 0.483 178 T N 1.382 116.068 114.554 0.221 0.000 3.085 178 T HA 0.312 4.647 4.350 -0.024 0.000 0.241 178 T C 0.358 175.161 174.700 0.172 0.000 0.988 178 T CA -0.153 62.061 62.100 0.191 0.000 1.117 178 T CB 0.475 69.437 68.868 0.156 0.000 0.978 178 T HN 0.603 8.843 8.240 -0.000 0.000 0.454 179 E N 1.444 121.753 120.200 0.181 0.000 2.367 179 E HA 0.533 4.869 4.350 -0.024 0.000 0.273 179 E C -1.746 175.042 176.600 0.313 0.000 0.903 179 E CA -0.825 55.662 56.400 0.146 0.000 0.764 179 E CB 2.293 31.921 29.700 -0.120 0.000 1.252 179 E HN 0.548 8.908 8.360 -0.000 0.000 0.446 180 D N 0.617 121.211 120.400 0.323 0.000 2.596 180 D HA 0.448 5.073 4.640 -0.024 0.000 0.262 180 D C -0.868 175.679 176.300 0.411 0.000 1.210 180 D CA -0.630 53.634 54.000 0.439 0.000 0.873 180 D CB 0.881 41.868 40.800 0.312 0.000 1.408 180 D HN 0.324 8.694 8.370 -0.000 0.000 0.441 181 I N 0.460 121.289 120.570 0.431 0.000 2.418 181 I HA 0.310 4.466 4.170 -0.024 0.000 0.287 181 I C -0.225 176.122 176.117 0.383 0.000 1.008 181 I CA -0.452 61.075 61.300 0.377 0.000 1.104 181 I CB 1.559 39.762 38.000 0.338 0.000 1.264 181 I HN 0.196 8.406 8.210 -0.000 0.000 0.438 182 Q N 4.065 124.074 119.800 0.348 0.000 2.587 182 Q HA 0.482 4.808 4.340 -0.024 0.000 0.293 182 Q C -1.515 174.704 176.000 0.366 0.000 1.083 182 Q CA -1.036 54.984 55.803 0.362 0.000 0.792 182 Q CB 2.629 31.508 28.738 0.235 0.000 1.484 182 Q HN 0.645 8.915 8.270 -0.000 0.000 0.446 183 D N -1.209 119.422 120.400 0.385 0.000 2.689 183 D HA 0.111 4.736 4.640 -0.024 0.000 0.255 183 D C -0.103 176.348 176.300 0.251 0.000 1.113 183 D CA -0.527 53.680 54.000 0.345 0.000 1.115 183 D CB 0.236 41.293 40.800 0.429 0.000 1.334 183 D HN 0.537 8.907 8.370 -0.000 0.000 0.621 184 D N -1.702 118.838 120.400 0.233 0.000 2.349 184 D HA -0.032 4.593 4.640 -0.024 0.000 0.224 184 D C 0.234 176.608 176.300 0.124 0.000 1.029 184 D CA 0.348 54.442 54.000 0.157 0.000 0.879 184 D CB -0.203 40.674 40.800 0.129 0.000 0.906 184 D HN 0.574 8.944 8.370 -0.000 0.000 0.528 185 E N -0.660 119.623 120.200 0.139 0.000 2.624 185 E HA 0.352 4.688 4.350 -0.024 0.000 0.210 185 E C 0.843 177.492 176.600 0.081 0.000 0.997 185 E CA 0.020 56.480 56.400 0.101 0.000 0.999 185 E CB 0.711 30.477 29.700 0.110 0.000 1.040 185 E HN 0.290 8.650 8.360 -0.000 0.000 0.469 186 G N 1.341 110.193 108.800 0.088 0.000 2.176 186 G HA2 -0.267 3.679 3.960 -0.024 0.000 0.253 186 G HA3 -0.267 3.679 3.960 -0.024 0.000 0.253 186 G C 0.474 175.391 174.900 0.029 0.000 0.979 186 G CA 0.423 45.558 45.100 0.059 0.000 0.641 186 G HN 0.259 8.549 8.290 -0.000 0.000 0.530 187 T N 1.831 116.395 114.554 0.016 0.000 2.869 187 T HA 0.538 4.874 4.350 -0.024 0.000 0.295 187 T C 0.391 175.003 174.700 -0.147 0.000 0.987 187 T CA 0.620 62.635 62.100 -0.141 0.000 1.109 187 T CB 1.468 70.151 68.868 -0.308 0.000 0.932 187 T HN 0.205 8.445 8.240 -0.000 0.000 0.518 188 T N 3.173 117.614 114.554 -0.188 0.000 2.795 188 T HA 0.330 4.665 4.350 -0.024 0.000 0.282 188 T C 0.099 174.669 174.700 -0.217 0.000 0.980 188 T CA -0.442 61.614 62.100 -0.072 0.000 1.012 188 T CB 0.747 69.618 68.868 0.005 0.000 0.936 188 T HN 0.576 8.816 8.240 -0.000 0.000 0.457 189 Y N 1.208 121.549 120.300 0.070 0.000 2.507 189 Y HA 0.585 5.124 4.550 -0.018 0.000 0.263 189 Y C 1.151 177.075 175.900 0.041 0.000 1.093 189 Y CA -0.207 57.925 58.100 0.055 0.000 1.285 189 Y CB 0.697 39.192 38.460 0.057 0.000 1.115 189 Y HN 0.778 9.058 8.280 -0.000 0.000 0.533 190 A N -0.183 122.747 122.820 0.184 0.000 2.590 190 A HA 0.798 5.103 4.320 -0.024 0.000 0.296 190 A C -1.688 175.927 177.584 0.052 0.000 1.050 190 A CA -0.195 51.839 52.037 -0.006 0.000 0.697 190 A CB 0.251 19.220 19.000 -0.053 0.000 1.277 190 A HN 0.163 8.313 8.150 -0.000 0.000 0.411 191 A N 1.123 123.832 122.820 -0.185 0.000 2.515 191 A HA 0.819 5.125 4.320 -0.024 0.000 0.298 191 A C -1.417 176.059 177.584 -0.180 0.000 1.059 191 A CA -0.389 51.680 52.037 0.053 0.000 0.698 191 A CB 1.102 20.134 19.000 0.054 0.000 1.289 191 A HN 0.993 9.143 8.150 -0.000 0.000 0.404 192 W N 2.530 123.788 121.300 -0.071 0.000 2.632 192 W HA 0.629 5.277 4.660 -0.020 0.000 0.328 192 W C -0.526 175.990 176.519 -0.005 0.000 1.044 192 W CA -0.567 56.700 57.345 -0.130 0.000 1.225 192 W CB 2.097 31.373 29.460 -0.306 0.000 1.396 192 W HN 0.781 8.961 8.180 -0.000 0.000 0.499 193 M N 2.065 121.808 119.600 0.238 0.000 2.421 193 M HA 0.423 4.889 4.480 -0.024 0.000 0.287 193 M C -1.544 174.984 176.300 0.381 0.000 1.183 193 M CA -0.736 54.717 55.300 0.255 0.000 0.916 193 M CB 2.097 34.780 32.600 0.139 0.000 1.701 193 M HN 0.581 8.871 8.290 -0.000 0.000 0.470 194 H N 0.404 119.636 119.070 0.270 0.000 2.731 194 H HA 0.767 5.308 4.556 -0.024 0.000 0.368 194 H C -0.464 174.915 175.328 0.085 0.000 1.168 194 H CA -0.751 55.425 56.048 0.214 0.000 1.181 194 H CB 1.965 31.781 29.762 0.090 0.000 1.743 194 H HN 0.672 8.952 8.280 -0.000 0.000 0.547 195 R N 0.750 121.185 120.500 -0.109 0.000 2.276 195 R HA 0.038 4.363 4.340 -0.024 0.000 0.195 195 R C 1.376 177.724 176.300 0.081 0.000 0.908 195 R CA 0.924 56.859 56.100 -0.274 0.000 1.083 195 R CB -0.089 29.959 30.300 -0.421 0.000 1.182 195 R HN 0.813 9.083 8.270 -0.000 0.000 0.608 196 K N 0.066 120.578 120.400 0.186 0.000 2.487 196 K HA 0.103 4.408 4.320 -0.024 0.000 0.192 196 K C 0.657 177.343 176.600 0.143 0.000 1.027 196 K CA 1.073 57.444 56.287 0.139 0.000 1.054 196 K CB 0.343 32.893 32.500 0.083 0.000 0.824 196 K HN 0.162 8.412 8.250 -0.000 0.000 0.510 197 G N 1.382 110.278 108.800 0.159 0.000 2.131 197 G HA2 -0.267 3.679 3.960 -0.024 0.000 0.223 197 G HA3 -0.267 3.679 3.960 -0.024 0.000 0.223 197 G C 0.158 174.894 174.900 -0.273 0.000 0.990 197 G CA 0.325 45.282 45.100 -0.237 0.000 0.671 197 G HN 0.626 8.916 8.290 -0.000 0.000 0.521 198 T N -3.705 110.743 114.554 -0.177 0.000 2.876 198 T HA 0.670 5.005 4.350 -0.024 0.000 0.277 198 T C 1.452 176.027 174.700 -0.208 0.000 0.997 198 T CA 0.233 62.254 62.100 -0.131 0.000 0.966 198 T CB 1.638 70.517 68.868 0.018 0.000 1.312 198 T HN 0.500 8.740 8.240 -0.000 0.000 0.598 199 V N 1.408 121.231 119.914 -0.151 0.000 2.490 199 V HA 0.053 4.158 4.120 -0.024 0.000 0.250 199 V C 0.942 177.165 176.094 0.215 0.000 1.061 199 V CA 1.914 64.132 62.300 -0.136 0.000 1.064 199 V CB -1.459 30.233 31.823 -0.218 0.000 0.670 199 V HN 1.092 9.282 8.190 -0.000 0.000 0.461 200 H N -3.220 115.860 119.070 0.018 0.000 3.068 200 H HA 0.362 4.903 4.556 -0.025 0.000 0.342 200 H C -0.585 174.791 175.328 0.081 0.000 1.284 200 H CA -1.050 55.054 56.048 0.095 0.000 1.181 200 H CB 0.906 30.716 29.762 0.081 0.000 1.898 200 H HN -0.063 8.217 8.280 -0.000 0.000 0.540 201 D N 0.303 120.829 120.400 0.210 0.000 2.379 201 D HA 0.048 4.673 4.640 -0.024 0.000 0.218 201 D C 0.147 176.528 176.300 0.135 0.000 1.006 201 D CA 0.890 54.974 54.000 0.141 0.000 0.893 201 D CB 1.406 42.424 40.800 0.364 0.000 1.019 201 D HN 0.494 8.864 8.370 -0.000 0.000 0.503 202 T N -0.535 114.126 114.554 0.177 0.000 2.864 202 T HA 0.655 4.990 4.350 -0.024 0.000 0.299 202 T C -1.836 172.870 174.700 0.011 0.000 1.166 202 T CA -0.546 61.605 62.100 0.085 0.000 1.007 202 T CB 2.060 70.980 68.868 0.086 0.000 1.219 202 T HN -0.014 8.226 8.240 -0.000 0.000 0.506 203 A N 2.049 124.803 122.820 -0.110 0.000 2.515 203 A HA 0.866 5.171 4.320 -0.024 0.000 0.296 203 A C -1.751 175.606 177.584 -0.378 0.000 1.094 203 A CA -0.711 51.111 52.037 -0.358 0.000 0.718 203 A CB 1.320 19.873 19.000 -0.746 0.000 1.307 203 A HN 0.773 8.923 8.150 -0.000 0.000 0.408 204 L N 1.148 122.117 121.223 -0.423 0.000 2.333 204 L HA 0.565 4.890 4.340 -0.024 0.000 0.280 204 L C -0.406 176.263 176.870 -0.335 0.000 1.004 204 L CA -0.368 54.291 54.840 -0.301 0.000 0.820 204 L CB 2.122 44.072 42.059 -0.182 0.000 1.247 204 L HN 0.698 8.928 8.230 -0.000 0.000 0.416 205 T N 1.498 115.910 114.554 -0.237 0.000 2.797 205 T HA 0.411 4.747 4.350 -0.024 0.000 0.279 205 T C 0.389 175.068 174.700 -0.034 0.000 0.991 205 T CA -0.549 61.454 62.100 -0.161 0.000 0.979 205 T CB 1.686 70.426 68.868 -0.214 0.000 0.943 205 T HN 0.719 8.959 8.240 -0.000 0.000 0.444 206 G N 1.407 110.223 108.800 0.026 0.000 2.343 206 G HA2 0.538 4.484 3.960 -0.024 0.000 0.254 206 G HA3 0.538 4.484 3.960 -0.024 0.000 0.254 206 G C 0.246 175.190 174.900 0.073 0.000 1.277 206 G CA 0.081 45.206 45.100 0.041 0.000 0.909 206 G HN 1.023 9.313 8.290 -0.000 0.000 0.502 207 G N 1.705 110.537 108.800 0.053 0.000 2.321 207 G HA2 0.284 4.230 3.960 -0.024 0.000 0.296 207 G HA3 0.284 4.230 3.960 -0.024 0.000 0.296 207 G C -1.012 173.909 174.900 0.036 0.000 1.287 207 G CA -1.128 44.006 45.100 0.058 0.000 0.846 207 G HN 0.611 8.901 8.290 -0.000 0.000 0.508 208 N N 0.502 119.218 118.700 0.026 0.000 2.447 208 N HA 0.503 5.228 4.740 -0.024 0.000 0.263 208 N C 0.463 175.972 175.510 -0.002 0.000 1.226 208 N CA 1.047 54.099 53.050 0.003 0.000 0.906 208 N CB 1.332 39.816 38.487 -0.005 0.000 1.060 208 N HN 1.073 9.453 8.380 -0.000 0.000 0.468 209 G N 1.282 110.069 108.800 -0.022 0.000 2.687 209 G HA2 0.513 4.458 3.960 -0.024 0.000 0.291 209 G HA3 0.513 4.458 3.960 -0.024 0.000 0.291 209 G C -3.140 171.675 174.900 -0.140 0.000 1.420 209 G CA -1.021 44.049 45.100 -0.051 0.000 0.796 209 G HN 0.270 8.560 8.290 -0.000 0.000 0.485 210 P HA 0.334 4.754 4.420 -0.000 0.000 0.276 210 P C -0.748 176.323 177.300 -0.382 0.000 1.243 210 P CA 0.078 62.810 63.100 -0.614 0.000 0.768 210 P CB 1.076 31.982 31.700 -1.323 0.000 0.856 211 R N 1.934 122.402 120.500 -0.053 0.000 2.771 211 R HA 0.537 4.862 4.340 -0.024 0.000 0.274 211 R C -0.830 175.620 176.300 0.251 0.000 0.987 211 R CA -1.289 54.834 56.100 0.037 0.000 0.908 211 R CB 1.776 32.075 30.300 -0.000 0.000 1.213 211 R HN 0.332 8.602 8.270 -0.000 0.000 0.468 212 L N 2.868 124.180 121.223 0.149 0.000 2.260 212 L HA 0.209 4.535 4.340 -0.024 0.000 0.289 212 L C 1.152 178.029 176.870 0.012 0.000 1.057 212 L CA 0.207 55.110 54.840 0.105 0.000 0.811 212 L CB 0.527 42.600 42.059 0.024 0.000 1.184 212 L HN 0.631 8.861 8.230 -0.000 0.000 0.429 213 H N 5.010 124.022 119.070 -0.097 0.000 2.284 213 H HA 0.036 4.577 4.556 -0.026 0.000 0.304 213 H C -0.277 175.043 175.328 -0.015 0.000 1.069 213 H CA 1.821 57.778 56.048 -0.152 0.000 1.327 213 H CB 0.410 30.005 29.762 -0.278 0.000 1.387 213 H HN 0.805 9.085 8.280 -0.000 0.000 0.498 214 H N -3.074 116.090 119.070 0.158 0.000 2.932 214 H HA 0.377 4.918 4.556 -0.023 0.000 0.307 214 H C -1.513 173.901 175.328 0.144 0.000 1.391 214 H CA -0.784 55.366 56.048 0.169 0.000 1.130 214 H CB 0.879 30.829 29.762 0.313 0.000 1.836 214 H HN -0.049 8.231 8.280 -0.000 0.000 0.522 215 V N 0.445 120.515 119.914 0.260 0.000 2.555 215 V HA 0.705 4.810 4.120 -0.024 0.000 0.302 215 V C 0.035 176.126 176.094 -0.005 0.000 1.038 215 V CA -0.361 61.984 62.300 0.076 0.000 0.887 215 V CB 1.189 33.058 31.823 0.076 0.000 0.991 215 V HN 1.032 9.222 8.190 -0.000 0.000 0.434 216 A N 4.148 126.712 122.820 -0.427 0.000 2.355 216 A HA 0.924 5.229 4.320 -0.024 0.000 0.317 216 A C -1.286 175.930 177.584 -0.612 0.000 1.094 216 A CA -0.360 51.409 52.037 -0.447 0.000 0.764 216 A CB 0.939 19.439 19.000 -0.832 0.000 1.230 216 A HN 0.591 8.741 8.150 -0.000 0.000 0.448 217 F N 0.905 120.796 119.950 -0.099 0.000 2.492 217 F HA 0.543 5.055 4.527 -0.024 0.000 0.327 217 F C 0.890 176.710 175.800 0.034 0.000 1.079 217 F CA -0.058 57.917 58.000 -0.041 0.000 0.967 217 F CB 2.432 41.435 39.000 0.004 0.000 1.169 217 F HN 0.490 8.790 8.300 -0.000 0.000 0.472 218 S N 0.428 116.269 115.700 0.235 0.000 2.616 218 S HA 0.600 5.056 4.470 -0.024 0.000 0.277 218 S C 0.011 174.691 174.600 0.133 0.000 1.234 218 S CA -0.748 57.584 58.200 0.220 0.000 1.028 218 S CB 1.322 64.638 63.200 0.194 0.000 0.988 218 S HN 0.711 9.021 8.310 -0.000 0.000 0.522 219 T N -1.393 113.216 114.554 0.092 0.000 2.927 219 T HA 0.475 4.810 4.350 -0.024 0.000 0.286 219 T C 0.547 175.258 174.700 0.018 0.000 1.040 219 T CA -0.630 61.461 62.100 -0.015 0.000 1.010 219 T CB 0.690 69.541 68.868 -0.028 0.000 1.177 219 T HN 0.614 8.854 8.240 -0.000 0.000 0.546 220 H N -0.185 118.946 119.070 0.101 0.000 2.363 220 H HA 0.245 4.787 4.556 -0.024 0.000 0.301 220 H C 0.735 176.074 175.328 0.018 0.000 1.074 220 H CA 0.888 57.000 56.048 0.107 0.000 1.354 220 H CB 0.364 30.231 29.762 0.175 0.000 1.397 220 H HN 0.575 8.855 8.280 -0.000 0.000 0.516 221 E N -0.712 119.502 120.200 0.022 0.000 2.433 221 E HA 0.194 4.529 4.350 -0.024 0.000 0.273 221 E C 0.069 176.489 176.600 -0.300 0.000 0.950 221 E CA -0.654 55.654 56.400 -0.152 0.000 0.796 221 E CB 2.075 31.656 29.700 -0.199 0.000 1.330 221 E HN 0.049 8.409 8.360 -0.000 0.000 0.455 222 K N 0.207 120.408 120.400 -0.331 0.000 2.148 222 K HA -0.143 4.162 4.320 -0.024 0.000 0.204 222 K C 1.875 178.274 176.600 -0.336 0.000 1.050 222 K CA 1.518 57.500 56.287 -0.508 0.000 0.942 222 K CB -0.228 31.723 32.500 -0.915 0.000 0.724 222 K HN 0.492 8.742 8.250 -0.000 0.000 0.446 223 H N -0.266 118.731 119.070 -0.121 0.000 2.491 223 H HA 0.025 4.567 4.556 -0.024 0.000 0.290 223 H C 1.176 176.506 175.328 0.004 0.000 1.050 223 H CA 1.520 57.540 56.048 -0.047 0.000 1.309 223 H CB -0.532 29.214 29.762 -0.027 0.000 1.392 223 H HN 0.226 8.506 8.280 -0.000 0.000 0.554 224 N N 0.503 118.990 118.700 -0.356 0.000 2.166 224 N HA -0.053 4.672 4.740 -0.024 0.000 0.186 224 N C 1.470 176.954 175.510 -0.043 0.000 1.019 224 N CA 1.576 54.544 53.050 -0.137 0.000 0.856 224 N CB -0.027 38.344 38.487 -0.192 0.000 0.993 224 N HN 0.338 8.718 8.380 -0.000 0.000 0.426 225 I N 0.598 121.168 120.570 -0.001 0.000 2.252 225 I HA -0.192 3.963 4.170 -0.024 0.000 0.245 225 I C 1.621 177.796 176.117 0.097 0.000 1.102 225 I CA 0.595 61.945 61.300 0.083 0.000 1.385 225 I CB -0.199 37.933 38.000 0.221 0.000 1.064 225 I HN 0.133 8.343 8.210 -0.000 0.000 0.414 226 I N 0.921 121.570 120.570 0.132 0.000 2.194 226 I HA -0.317 3.838 4.170 -0.024 0.000 0.246 226 I C 2.631 178.787 176.117 0.064 0.000 1.093 226 I CA 1.731 63.101 61.300 0.117 0.000 1.355 226 I CB -1.380 36.692 38.000 0.120 0.000 1.046 226 I HN 0.369 8.579 8.210 -0.000 0.000 0.413 227 Q N 1.317 121.150 119.800 0.054 0.000 2.167 227 Q HA -0.132 4.194 4.340 -0.024 0.000 0.202 227 Q C 2.114 178.109 176.000 -0.008 0.000 0.970 227 Q CA 1.583 57.403 55.803 0.028 0.000 0.855 227 Q CB -0.456 28.304 28.738 0.037 0.000 0.911 227 Q HN 0.555 8.825 8.270 -0.000 0.000 0.438 228 I N -0.373 120.185 120.570 -0.021 0.000 2.179 228 I HA -0.363 3.792 4.170 -0.024 0.000 0.242 228 I C 2.244 178.343 176.117 -0.030 0.000 1.088 228 I CA 0.982 62.251 61.300 -0.051 0.000 1.357 228 I CB -0.453 37.511 38.000 -0.059 0.000 1.051 228 I HN 0.324 8.534 8.210 -0.000 0.000 0.409 229 C N 0.679 119.978 119.300 -0.002 0.000 2.413 229 C HA -0.188 4.257 4.460 -0.024 0.000 0.276 229 C C 2.490 177.484 174.990 0.006 0.000 1.236 229 C CA 0.925 59.948 59.018 0.008 0.000 1.735 229 C CB -1.022 26.731 27.740 0.023 0.000 2.031 229 C HN 0.531 8.761 8.230 -0.000 0.000 0.474 230 D N 0.356 120.761 120.400 0.009 0.000 2.117 230 D HA -0.125 4.500 4.640 -0.024 0.000 0.198 230 D C 2.148 178.445 176.300 -0.006 0.000 0.982 230 D CA 1.073 55.076 54.000 0.007 0.000 0.828 230 D CB -0.486 40.321 40.800 0.012 0.000 0.967 230 D HN 0.538 8.908 8.370 -0.000 0.000 0.464 231 K N 0.205 120.594 120.400 -0.019 0.000 2.057 231 K HA -0.078 4.228 4.320 -0.024 0.000 0.207 231 K C 2.166 178.747 176.600 -0.030 0.000 1.049 231 K CA 0.876 57.143 56.287 -0.033 0.000 0.931 231 K CB -0.012 32.453 32.500 -0.059 0.000 0.714 231 K HN 0.049 8.299 8.250 -0.000 0.000 0.440 232 M N -0.282 119.303 119.600 -0.026 0.000 2.175 232 M HA -0.067 4.399 4.480 -0.024 0.000 0.264 232 M C 2.202 178.503 176.300 0.001 0.000 1.063 232 M CA 1.569 56.863 55.300 -0.010 0.000 1.119 232 M CB -0.316 32.287 32.600 0.005 0.000 1.377 232 M HN 0.367 8.657 8.290 -0.000 0.000 0.415 233 G N 0.243 109.044 108.800 0.002 0.000 2.446 233 G HA2 -0.189 3.756 3.960 -0.024 0.000 0.217 233 G HA3 -0.189 3.756 3.960 -0.024 0.000 0.217 233 G C 1.632 176.533 174.900 0.001 0.000 1.168 233 G CA 1.043 46.146 45.100 0.004 0.000 0.771 233 G HN 0.535 8.825 8.290 -0.000 0.000 0.551 234 A N 0.391 123.209 122.820 -0.004 0.000 1.933 234 A HA 0.149 4.454 4.320 -0.024 0.000 0.218 234 A C 2.293 179.873 177.584 -0.006 0.000 1.175 234 A CA 1.057 53.091 52.037 -0.006 0.000 0.628 234 A CB -0.331 18.663 19.000 -0.010 0.000 0.814 234 A HN 0.355 8.505 8.150 -0.000 0.000 0.444 235 L N -1.561 119.656 121.223 -0.009 0.000 2.610 235 L HA 0.047 4.373 4.340 -0.024 0.000 0.232 235 L C 0.457 177.327 176.870 0.001 0.000 1.149 235 L CA -0.137 54.700 54.840 -0.007 0.000 0.872 235 L CB -0.129 41.923 42.059 -0.011 0.000 0.992 235 L HN 0.303 8.533 8.230 -0.000 0.000 0.447 236 R N 0.851 121.352 120.500 0.003 0.000 3.423 236 R HA -0.173 4.152 4.340 -0.024 0.000 0.271 236 R C 0.295 176.600 176.300 0.010 0.000 1.093 236 R CA 0.983 57.086 56.100 0.005 0.000 0.730 236 R CB -2.301 28.000 30.300 0.003 0.000 1.190 236 R HN 0.600 8.870 8.270 -0.000 0.000 0.437 237 I N -3.268 117.311 120.570 0.015 0.000 3.658 237 I HA 0.168 4.323 4.170 -0.024 0.000 0.328 237 I C 1.466 177.602 176.117 0.031 0.000 1.567 237 I CA 0.086 61.401 61.300 0.026 0.000 1.078 237 I CB 0.974 39.000 38.000 0.043 0.000 1.267 237 I HN 0.021 8.231 8.210 -0.000 0.000 0.495 238 S N 0.850 116.563 115.700 0.022 0.000 2.440 238 S HA -0.241 4.215 4.470 -0.024 0.000 0.238 238 S C 1.568 176.181 174.600 0.023 0.000 1.010 238 S CA 1.444 59.658 58.200 0.023 0.000 0.972 238 S CB -0.635 62.574 63.200 0.016 0.000 0.774 238 S HN 0.740 9.050 8.310 -0.000 0.000 0.501 239 D N 1.161 121.571 120.400 0.016 0.000 2.350 239 D HA -0.123 4.502 4.640 -0.024 0.000 0.216 239 D C 1.493 177.803 176.300 0.016 0.000 0.968 239 D CA 0.444 54.451 54.000 0.010 0.000 0.894 239 D CB -0.314 40.487 40.800 0.001 0.000 0.909 239 D HN 0.306 8.676 8.370 -0.000 0.000 0.520 240 R N 0.151 120.670 120.500 0.032 0.000 2.334 240 R HA 0.308 4.633 4.340 -0.024 0.000 0.216 240 R C 0.483 176.833 176.300 0.084 0.000 0.905 240 R CA -0.338 55.789 56.100 0.045 0.000 1.064 240 R CB 0.048 30.385 30.300 0.061 0.000 1.046 240 R HN 0.306 8.576 8.270 -0.000 0.000 0.508 241 I N 1.675 122.289 120.570 0.073 0.000 2.347 241 I HA 0.009 4.165 4.170 -0.024 0.000 0.294 241 I C 1.722 177.892 176.117 0.088 0.000 1.090 241 I CA 0.108 61.460 61.300 0.087 0.000 1.314 241 I CB 0.937 38.972 38.000 0.059 0.000 1.423 241 I HN 0.110 8.320 8.210 -0.000 0.000 0.503 242 E N 6.791 127.072 120.200 0.135 0.000 2.042 242 E HA 0.022 4.357 4.350 -0.024 0.000 0.189 242 E C 0.764 177.453 176.600 0.148 0.000 0.974 242 E CA 0.577 57.058 56.400 0.136 0.000 0.806 242 E CB 0.566 30.372 29.700 0.177 0.000 0.769 242 E HN 0.542 8.902 8.360 -0.000 0.000 0.451 243 R N -1.075 119.565 120.500 0.233 0.000 2.535 243 R HA 0.434 4.759 4.340 -0.024 0.000 0.274 243 R C -0.873 175.570 176.300 0.238 0.000 1.090 243 R CA 0.359 56.588 56.100 0.216 0.000 0.930 243 R CB 1.667 32.101 30.300 0.223 0.000 1.223 243 R HN 0.324 8.594 8.270 -0.000 0.000 0.441 244 G N 3.398 112.239 108.800 0.070 0.000 2.409 244 G HA2 -0.093 3.852 3.960 -0.024 0.000 0.421 244 G HA3 -0.093 3.852 3.960 -0.024 0.000 0.421 244 G C -2.859 171.955 174.900 -0.143 0.000 1.259 244 G CA -0.694 44.315 45.100 -0.152 0.000 1.011 244 G HN 0.540 8.830 8.290 -0.000 0.000 0.497 245 P HA 0.648 5.068 4.420 -0.000 0.000 0.276 245 P C 0.389 177.141 177.300 -0.913 0.000 1.261 245 P CA 0.663 63.389 63.100 -0.625 0.000 0.800 245 P CB 1.498 32.950 31.700 -0.413 0.000 1.066 246 G N -0.438 107.260 108.800 -1.836 0.000 2.606 246 G HA2 0.516 4.461 3.960 -0.024 0.000 0.300 246 G HA3 0.516 4.461 3.960 -0.024 0.000 0.300 246 G C -1.661 172.019 174.900 -2.034 0.000 1.360 246 G CA -0.784 43.235 45.100 -1.802 0.000 0.783 246 G HN 0.610 8.900 8.290 -0.000 0.000 0.484 247 R N 0.108 119.480 120.500 -1.879 0.000 2.338 247 R HA 0.519 4.844 4.340 -0.024 0.000 0.317 247 R C -0.523 175.548 176.300 -0.382 0.000 0.968 247 R CA -0.599 54.978 56.100 -0.872 0.000 0.849 247 R CB 0.207 30.120 30.300 -0.645 0.000 1.128 247 R HN 0.536 8.806 8.270 -0.000 0.000 0.448 248 H N 2.278 121.294 119.070 -0.091 0.000 2.707 248 H HA 0.156 4.698 4.556 -0.024 0.000 0.359 248 H C 0.959 176.097 175.328 -0.317 0.000 1.113 248 H CA 0.820 56.730 56.048 -0.229 0.000 1.422 248 H CB 1.707 31.313 29.762 -0.260 0.000 1.443 248 H HN 0.903 9.183 8.280 -0.000 0.000 0.591 249 G N 2.453 111.083 108.800 -0.283 0.000 2.551 249 G HA2 -0.091 3.854 3.960 -0.024 0.000 0.214 249 G HA3 -0.091 3.854 3.960 -0.024 0.000 0.214 249 G C 0.196 174.694 174.900 -0.670 0.000 1.250 249 G CA -0.037 44.736 45.100 -0.546 0.000 0.825 249 G HN 0.460 8.750 8.290 -0.000 0.000 0.549 250 V N 2.115 121.387 119.914 -1.070 0.000 2.509 250 V HA 0.264 4.369 4.120 -0.024 0.000 0.297 250 V C 1.404 177.108 176.094 -0.650 0.000 1.014 250 V CA 1.570 63.312 62.300 -0.929 0.000 1.127 250 V CB 0.358 31.284 31.823 -1.496 0.000 0.925 250 V HN 1.328 9.518 8.190 -0.000 0.000 0.480 251 S N 3.658 119.162 115.700 -0.327 0.000 2.154 251 S HA -0.299 4.156 4.470 -0.024 0.000 0.247 251 S C 1.019 175.632 174.600 0.021 0.000 1.170 251 S CA 1.350 59.460 58.200 -0.150 0.000 1.419 251 S CB -1.859 61.222 63.200 -0.198 0.000 1.768 251 S HN 1.849 10.159 8.310 -0.000 0.000 0.587 252 N N 0.856 119.525 118.700 -0.051 0.000 2.732 252 N HA -0.185 4.541 4.740 -0.024 0.000 0.250 252 N C 0.034 175.512 175.510 -0.053 0.000 1.097 252 N CA 2.086 55.088 53.050 -0.079 0.000 0.812 252 N CB -1.660 36.823 38.487 -0.007 0.000 1.148 252 N HN 1.917 10.297 8.380 -0.000 0.000 0.572 253 A N -0.204 122.570 122.820 -0.076 0.000 2.371 253 A HA 0.475 4.781 4.320 -0.024 0.000 0.257 253 A C 0.131 177.664 177.584 -0.086 0.000 1.089 253 A CA -0.333 51.567 52.037 -0.229 0.000 0.794 253 A CB 0.104 18.560 19.000 -0.906 0.000 1.029 253 A HN 0.326 8.476 8.150 -0.000 0.000 0.488 254 F N 2.156 121.970 119.950 -0.227 0.000 2.429 254 F HA 0.523 5.036 4.527 -0.024 0.000 0.348 254 F C -0.068 175.605 175.800 -0.213 0.000 1.109 254 F CA 0.419 58.286 58.000 -0.222 0.000 1.232 254 F CB 0.583 39.501 39.000 -0.137 0.000 1.157 254 F HN 0.616 8.916 8.300 -0.000 0.000 0.564 255 Y N 4.483 124.321 120.300 -0.769 0.000 2.625 255 Y HA 0.761 5.297 4.550 -0.023 0.000 0.338 255 Y C -2.383 173.166 175.900 -0.584 0.000 1.123 255 Y CA -1.807 55.939 58.100 -0.589 0.000 1.046 255 Y CB 1.251 39.214 38.460 -0.827 0.000 1.299 255 Y HN 0.711 8.991 8.280 -0.000 0.000 0.464 256 L N 2.245 123.294 121.223 -0.290 0.000 2.505 256 L HA 0.624 4.950 4.340 -0.024 0.000 0.259 256 L C -2.428 174.289 176.870 -0.254 0.000 0.952 256 L CA -0.894 53.807 54.840 -0.231 0.000 0.840 256 L CB 2.129 44.110 42.059 -0.130 0.000 1.358 256 L HN 0.713 8.943 8.230 -0.000 0.000 0.409 257 Y N 5.292 125.711 120.300 0.200 0.000 2.350 257 Y HA 0.758 5.294 4.550 -0.023 0.000 0.338 257 Y C 0.136 176.136 175.900 0.167 0.000 0.961 257 Y CA -0.674 57.555 58.100 0.215 0.000 1.100 257 Y CB 1.632 40.281 38.460 0.316 0.000 1.179 257 Y HN 0.605 8.885 8.280 -0.000 0.000 0.454 258 I N 0.627 121.383 120.570 0.310 0.000 3.042 258 I HA 0.750 4.905 4.170 -0.024 0.000 0.310 258 I C -1.690 174.563 176.117 0.227 0.000 1.117 258 I CA -1.347 60.104 61.300 0.251 0.000 1.003 258 I CB 2.666 40.820 38.000 0.257 0.000 1.228 258 I HN 0.420 8.630 8.210 -0.000 0.000 0.443 259 L N 3.122 124.417 121.223 0.121 0.000 2.356 259 L HA 0.438 4.763 4.340 -0.024 0.000 0.277 259 L C -0.658 175.963 176.870 -0.415 0.000 0.996 259 L CA -0.792 54.018 54.840 -0.050 0.000 0.822 259 L CB 1.689 43.711 42.059 -0.062 0.000 1.256 259 L HN 0.729 8.959 8.230 -0.000 0.000 0.413 260 D N 3.465 123.501 120.400 -0.606 0.000 2.398 260 D HA 0.187 4.812 4.640 -0.024 0.000 0.247 260 D C -2.072 173.793 176.300 -0.726 0.000 1.227 260 D CA -1.919 51.290 54.000 -1.318 0.000 0.980 260 D CB 0.643 40.983 40.800 -0.766 0.000 1.106 260 D HN 0.129 8.499 8.370 -0.000 0.000 0.493 261 P HA -0.094 4.326 4.420 -0.000 0.000 0.217 261 P C 0.296 177.448 177.300 -0.246 0.000 1.148 261 P CA 1.220 64.131 63.100 -0.316 0.000 0.828 261 P CB 0.122 31.708 31.700 -0.190 0.000 0.783 262 D N -1.295 118.939 120.400 -0.276 0.000 2.325 262 D HA 0.044 4.669 4.640 -0.024 0.000 0.225 262 D C 0.274 176.338 176.300 -0.393 0.000 1.096 262 D CA 0.101 53.896 54.000 -0.342 0.000 0.844 262 D CB -0.259 40.271 40.800 -0.451 0.000 0.925 262 D HN 0.083 8.453 8.370 -0.000 0.000 0.513 263 N N 0.796 119.320 118.700 -0.294 0.000 2.863 263 N HA -0.167 4.558 4.740 -0.024 0.000 0.245 263 N C -0.256 175.174 175.510 -0.132 0.000 1.001 263 N CA 0.635 53.561 53.050 -0.206 0.000 0.901 263 N CB -1.532 36.856 38.487 -0.166 0.000 1.124 263 N HN 0.468 8.848 8.380 -0.000 0.000 0.582 264 H N 1.190 120.221 119.070 -0.064 0.000 3.070 264 H HA 0.056 4.597 4.556 -0.025 0.000 0.313 264 H C 1.225 176.570 175.328 0.029 0.000 0.997 264 H CA 0.406 56.453 56.048 -0.002 0.000 1.438 264 H CB 0.421 30.224 29.762 0.069 0.000 1.455 264 H HN 0.182 8.462 8.280 -0.000 0.000 0.575 265 R N 3.954 124.561 120.500 0.179 0.000 2.265 265 R HA 0.223 4.548 4.340 -0.024 0.000 0.314 265 R C -0.681 175.814 176.300 0.324 0.000 1.053 265 R CA -0.577 55.638 56.100 0.192 0.000 0.931 265 R CB 0.269 30.622 30.300 0.088 0.000 1.024 265 R HN 0.407 8.677 8.270 -0.000 0.000 0.457 266 I N 3.751 124.534 120.570 0.355 0.000 2.406 266 I HA 0.260 4.415 4.170 -0.024 0.000 0.290 266 I C 0.028 176.345 176.117 0.332 0.000 0.999 266 I CA -0.514 61.026 61.300 0.399 0.000 1.124 266 I CB 1.551 39.835 38.000 0.473 0.000 1.289 266 I HN 0.730 8.940 8.210 -0.000 0.000 0.441 267 E N 6.212 126.570 120.200 0.263 0.000 2.204 267 E HA 0.533 4.869 4.350 -0.024 0.000 0.276 267 E C -1.271 175.402 176.600 0.121 0.000 0.974 267 E CA -0.659 55.776 56.400 0.058 0.000 0.815 267 E CB 1.607 31.261 29.700 -0.078 0.000 1.119 267 E HN 0.315 8.675 8.360 -0.000 0.000 0.393 268 I N 3.853 124.468 120.570 0.075 0.000 2.474 268 I HA 0.377 4.532 4.170 -0.024 0.000 0.294 268 I C -0.875 175.365 176.117 0.205 0.000 1.005 268 I CA -0.718 60.672 61.300 0.149 0.000 1.113 268 I CB 0.970 39.022 38.000 0.086 0.000 1.289 268 I HN 0.613 8.823 8.210 -0.000 0.000 0.436 269 Y N 3.426 123.784 120.300 0.097 0.000 2.482 269 Y HA 0.549 5.085 4.550 -0.024 0.000 0.334 269 Y C -0.814 175.178 175.900 0.154 0.000 1.091 269 Y CA -0.285 57.906 58.100 0.152 0.000 1.027 269 Y CB 2.062 40.639 38.460 0.195 0.000 1.306 269 Y HN 0.679 8.959 8.280 -0.000 0.000 0.446 270 T N 4.805 119.334 114.554 -0.040 0.000 2.932 270 T HA 0.336 4.671 4.350 -0.024 0.000 0.318 270 T C -1.389 173.251 174.700 -0.100 0.000 1.265 270 T CA -0.195 61.912 62.100 0.011 0.000 1.036 270 T CB 1.426 70.337 68.868 0.071 0.000 1.209 270 T HN 0.825 9.065 8.240 -0.000 0.000 0.484 271 Q N 1.365 121.161 119.800 -0.006 0.000 2.479 271 Q HA -0.135 4.191 4.340 -0.024 0.000 0.282 271 Q C -0.384 175.619 176.000 0.005 0.000 1.279 271 Q CA 0.968 56.785 55.803 0.024 0.000 0.815 271 Q CB -1.221 27.536 28.738 0.031 0.000 1.204 271 Q HN 0.881 9.151 8.270 -0.000 0.000 0.444 272 D N -0.056 120.330 120.400 -0.022 0.000 2.398 272 D HA 0.249 4.875 4.640 -0.024 0.000 0.264 272 D C 0.335 176.691 176.300 0.092 0.000 1.263 272 D CA 0.136 54.142 54.000 0.011 0.000 1.037 272 D CB 0.287 41.085 40.800 -0.002 0.000 1.101 272 D HN 0.256 8.626 8.370 -0.000 0.000 0.551 273 Y N -3.623 116.718 120.300 0.069 0.000 2.659 273 Y HA 0.495 5.030 4.550 -0.025 0.000 0.333 273 Y C -0.602 175.358 175.900 0.099 0.000 1.064 273 Y CA -1.967 56.181 58.100 0.081 0.000 1.141 273 Y CB 0.317 38.806 38.460 0.049 0.000 1.316 273 Y HN 0.396 8.676 8.280 -0.000 0.000 0.509 274 Y N 1.507 121.930 120.300 0.204 0.000 2.377 274 Y HA 0.362 4.898 4.550 -0.023 0.000 0.330 274 Y C 0.829 176.786 175.900 0.095 0.000 1.108 274 Y CA 0.515 58.666 58.100 0.085 0.000 1.308 274 Y CB 1.305 39.815 38.460 0.083 0.000 1.216 274 Y HN 0.859 9.139 8.280 -0.000 0.000 0.518 275 T N 0.244 114.303 114.554 -0.825 0.000 3.111 275 T HA 0.202 4.538 4.350 -0.024 0.000 0.284 275 T C 1.457 175.637 174.700 -0.867 0.000 0.983 275 T CA 0.203 61.870 62.100 -0.722 0.000 0.900 275 T CB -0.035 68.385 68.868 -0.747 0.000 1.132 275 T HN 0.750 8.990 8.240 -0.000 0.000 0.531 276 G N 1.184 109.111 108.800 -1.455 0.000 2.559 276 G HA2 0.041 3.987 3.960 -0.024 0.000 0.216 276 G HA3 0.041 3.987 3.960 -0.024 0.000 0.216 276 G C 0.091 174.904 174.900 -0.144 0.000 1.126 276 G CA -0.006 44.751 45.100 -0.571 0.000 0.778 276 G HN 0.440 8.730 8.290 -0.000 0.000 0.543 277 D N 0.256 120.574 120.400 -0.136 0.000 2.345 277 D HA 0.219 4.845 4.640 -0.024 0.000 0.247 277 D C -0.964 175.367 176.300 0.051 0.000 1.108 277 D CA -1.958 52.089 54.000 0.078 0.000 0.894 277 D CB 1.847 42.737 40.800 0.151 0.000 1.203 277 D HN 0.026 8.396 8.370 -0.000 0.000 0.430 278 P HA -0.096 4.324 4.420 -0.000 0.000 0.221 278 P C 0.240 177.571 177.300 0.053 0.000 1.150 278 P CA 0.859 63.991 63.100 0.054 0.000 0.800 278 P CB 0.295 32.019 31.700 0.040 0.000 0.787 279 D N -1.287 119.145 120.400 0.053 0.000 2.395 279 D HA 0.001 4.626 4.640 -0.024 0.000 0.226 279 D C 0.195 176.527 176.300 0.053 0.000 1.146 279 D CA -0.907 53.122 54.000 0.049 0.000 0.830 279 D CB -1.648 39.178 40.800 0.043 0.000 0.958 279 D HN -0.028 8.342 8.370 -0.000 0.000 0.501 280 N N 2.118 120.852 118.700 0.057 0.000 2.223 280 N HA -0.010 4.715 4.740 -0.024 0.000 0.271 280 N C -2.305 173.243 175.510 0.063 0.000 1.315 280 N CA -0.566 52.518 53.050 0.056 0.000 0.835 280 N CB 0.372 38.884 38.487 0.042 0.000 1.066 280 N HN -0.011 8.369 8.380 -0.000 0.000 0.486 281 P HA 0.079 4.499 4.420 -0.000 0.000 0.267 281 P C -0.719 176.615 177.300 0.055 0.000 1.205 281 P CA -0.061 63.060 63.100 0.036 0.000 0.765 281 P CB 0.717 32.419 31.700 0.003 0.000 0.828 282 T N 3.694 118.283 114.554 0.059 0.000 2.910 282 T HA 0.436 4.772 4.350 -0.024 0.000 0.293 282 T C 0.456 175.189 174.700 0.056 0.000 1.015 282 T CA -0.068 62.080 62.100 0.081 0.000 1.094 282 T CB 0.204 69.124 68.868 0.087 0.000 0.968 282 T HN 0.198 8.438 8.240 -0.000 0.000 0.521 283 I N 2.167 122.786 120.570 0.081 0.000 2.436 283 I HA 0.324 4.479 4.170 -0.024 0.000 0.289 283 I C -0.029 176.145 176.117 0.095 0.000 1.010 283 I CA -0.685 60.634 61.300 0.032 0.000 1.098 283 I CB 2.067 40.098 38.000 0.052 0.000 1.266 283 I HN 0.502 8.712 8.210 -0.000 0.000 0.434 284 T N 4.319 118.889 114.554 0.026 0.000 2.792 284 T HA 0.411 4.747 4.350 -0.024 0.000 0.280 284 T C -1.002 173.737 174.700 0.066 0.000 0.990 284 T CA -0.440 61.738 62.100 0.131 0.000 0.960 284 T CB 0.660 69.599 68.868 0.119 0.000 0.939 284 T HN 0.273 8.513 8.240 -0.000 0.000 0.439 285 W N 2.226 123.570 121.300 0.072 0.000 2.516 285 W HA 0.456 5.100 4.660 -0.025 0.000 0.343 285 W C 0.726 177.314 176.519 0.116 0.000 1.094 285 W CA -0.905 56.490 57.345 0.083 0.000 1.250 285 W CB 0.612 30.093 29.460 0.035 0.000 1.308 285 W HN 0.475 8.655 8.180 -0.000 0.000 0.588 286 N N 1.125 120.047 118.700 0.370 0.000 2.529 286 N HA 0.012 4.737 4.740 -0.024 0.000 0.278 286 N C 0.765 176.387 175.510 0.186 0.000 1.146 286 N CA -0.058 53.181 53.050 0.316 0.000 0.980 286 N CB 1.828 40.576 38.487 0.435 0.000 1.124 286 N HN 0.485 8.865 8.380 -0.000 0.000 0.458 287 V N 4.422 124.347 119.914 0.019 0.000 2.594 287 V HA -0.173 3.932 4.120 -0.024 0.000 0.253 287 V C 1.560 177.415 176.094 -0.398 0.000 1.069 287 V CA 1.664 63.771 62.300 -0.321 0.000 1.082 287 V CB -0.775 30.548 31.823 -0.834 0.000 0.680 287 V HN 0.691 8.881 8.190 -0.000 0.000 0.469 288 H N -1.165 117.895 119.070 -0.018 0.000 2.539 288 H HA 0.124 4.666 4.556 -0.024 0.000 0.267 288 H C 0.616 175.523 175.328 -0.701 0.000 0.982 288 H CA 0.370 56.345 56.048 -0.122 0.000 1.146 288 H CB -0.010 29.924 29.762 0.286 0.000 1.382 288 H HN 0.423 8.703 8.280 -0.000 0.000 0.577 289 D N 1.849 121.891 120.400 -0.598 0.000 2.349 289 D HA -0.089 4.536 4.640 -0.024 0.000 0.266 289 D C 1.004 177.050 176.300 -0.423 0.000 1.293 289 D CA 0.027 53.522 54.000 -0.842 0.000 0.926 289 D CB 0.185 40.971 40.800 -0.024 0.000 1.090 289 D HN 0.099 8.469 8.370 -0.000 0.000 0.502 290 N N 2.861 121.282 118.700 -0.464 0.000 2.609 290 N HA -0.117 4.609 4.740 -0.024 0.000 0.190 290 N C 0.856 176.309 175.510 -0.095 0.000 1.157 290 N CA 0.813 53.740 53.050 -0.205 0.000 0.918 290 N CB 0.197 38.622 38.487 -0.104 0.000 0.978 290 N HN 0.500 8.880 8.380 -0.000 0.000 0.448 291 Q N -0.974 118.809 119.800 -0.029 0.000 2.219 291 Q HA 0.109 4.434 4.340 -0.024 0.000 0.209 291 Q C 1.436 177.465 176.000 0.048 0.000 0.854 291 Q CA -0.239 55.614 55.803 0.084 0.000 0.960 291 Q CB 0.508 29.305 28.738 0.097 0.000 1.116 291 Q HN 0.490 8.760 8.270 -0.000 0.000 0.500 292 R N 0.085 120.498 120.500 -0.145 0.000 2.119 292 R HA 0.022 4.348 4.340 -0.024 0.000 0.222 292 R C 1.607 177.498 176.300 -0.681 0.000 1.088 292 R CA 0.773 56.480 56.100 -0.655 0.000 0.984 292 R CB 0.098 30.205 30.300 -0.320 0.000 0.884 292 R HN 0.050 8.320 8.270 -0.000 0.000 0.447 293 R N 0.082 120.363 120.500 -0.365 0.000 2.102 293 R HA 0.101 4.426 4.340 -0.024 0.000 0.208 293 R C -0.198 175.975 176.300 -0.211 0.000 1.131 293 R CA 0.639 56.539 56.100 -0.333 0.000 1.054 293 R CB 0.234 30.331 30.300 -0.338 0.000 0.954 293 R HN 0.142 8.412 8.270 -0.000 0.000 0.465 294 D N -0.077 120.233 120.400 -0.149 0.000 2.414 294 D HA 0.025 4.651 4.640 -0.024 0.000 0.232 294 D C 0.358 176.650 176.300 -0.013 0.000 1.070 294 D CA -0.407 53.548 54.000 -0.074 0.000 0.839 294 D CB 0.630 41.406 40.800 -0.039 0.000 1.079 294 D HN 0.187 8.557 8.370 -0.000 0.000 0.521 295 W N 4.470 125.597 121.300 -0.287 0.000 2.364 295 W HA -0.148 4.496 4.660 -0.025 0.000 0.281 295 W C 0.004 176.573 176.519 0.084 0.000 1.219 295 W CA 0.275 57.540 57.345 -0.133 0.000 1.220 295 W CB 0.133 29.492 29.460 -0.167 0.000 1.127 295 W HN 0.626 8.806 8.180 -0.000 0.000 0.556 296 W N 0.097 121.453 121.300 0.093 0.000 3.256 296 W HA 0.279 4.926 4.660 -0.023 0.000 0.269 296 W C 1.875 178.367 176.519 -0.045 0.000 1.310 296 W CA 0.618 57.948 57.345 -0.026 0.000 1.673 296 W CB -1.366 28.110 29.460 0.026 0.000 1.115 296 W HN 0.201 8.381 8.180 -0.000 0.000 0.686 297 G N 0.971 109.842 108.800 0.117 0.000 2.184 297 G HA2 -0.306 3.639 3.960 -0.024 0.000 0.264 297 G HA3 -0.306 3.639 3.960 -0.024 0.000 0.264 297 G C 0.420 175.340 174.900 0.033 0.000 0.975 297 G CA 0.033 45.163 45.100 0.050 0.000 0.642 297 G HN 0.159 8.449 8.290 -0.000 0.000 0.536 298 N N 1.895 120.645 118.700 0.083 0.000 2.441 298 N HA 0.321 5.046 4.740 -0.024 0.000 0.251 298 N C -2.021 173.484 175.510 -0.009 0.000 1.242 298 N CA -0.613 52.474 53.050 0.061 0.000 0.898 298 N CB 0.741 39.290 38.487 0.103 0.000 1.100 298 N HN 0.249 8.629 8.380 -0.000 0.000 0.443 299 P HA 0.060 4.480 4.420 -0.000 0.000 0.275 299 P C -0.407 176.852 177.300 -0.068 0.000 1.227 299 P CA -0.250 62.822 63.100 -0.045 0.000 0.781 299 P CB 0.657 32.353 31.700 -0.005 0.000 0.906 300 V N 4.104 123.969 119.914 -0.082 0.000 2.470 300 V HA 0.024 4.129 4.120 -0.024 0.000 0.276 300 V C 1.035 177.081 176.094 -0.079 0.000 1.040 300 V CA -0.422 61.774 62.300 -0.172 0.000 1.008 300 V CB 0.787 32.447 31.823 -0.271 0.000 0.990 300 V HN 0.424 8.614 8.190 -0.000 0.000 0.477 301 V N 5.489 125.345 119.914 -0.097 0.000 2.585 301 V HA 0.201 4.307 4.120 -0.024 0.000 0.296 301 V C -0.894 175.234 176.094 0.057 0.000 1.035 301 V CA -0.940 61.352 62.300 -0.015 0.000 1.084 301 V CB 0.445 32.268 31.823 0.000 0.000 0.953 301 V HN 0.710 8.900 8.190 -0.000 0.000 0.483 302 P HA -0.156 4.264 4.420 -0.000 0.000 0.218 302 P C 1.847 179.249 177.300 0.170 0.000 1.148 302 P CA 2.079 65.296 63.100 0.195 0.000 0.822 302 P CB -0.023 31.758 31.700 0.134 0.000 0.784 303 S N -2.208 113.550 115.700 0.096 0.000 2.419 303 S HA -0.184 4.272 4.470 -0.024 0.000 0.233 303 S C 1.960 176.583 174.600 0.038 0.000 1.016 303 S CA 0.481 58.713 58.200 0.053 0.000 0.974 303 S CB -1.722 61.489 63.200 0.018 0.000 0.786 303 S HN 0.184 8.494 8.310 -0.000 0.000 0.492 304 W N 1.324 122.542 121.300 -0.137 0.000 2.374 304 W HA -0.050 4.596 4.660 -0.023 0.000 0.288 304 W C 1.558 178.012 176.519 -0.108 0.000 1.218 304 W CA 1.223 58.439 57.345 -0.214 0.000 1.245 304 W CB -0.243 28.961 29.460 -0.427 0.000 1.126 304 W HN 0.330 8.510 8.180 -0.000 0.000 0.545 305 Y N -0.980 119.501 120.300 0.302 0.000 2.365 305 Y HA -0.075 4.460 4.550 -0.025 0.000 0.293 305 Y C 2.803 178.746 175.900 0.072 0.000 1.119 305 Y CA 1.812 60.035 58.100 0.204 0.000 1.203 305 Y CB -1.121 37.453 38.460 0.190 0.000 1.026 305 Y HN -0.035 8.245 8.280 -0.000 0.000 0.549 306 T N -3.152 111.504 114.554 0.170 0.000 3.031 306 T HA 0.067 4.402 4.350 -0.024 0.000 0.254 306 T C 0.503 175.196 174.700 -0.011 0.000 1.060 306 T CA 0.212 62.361 62.100 0.082 0.000 1.135 306 T CB 0.005 68.918 68.868 0.076 0.000 0.896 306 T HN -0.099 8.141 8.240 -0.000 0.000 0.472 307 E N 1.681 121.832 120.200 -0.082 0.000 2.216 307 E HA 0.763 5.098 4.350 -0.024 0.000 0.279 307 E C -0.597 175.839 176.600 -0.274 0.000 0.997 307 E CA -0.518 55.796 56.400 -0.144 0.000 0.817 307 E CB 1.761 31.381 29.700 -0.132 0.000 1.096 307 E HN 0.569 8.929 8.360 -0.000 0.000 0.393 308 A N 1.595 124.295 122.820 -0.200 0.000 2.610 308 A HA 0.537 4.843 4.320 -0.024 0.000 0.291 308 A C -0.695 176.835 177.584 -0.090 0.000 1.086 308 A CA -0.733 51.174 52.037 -0.216 0.000 0.677 308 A CB 1.208 20.095 19.000 -0.188 0.000 1.278 308 A HN 0.413 8.563 8.150 -0.000 0.000 0.414 309 S N 1.038 116.721 115.700 -0.028 0.000 2.565 309 S HA 0.304 4.759 4.470 -0.024 0.000 0.276 309 S C 0.168 174.776 174.600 0.013 0.000 1.326 309 S CA -0.411 57.821 58.200 0.054 0.000 1.045 309 S CB 0.512 63.831 63.200 0.198 0.000 0.918 309 S HN 0.560 8.870 8.310 -0.000 0.000 0.505 310 K N 1.258 121.662 120.400 0.006 0.000 2.494 310 K HA 0.187 4.493 4.320 -0.024 0.000 0.273 310 K C 0.089 176.666 176.600 -0.038 0.000 0.970 310 K CA -0.206 56.063 56.287 -0.030 0.000 0.963 310 K CB 0.167 32.650 32.500 -0.028 0.000 0.913 310 K HN 0.462 8.712 8.250 -0.000 0.000 0.502 311 V N 0.409 120.265 119.914 -0.097 0.000 2.715 311 V HA 0.550 4.656 4.120 -0.024 0.000 0.310 311 V C -0.590 175.433 176.094 -0.119 0.000 1.054 311 V CA -1.107 61.123 62.300 -0.117 0.000 0.928 311 V CB 1.256 32.965 31.823 -0.190 0.000 1.007 311 V HN 0.557 8.747 8.190 -0.000 0.000 0.437 312 L N 3.077 124.239 121.223 -0.100 0.000 2.344 312 L HA 0.587 4.913 4.340 -0.024 0.000 0.272 312 L C 0.122 176.932 176.870 -0.100 0.000 1.035 312 L CA -0.789 53.997 54.840 -0.089 0.000 0.807 312 L CB 1.570 43.589 42.059 -0.067 0.000 1.237 312 L HN 0.974 9.204 8.230 -0.000 0.000 0.442 313 D N 0.934 121.283 120.400 -0.086 0.000 2.440 313 D HA 0.124 4.749 4.640 -0.024 0.000 0.269 313 D C 0.805 177.069 176.300 -0.061 0.000 1.249 313 D CA -0.395 53.558 54.000 -0.079 0.000 1.055 313 D CB 0.628 41.387 40.800 -0.069 0.000 1.104 313 D HN 0.372 8.742 8.370 -0.000 0.000 0.561 314 L N -0.816 120.380 121.223 -0.045 0.000 2.610 314 L HA 0.040 4.366 4.340 -0.024 0.000 0.232 314 L C 0.682 177.555 176.870 0.005 0.000 1.149 314 L CA 0.567 55.392 54.840 -0.025 0.000 0.872 314 L CB -0.330 41.726 42.059 -0.005 0.000 0.992 314 L HN 0.281 8.511 8.230 -0.000 0.000 0.447 315 D N 0.140 120.537 120.400 -0.005 0.000 2.349 315 D HA 0.116 4.742 4.640 -0.024 0.000 0.214 315 D C 1.597 177.896 176.300 -0.002 0.000 1.063 315 D CA 0.851 54.854 54.000 0.005 0.000 0.847 315 D CB 0.899 41.698 40.800 -0.001 0.000 0.933 315 D HN 0.302 8.672 8.370 -0.000 0.000 0.513 316 G N 1.176 109.967 108.800 -0.014 0.000 2.141 316 G HA2 -0.237 3.709 3.960 -0.024 0.000 0.242 316 G HA3 -0.237 3.709 3.960 -0.024 0.000 0.242 316 G C 0.128 175.014 174.900 -0.025 0.000 0.982 316 G CA -0.400 44.690 45.100 -0.017 0.000 0.662 316 G HN 0.199 8.489 8.290 -0.000 0.000 0.527 317 N N -0.014 118.668 118.700 -0.031 0.000 2.456 317 N HA 0.475 5.200 4.740 -0.024 0.000 0.296 317 N C 0.508 175.986 175.510 -0.052 0.000 1.102 317 N CA -0.419 52.609 53.050 -0.037 0.000 0.924 317 N CB 2.010 40.478 38.487 -0.033 0.000 1.186 317 N HN 0.046 8.426 8.380 -0.000 0.000 0.492 318 V N 2.429 122.312 119.914 -0.053 0.000 2.557 318 V HA -0.082 4.023 4.120 -0.024 0.000 0.301 318 V C 0.883 176.928 176.094 -0.083 0.000 1.026 318 V CA 0.052 62.312 62.300 -0.067 0.000 1.137 318 V CB 0.030 31.819 31.823 -0.057 0.000 0.917 318 V HN 0.450 8.640 8.190 -0.000 0.000 0.484 319 Q N 3.396 123.128 119.800 -0.114 0.000 2.300 319 Q HA 0.073 4.399 4.340 -0.024 0.000 0.280 319 Q C 0.410 176.337 176.000 -0.121 0.000 1.033 319 Q CA 0.249 55.970 55.803 -0.137 0.000 0.903 319 Q CB 0.485 29.098 28.738 -0.209 0.000 1.195 319 Q HN 0.749 9.019 8.270 -0.000 0.000 0.386 320 E N 2.283 122.421 120.200 -0.103 0.000 2.414 320 E HA -0.014 4.322 4.350 -0.024 0.000 0.263 320 E C -0.576 175.962 176.600 -0.103 0.000 1.000 320 E CA -0.155 56.193 56.400 -0.088 0.000 0.914 320 E CB 0.516 30.173 29.700 -0.072 0.000 0.948 320 E HN 0.355 8.715 8.360 -0.000 0.000 0.444 321 I N 4.897 125.414 120.570 -0.087 0.000 2.395 321 I HA 0.145 4.301 4.170 -0.024 0.000 0.289 321 I C -0.007 176.069 176.117 -0.067 0.000 1.023 321 I CA 0.032 61.281 61.300 -0.086 0.000 1.350 321 I CB 0.981 38.939 38.000 -0.069 0.000 1.409 321 I HN 0.419 8.629 8.210 -0.000 0.000 0.507 322 I N 6.267 126.797 120.570 -0.067 0.000 2.359 322 I HA 0.242 4.398 4.170 -0.024 0.000 0.294 322 I C 0.101 176.197 176.117 -0.034 0.000 0.987 322 I CA -0.455 60.816 61.300 -0.049 0.000 1.225 322 I CB 0.981 38.949 38.000 -0.053 0.000 1.366 322 I HN 0.505 8.715 8.210 -0.000 0.000 0.466 323 E N 5.405 125.590 120.200 -0.025 0.000 2.289 323 E HA 0.200 4.536 4.350 -0.024 0.000 0.278 323 E C -0.139 176.455 176.600 -0.011 0.000 1.032 323 E CA -0.680 55.712 56.400 -0.015 0.000 0.854 323 E CB 0.959 30.652 29.700 -0.011 0.000 1.046 323 E HN 0.361 8.721 8.360 -0.000 0.000 0.409 324 R N 1.725 122.223 120.500 -0.004 0.000 2.522 324 R HA -0.029 4.296 4.340 -0.024 0.000 0.284 324 R C 0.807 177.103 176.300 -0.006 0.000 1.032 324 R CA 0.654 56.752 56.100 -0.005 0.000 1.049 324 R CB 0.412 30.716 30.300 0.005 0.000 0.956 324 R HN 0.654 8.924 8.270 -0.000 0.000 0.422 325 T N -0.667 113.879 114.554 -0.013 0.000 3.015 325 T HA 0.070 4.405 4.350 -0.024 0.000 0.250 325 T C 0.274 174.964 174.700 -0.016 0.000 1.057 325 T CA -0.333 61.760 62.100 -0.010 0.000 1.066 325 T CB 0.141 69.002 68.868 -0.011 0.000 0.959 325 T HN 0.489 8.729 8.240 -0.000 0.000 0.488 326 D N 3.004 123.382 120.400 -0.037 0.000 2.406 326 D HA 0.130 4.755 4.640 -0.024 0.000 0.234 326 D C -0.024 176.251 176.300 -0.042 0.000 1.196 326 D CA 0.198 54.158 54.000 -0.068 0.000 0.881 326 D CB 0.219 40.938 40.800 -0.135 0.000 1.205 326 D HN 0.275 8.645 8.370 -0.000 0.000 0.453 327 D N -0.292 120.088 120.400 -0.035 0.000 2.478 327 D HA -0.019 4.607 4.640 -0.024 0.000 0.234 327 D C 0.247 176.636 176.300 0.147 0.000 1.154 327 D CA 0.383 54.428 54.000 0.075 0.000 0.874 327 D CB 0.351 41.254 40.800 0.171 0.000 1.198 327 D HN 0.108 8.478 8.370 -0.000 0.000 0.455 328 S N 0.926 116.716 115.700 0.150 0.000 2.489 328 S HA 0.059 4.514 4.470 -0.024 0.000 0.277 328 S C 1.092 175.738 174.600 0.077 0.000 1.230 328 S CA -0.607 57.660 58.200 0.112 0.000 1.053 328 S CB 1.200 64.419 63.200 0.032 0.000 0.955 328 S HN 0.446 8.756 8.310 -0.000 0.000 0.488 329 E N 3.620 123.829 120.200 0.015 0.000 2.085 329 E HA -0.179 4.156 4.350 -0.024 0.000 0.194 329 E C 1.782 178.023 176.600 -0.600 0.000 0.994 329 E CA 1.499 57.687 56.400 -0.354 0.000 0.801 329 E CB -0.171 29.338 29.700 -0.318 0.000 0.743 329 E HN 0.855 9.215 8.360 -0.000 0.000 0.453 330 L N 0.928 121.690 121.223 -0.768 0.000 1.971 330 L HA -0.257 4.068 4.340 -0.024 0.000 0.215 330 L C 2.350 179.095 176.870 -0.209 0.000 1.072 330 L CA 1.801 56.292 54.840 -0.580 0.000 0.758 330 L CB -0.306 41.584 42.059 -0.281 0.000 0.889 330 L HN 0.148 8.378 8.230 -0.000 0.000 0.433 331 E N -0.166 119.973 120.200 -0.103 0.000 2.070 331 E HA -0.223 4.113 4.350 -0.024 0.000 0.197 331 E C 2.118 178.725 176.600 0.012 0.000 1.004 331 E CA 1.918 58.312 56.400 -0.011 0.000 0.805 331 E CB -0.710 29.006 29.700 0.027 0.000 0.744 331 E HN 0.663 9.023 8.360 -0.000 0.000 0.451 332 V N -0.744 119.161 119.914 -0.015 0.000 3.461 332 V HA 0.004 4.109 4.120 -0.024 0.000 0.267 332 V C 1.908 178.036 176.094 0.056 0.000 1.186 332 V CA 1.742 64.077 62.300 0.059 0.000 1.154 332 V CB -0.500 31.364 31.823 0.068 0.000 0.802 332 V HN 0.276 8.466 8.190 -0.000 0.000 0.474 333 T N -0.623 113.893 114.554 -0.064 0.000 3.085 333 T HA 0.266 4.601 4.350 -0.024 0.000 0.241 333 T C 1.561 176.264 174.700 0.004 0.000 0.988 333 T CA 1.024 63.097 62.100 -0.046 0.000 1.117 333 T CB -0.034 68.740 68.868 -0.156 0.000 0.978 333 T HN 0.635 8.875 8.240 -0.000 0.000 0.454 334 I N -0.810 119.758 120.570 -0.003 0.000 4.327 334 I HA 0.571 4.726 4.170 -0.024 0.000 0.331 334 I C 1.155 177.306 176.117 0.057 0.000 1.348 334 I CA -0.903 60.418 61.300 0.035 0.000 1.152 334 I CB -0.064 37.967 38.000 0.053 0.000 1.151 334 I HN 0.228 8.438 8.210 -0.000 0.000 0.410 335 G N 0.989 109.819 108.800 0.049 0.000 2.683 335 G HA2 0.371 4.316 3.960 -0.024 0.000 0.260 335 G HA3 0.371 4.316 3.960 -0.024 0.000 0.260 335 G C 1.070 176.020 174.900 0.085 0.000 1.238 335 G CA 0.210 45.347 45.100 0.062 0.000 0.934 335 G HN 0.296 8.586 8.290 -0.000 0.000 0.534 336 A N -0.688 122.180 122.820 0.081 0.000 1.978 336 A HA -0.027 4.279 4.320 -0.024 0.000 0.220 336 A C 1.518 179.166 177.584 0.107 0.000 1.170 336 A CA 1.945 54.036 52.037 0.090 0.000 0.636 336 A CB -0.105 18.939 19.000 0.073 0.000 0.810 336 A HN 0.473 8.623 8.150 -0.000 0.000 0.448 337 D N -0.464 120.000 120.400 0.106 0.000 2.463 337 D HA 0.261 4.887 4.640 -0.024 0.000 0.224 337 D C 0.780 177.176 176.300 0.159 0.000 1.174 337 D CA 0.480 54.554 54.000 0.124 0.000 0.829 337 D CB 0.009 40.868 40.800 0.099 0.000 0.993 337 D HN 0.359 8.729 8.370 -0.000 0.000 0.497 338 G N 0.308 109.208 108.800 0.165 0.000 2.580 338 G HA2 0.464 4.409 3.960 -0.024 0.000 0.278 338 G HA3 0.464 4.409 3.960 -0.024 0.000 0.278 338 G C -1.011 174.063 174.900 0.291 0.000 1.212 338 G CA -0.339 44.881 45.100 0.200 0.000 0.939 338 G HN 0.100 8.390 8.290 -0.000 0.000 0.513 339 F N -0.592 119.437 119.950 0.132 0.000 2.650 339 F HA 0.619 5.131 4.527 -0.025 0.000 0.310 339 F C -0.592 175.308 175.800 0.166 0.000 1.112 339 F CA -0.704 57.333 58.000 0.062 0.000 0.986 339 F CB 1.918 40.895 39.000 -0.038 0.000 1.285 339 F HN 0.533 8.833 8.300 -0.000 0.000 0.440 340 S N 4.275 119.480 115.700 -0.825 0.000 2.564 340 S HA 0.795 5.251 4.470 -0.024 0.000 0.274 340 S C -1.520 172.573 174.600 -0.845 0.000 1.124 340 S CA -0.599 57.217 58.200 -0.640 0.000 0.869 340 S CB 1.825 64.885 63.200 -0.233 0.000 1.105 340 S HN 0.634 8.944 8.310 -0.000 0.000 0.472 341 F N -1.157 118.533 119.950 -0.434 0.000 2.577 341 F HA 0.735 5.247 4.527 -0.025 0.000 0.318 341 F C 0.762 176.527 175.800 -0.058 0.000 1.065 341 F CA -0.857 56.986 58.000 -0.263 0.000 0.929 341 F CB 0.862 39.816 39.000 -0.077 0.000 1.237 341 F HN 0.442 8.742 8.300 -0.000 0.000 0.468 342 T N -0.223 114.451 114.554 0.201 0.000 2.953 342 T HA 0.222 4.557 4.350 -0.024 0.000 0.247 342 T C 0.502 175.386 174.700 0.306 0.000 1.029 342 T CA 0.573 62.770 62.100 0.161 0.000 1.144 342 T CB -0.102 68.811 68.868 0.075 0.000 0.870 342 T HN 0.456 8.696 8.240 -0.000 0.000 0.446 343 R N 1.110 121.791 120.500 0.302 0.000 2.437 343 R HA 0.673 4.998 4.340 -0.024 0.000 0.310 343 R C -0.684 175.633 176.300 0.027 0.000 0.955 343 R CA -0.575 55.642 56.100 0.195 0.000 0.851 343 R CB 1.465 31.809 30.300 0.074 0.000 1.161 343 R HN 0.253 8.523 8.270 -0.000 0.000 0.446 344 A N 1.693 124.381 122.820 -0.219 0.000 2.566 344 A HA 0.350 4.656 4.320 -0.024 0.000 0.245 344 A C 1.342 178.732 177.584 -0.323 0.000 1.056 344 A CA 1.095 52.724 52.037 -0.680 0.000 0.757 344 A CB -0.487 18.257 19.000 -0.426 0.000 0.979 344 A HN 1.015 9.165 8.150 -0.000 0.000 0.508 345 G N 1.718 110.334 108.800 -0.307 0.000 2.179 345 G HA2 -0.216 3.729 3.960 -0.024 0.000 0.260 345 G HA3 -0.216 3.729 3.960 -0.024 0.000 0.260 345 G C -0.024 174.848 174.900 -0.048 0.000 0.977 345 G CA 0.558 45.580 45.100 -0.131 0.000 0.641 345 G HN 1.091 9.381 8.290 -0.000 0.000 0.533 346 D N -0.230 120.158 120.400 -0.020 0.000 2.256 346 D HA 0.544 5.169 4.640 -0.024 0.000 0.240 346 D C 1.139 177.483 176.300 0.074 0.000 1.062 346 D CA -0.576 53.436 54.000 0.021 0.000 0.832 346 D CB 1.492 42.302 40.800 0.016 0.000 1.135 346 D HN 0.062 8.432 8.370 -0.000 0.000 0.484 347 E N 2.564 122.811 120.200 0.077 0.000 2.216 347 E HA -0.098 4.238 4.350 -0.024 0.000 0.192 347 E C -0.202 176.433 176.600 0.058 0.000 0.988 347 E CA 0.387 56.861 56.400 0.123 0.000 0.834 347 E CB -0.012 29.752 29.700 0.107 0.000 0.772 347 E HN 0.440 8.800 8.360 -0.000 0.000 0.479 348 D N -0.480 119.932 120.400 0.020 0.000 2.371 348 D HA 0.292 4.917 4.640 -0.024 0.000 0.256 348 D C 0.667 176.934 176.300 -0.056 0.000 1.193 348 D CA 1.220 55.209 54.000 -0.017 0.000 0.881 348 D CB 0.316 41.112 40.800 -0.007 0.000 1.143 348 D HN 0.321 8.691 8.370 -0.000 0.000 0.473 349 G N 2.548 111.261 108.800 -0.144 0.000 2.136 349 G HA2 -0.223 3.723 3.960 -0.024 0.000 0.242 349 G HA3 -0.223 3.723 3.960 -0.024 0.000 0.242 349 G C 0.347 174.975 174.900 -0.453 0.000 0.989 349 G CA 0.307 45.255 45.100 -0.252 0.000 0.682 349 G HN 0.575 8.865 8.290 -0.000 0.000 0.522 350 S N -0.719 114.728 115.700 -0.423 0.000 2.617 350 S HA 0.765 5.220 4.470 -0.024 0.000 0.283 350 S C -0.643 173.509 174.600 -0.748 0.000 1.189 350 S CA -0.352 57.559 58.200 -0.482 0.000 1.036 350 S CB 0.867 64.018 63.200 -0.082 0.000 1.014 350 S HN 0.323 8.633 8.310 -0.000 0.000 0.522 351 Y N 1.370 121.471 120.300 -0.331 0.000 2.350 351 Y HA 0.387 4.923 4.550 -0.025 0.000 0.338 351 Y C 0.347 176.113 175.900 -0.223 0.000 0.961 351 Y CA -0.746 57.254 58.100 -0.167 0.000 1.100 351 Y CB 1.079 39.464 38.460 -0.125 0.000 1.179 351 Y HN 0.589 8.869 8.280 -0.000 0.000 0.454 352 H N 1.855 121.059 119.070 0.224 0.000 2.551 352 H HA 0.354 4.895 4.556 -0.024 0.000 0.321 352 H C 0.788 176.229 175.328 0.187 0.000 1.028 352 H CA -0.218 55.982 56.048 0.254 0.000 1.215 352 H CB 1.751 31.648 29.762 0.226 0.000 1.414 352 H HN 1.008 9.288 8.280 -0.000 0.000 0.480 353 G N 3.554 112.509 108.800 0.258 0.000 2.198 353 G HA2 -0.261 3.684 3.960 -0.024 0.000 0.260 353 G HA3 -0.261 3.684 3.960 -0.024 0.000 0.260 353 G C 0.030 175.019 174.900 0.148 0.000 1.025 353 G CA 0.886 46.097 45.100 0.184 0.000 0.769 353 G HN 0.811 9.101 8.290 -0.000 0.000 0.507 354 Q N -2.483 117.404 119.800 0.144 0.000 2.756 354 Q HA 0.757 5.082 4.340 -0.024 0.000 0.295 354 Q C -0.284 175.753 176.000 0.061 0.000 0.903 354 Q CA -0.532 55.337 55.803 0.110 0.000 0.768 354 Q CB 0.403 29.214 28.738 0.121 0.000 1.472 354 Q HN 1.434 9.704 8.270 -0.000 0.000 0.416 355 A N 1.082 123.916 122.820 0.023 0.000 2.272 355 A HA 0.670 4.976 4.320 -0.024 0.000 0.275 355 A C 0.240 177.633 177.584 -0.318 0.000 1.096 355 A CA 0.060 52.051 52.037 -0.077 0.000 0.822 355 A CB 0.385 19.392 19.000 0.012 0.000 1.088 355 A HN 0.859 9.009 8.150 -0.000 0.000 0.495 356 S N 0.274 115.637 115.700 -0.563 0.000 2.596 356 S HA 0.336 4.791 4.470 -0.024 0.000 0.260 356 S C 0.015 174.382 174.600 -0.388 0.000 1.336 356 S CA 0.032 57.603 58.200 -1.048 0.000 0.993 356 S CB 0.250 62.999 63.200 -0.752 0.000 0.923 356 S HN 0.736 9.046 8.310 -0.000 0.000 0.567 357 K N -0.284 119.947 120.400 -0.283 0.000 3.088 357 K HA -0.208 4.097 4.320 -0.024 0.000 0.273 357 K C 0.922 177.335 176.600 -0.312 0.000 1.111 357 K CA 0.958 57.179 56.287 -0.109 0.000 0.803 357 K CB -2.527 29.999 32.500 0.043 0.000 1.226 357 K HN 1.872 10.122 8.250 -0.000 0.000 0.485 358 G N -0.815 107.826 108.800 -0.266 0.000 2.157 358 G HA2 -0.290 3.656 3.960 -0.024 0.000 0.239 358 G HA3 -0.290 3.656 3.960 -0.024 0.000 0.239 358 G C -0.029 174.606 174.900 -0.442 0.000 0.982 358 G CA 0.227 45.117 45.100 -0.350 0.000 0.650 358 G HN 0.220 8.510 8.290 -0.000 0.000 0.527 359 F N 0.443 120.377 119.950 -0.027 0.000 2.483 359 F HA 0.785 5.297 4.527 -0.024 0.000 0.329 359 F C 0.790 176.587 175.800 -0.005 0.000 1.064 359 F CA -0.715 57.278 58.000 -0.013 0.000 0.986 359 F CB 1.414 40.402 39.000 -0.020 0.000 1.218 359 F HN -0.092 8.208 8.300 -0.000 0.000 0.484 360 K N 0.671 121.210 120.400 0.231 0.000 2.316 360 K HA 0.615 4.920 4.320 -0.024 0.000 0.234 360 K C -1.121 175.553 176.600 0.123 0.000 1.054 360 K CA -1.042 55.330 56.287 0.142 0.000 0.879 360 K CB 1.710 34.277 32.500 0.112 0.000 1.252 360 K HN 0.401 8.651 8.250 -0.000 0.000 0.471 361 L N 1.624 122.902 121.223 0.091 0.000 2.416 361 L HA 0.156 4.481 4.340 -0.024 0.000 0.272 361 L C 1.025 177.933 176.870 0.063 0.000 1.161 361 L CA -0.265 54.618 54.840 0.071 0.000 0.845 361 L CB 0.227 42.328 42.059 0.069 0.000 1.119 361 L HN 0.765 8.995 8.230 -0.000 0.000 0.464 362 G N 0.000 108.827 108.800 0.046 0.000 5.446 362 G HA2 0.000 3.945 3.960 -0.024 0.000 0.244 362 G HA3 0.000 3.945 3.960 -0.024 0.000 0.244 362 G CA 0.000 45.123 45.100 0.038 0.000 0.502 362 G HN 0.000 8.290 8.290 -0.000 0.000 0.925