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 1hzj_1_B DATA FIRST_RESID 2 DATA SEQUENCE AEKVLVTGGA GYIGSHTVLE LLEAGYLPVV IDNFHNAFRG GGSLPESLRR DATA SEQUENCE VQELTGRSVE FEEMDILDQG ALQRLFKKYS FMAVIHFAGL KAVGESVQKP DATA SEQUENCE LDYYRVNLTG TIQLLEIMKA HGVKNLVFSS SATVYGNPQY LPLDEAHPTG DATA SEQUENCE GCTNPYGKSK FFIEEMIRDL CQADKTWNVV LLRYFNPTGA HASGCIGEDP DATA SEQUENCE QGIPNNLMPY VSQVAIGRRE ALNVFGNDYD TEDGTGVRDY IHVVDLAKGH DATA SEQUENCE IAALRKLKEQ CGCRIYNLGT GTGYSVLQMV QAMEKASGKK IPYKVVARRE DATA SEQUENCE GDVAACYANP SLAQEELGWT AALGLDRMCE DLWRWQKQNP SGFGT VARS RESID RESNAME ATOMNAME SS_SHIFT SHIFT RC_SHIFT HM_SHIFT EF_SHIFT SIGMA FORMAT %4d %4s %4s %9.3f %9.3f %9.3f %9.3f %9.3f %9.3f 2 A HA 0.000 4.320 4.320 -0.000 0.000 0.244 2 A C 0.000 177.614 177.584 0.050 0.000 1.274 2 A CA 0.000 52.053 52.037 0.027 0.000 0.836 2 A CB 0.000 19.012 19.000 0.020 0.000 0.831 3 E N 0.581 120.813 120.200 0.052 0.000 2.306 3 E HA 0.169 4.519 4.350 0.001 0.000 0.201 3 E C 0.245 176.914 176.600 0.116 0.000 0.874 3 E CA 0.071 56.513 56.400 0.071 0.000 0.972 3 E CB -0.196 29.533 29.700 0.048 0.000 0.957 3 E HN 0.500 8.860 8.360 -0.000 0.000 0.492 4 K N 1.601 122.074 120.400 0.123 0.000 2.219 4 K HA 0.402 4.722 4.320 0.001 0.000 0.258 4 K C -0.263 176.489 176.600 0.254 0.000 1.008 4 K CA -0.290 56.106 56.287 0.182 0.000 0.928 4 K CB 1.816 34.416 32.500 0.166 0.000 0.983 4 K HN -0.116 8.134 8.250 -0.000 0.000 0.484 5 V N 2.867 122.883 119.914 0.170 0.000 2.444 5 V HA 0.156 4.276 4.120 0.001 0.000 0.294 5 V C -0.638 175.383 176.094 -0.121 0.000 1.022 5 V CA -0.997 61.327 62.300 0.040 0.000 0.850 5 V CB 1.429 33.253 31.823 0.001 0.000 0.992 5 V HN 0.532 8.722 8.190 -0.000 0.000 0.426 6 L N 6.893 127.844 121.223 -0.453 0.000 2.305 6 L HA 0.619 4.959 4.340 0.001 0.000 0.281 6 L C -0.377 176.312 176.870 -0.303 0.000 1.085 6 L CA 0.411 54.834 54.840 -0.696 0.000 0.813 6 L CB 1.441 42.635 42.059 -1.441 0.000 1.157 6 L HN 0.452 8.682 8.230 -0.000 0.000 0.436 7 V N 4.228 124.039 119.914 -0.171 0.000 2.349 7 V HA 0.369 4.490 4.120 0.001 0.000 0.284 7 V C 0.234 176.362 176.094 0.057 0.000 1.014 7 V CA -0.372 61.929 62.300 0.002 0.000 0.826 7 V CB 1.193 33.062 31.823 0.077 0.000 1.009 7 V HN 0.910 9.100 8.190 -0.000 0.000 0.431 8 T N 0.979 115.607 114.554 0.123 0.000 2.910 8 T HA 0.537 4.888 4.350 0.001 0.000 0.293 8 T C 1.186 176.027 174.700 0.236 0.000 1.015 8 T CA 0.508 62.709 62.100 0.169 0.000 1.094 8 T CB 1.399 70.433 68.868 0.277 0.000 0.968 8 T HN 1.884 10.124 8.240 -0.000 0.000 0.521 9 G N 1.563 110.454 108.800 0.152 0.000 2.203 9 G HA2 -0.212 3.749 3.960 0.001 0.000 0.263 9 G HA3 -0.212 3.749 3.960 0.001 0.000 0.263 9 G C 1.044 175.969 174.900 0.042 0.000 1.012 9 G CA 0.328 45.495 45.100 0.112 0.000 0.749 9 G HN 1.490 9.780 8.290 -0.000 0.000 0.512 10 G N -0.304 108.528 108.800 0.055 0.000 2.535 10 G HA2 0.238 4.199 3.960 0.001 0.000 0.218 10 G HA3 0.238 4.199 3.960 0.001 0.000 0.218 10 G C 1.597 176.426 174.900 -0.117 0.000 1.122 10 G CA 1.737 46.822 45.100 -0.026 0.000 0.769 10 G HN 1.559 9.849 8.290 -0.000 0.000 0.549 11 A N 0.061 122.813 122.820 -0.114 0.000 2.238 11 A HA 0.557 4.877 4.320 0.001 0.000 0.210 11 A C 1.643 179.152 177.584 -0.126 0.000 1.179 11 A CA 0.788 52.713 52.037 -0.187 0.000 0.827 11 A CB -0.114 18.712 19.000 -0.292 0.000 0.856 11 A HN 0.479 8.629 8.150 -0.000 0.000 0.488 12 G N -2.060 106.681 108.800 -0.098 0.000 2.553 12 G HA2 0.262 4.222 3.960 0.001 0.000 0.278 12 G HA3 0.262 4.222 3.960 0.001 0.000 0.278 12 G C 0.704 175.605 174.900 0.001 0.000 1.349 12 G CA 0.120 45.207 45.100 -0.022 0.000 1.037 12 G HN 0.191 8.481 8.290 -0.000 0.000 0.508 13 Y N -0.056 120.195 120.300 -0.083 0.000 2.036 13 Y HA -0.158 4.392 4.550 0.000 0.000 0.273 13 Y C 2.710 178.548 175.900 -0.103 0.000 1.135 13 Y CA 1.915 59.979 58.100 -0.060 0.000 1.106 13 Y CB -0.583 37.843 38.460 -0.057 0.000 0.976 13 Y HN 0.271 8.551 8.280 -0.000 0.000 0.483 14 I N -0.002 120.286 120.570 -0.472 0.000 2.226 14 I HA -0.226 3.944 4.170 0.001 0.000 0.245 14 I C 2.673 178.255 176.117 -0.891 0.000 1.100 14 I CA 1.336 62.200 61.300 -0.728 0.000 1.374 14 I CB -1.161 36.458 38.000 -0.636 0.000 1.057 14 I HN 0.391 8.601 8.210 -0.000 0.000 0.413 15 G N 1.078 109.228 108.800 -1.083 0.000 2.446 15 G HA2 -0.308 3.652 3.960 0.001 0.000 0.217 15 G HA3 -0.308 3.652 3.960 0.001 0.000 0.217 15 G C 1.831 176.451 174.900 -0.466 0.000 1.168 15 G CA 1.269 45.735 45.100 -1.055 0.000 0.771 15 G HN 0.513 8.803 8.290 -0.000 0.000 0.551 16 S N 0.480 115.992 115.700 -0.313 0.000 2.370 16 S HA -0.187 4.284 4.470 0.001 0.000 0.226 16 S C 2.059 176.486 174.600 -0.289 0.000 1.033 16 S CA 1.788 59.827 58.200 -0.268 0.000 1.011 16 S CB -0.722 62.319 63.200 -0.267 0.000 0.852 16 S HN 0.534 8.844 8.310 -0.000 0.000 0.457 17 H N 1.450 120.358 119.070 -0.270 0.000 2.421 17 H HA 0.064 4.621 4.556 0.001 0.000 0.298 17 H C 2.369 177.598 175.328 -0.166 0.000 1.087 17 H CA 1.880 57.809 56.048 -0.199 0.000 1.330 17 H CB -0.684 28.952 29.762 -0.210 0.000 1.388 17 H HN 0.436 8.716 8.280 -0.000 0.000 0.526 18 T N -0.378 114.095 114.554 -0.135 0.000 2.904 18 T HA -0.079 4.272 4.350 0.001 0.000 0.267 18 T C 2.281 176.955 174.700 -0.044 0.000 1.059 18 T CA 0.886 62.931 62.100 -0.091 0.000 1.137 18 T CB -0.276 68.513 68.868 -0.132 0.000 0.879 18 T HN 0.086 8.326 8.240 -0.000 0.000 0.467 19 V N 1.732 121.595 119.914 -0.085 0.000 2.287 19 V HA -0.138 3.982 4.120 0.001 0.000 0.248 19 V C 2.362 178.431 176.094 -0.042 0.000 1.053 19 V CA 1.475 63.742 62.300 -0.054 0.000 1.027 19 V CB -0.627 31.145 31.823 -0.084 0.000 0.646 19 V HN 0.403 8.593 8.190 -0.000 0.000 0.447 20 L N -0.174 121.001 121.223 -0.080 0.000 1.989 20 L HA -0.187 4.154 4.340 0.001 0.000 0.211 20 L C 2.733 179.610 176.870 0.013 0.000 1.071 20 L CA 1.873 56.675 54.840 -0.065 0.000 0.749 20 L CB -0.464 41.509 42.059 -0.143 0.000 0.890 20 L HN 0.299 8.529 8.230 -0.000 0.000 0.431 21 E N 0.017 120.243 120.200 0.043 0.000 2.160 21 E HA -0.230 4.120 4.350 0.001 0.000 0.195 21 E C 2.282 178.950 176.600 0.114 0.000 0.991 21 E CA 1.443 57.897 56.400 0.089 0.000 0.810 21 E CB -0.360 29.404 29.700 0.106 0.000 0.742 21 E HN 0.573 8.933 8.360 -0.000 0.000 0.466 22 L N 0.398 121.675 121.223 0.091 0.000 1.994 22 L HA -0.201 4.140 4.340 0.001 0.000 0.208 22 L C 2.671 179.661 176.870 0.199 0.000 1.071 22 L CA 0.997 55.925 54.840 0.146 0.000 0.745 22 L CB -0.586 41.514 42.059 0.068 0.000 0.892 22 L HN 0.100 8.330 8.230 -0.000 0.000 0.431 23 L N -0.393 120.895 121.223 0.108 0.000 1.990 23 L HA -0.267 4.073 4.340 0.001 0.000 0.213 23 L C 2.592 179.512 176.870 0.083 0.000 1.072 23 L CA 1.583 56.472 54.840 0.083 0.000 0.755 23 L CB -0.571 41.509 42.059 0.035 0.000 0.889 23 L HN 0.323 8.553 8.230 -0.000 0.000 0.432 24 E N -0.285 119.963 120.200 0.081 0.000 2.204 24 E HA -0.162 4.188 4.350 0.001 0.000 0.194 24 E C 1.943 178.595 176.600 0.088 0.000 0.989 24 E CA 0.922 57.366 56.400 0.074 0.000 0.824 24 E CB -0.091 29.654 29.700 0.073 0.000 0.756 24 E HN 0.501 8.861 8.360 -0.000 0.000 0.477 25 A N 0.077 122.985 122.820 0.147 0.000 2.251 25 A HA 0.284 4.604 4.320 0.001 0.000 0.209 25 A C 1.669 179.265 177.584 0.021 0.000 1.187 25 A CA 0.770 52.903 52.037 0.159 0.000 0.823 25 A CB -0.072 19.136 19.000 0.346 0.000 0.846 25 A HN 0.321 8.471 8.150 -0.000 0.000 0.486 26 G N -2.346 106.468 108.800 0.024 0.000 2.176 26 G HA2 -0.271 3.689 3.960 0.001 0.000 0.232 26 G HA3 -0.271 3.689 3.960 0.001 0.000 0.232 26 G C 0.063 174.903 174.900 -0.100 0.000 0.986 26 G CA 0.204 45.257 45.100 -0.079 0.000 0.643 26 G HN 0.447 8.737 8.290 -0.000 0.000 0.522 27 Y N -0.438 119.881 120.300 0.032 0.000 2.281 27 Y HA 0.629 5.179 4.550 0.000 0.000 0.337 27 Y C 1.338 177.255 175.900 0.028 0.000 1.304 27 Y CA -0.503 57.617 58.100 0.033 0.000 1.465 27 Y CB 0.649 39.133 38.460 0.040 0.000 1.350 27 Y HN 0.016 8.296 8.280 -0.000 0.000 0.575 28 L N 4.340 125.683 121.223 0.199 0.000 2.435 28 L HA 0.349 4.689 4.340 0.001 0.000 0.253 28 L C -2.597 174.333 176.870 0.100 0.000 1.087 28 L CA -1.955 52.955 54.840 0.117 0.000 0.950 28 L CB 0.521 42.636 42.059 0.094 0.000 1.304 28 L HN 0.310 8.540 8.230 -0.000 0.000 0.453 29 P HA 0.252 4.672 4.420 -0.000 0.000 0.281 29 P C -0.630 176.663 177.300 -0.012 0.000 1.249 29 P CA -0.347 62.771 63.100 0.030 0.000 0.810 29 P CB 2.103 33.819 31.700 0.026 0.000 1.008 30 V N 2.788 122.660 119.914 -0.070 0.000 2.444 30 V HA 0.318 4.439 4.120 0.001 0.000 0.294 30 V C 0.127 176.149 176.094 -0.119 0.000 1.022 30 V CA -0.676 61.531 62.300 -0.154 0.000 0.850 30 V CB 2.004 33.611 31.823 -0.360 0.000 0.992 30 V HN 0.258 8.448 8.190 -0.000 0.000 0.426 31 V N 6.232 126.131 119.914 -0.025 0.000 2.581 31 V HA 0.633 4.753 4.120 0.001 0.000 0.303 31 V C -0.257 175.833 176.094 -0.006 0.000 1.041 31 V CA -0.589 61.742 62.300 0.050 0.000 0.907 31 V CB 1.941 33.885 31.823 0.202 0.000 0.994 31 V HN 0.843 9.033 8.190 -0.000 0.000 0.442 32 I N 0.301 120.851 120.570 -0.033 0.000 2.608 32 I HA 0.846 5.017 4.170 0.001 0.000 0.295 32 I C -1.149 174.962 176.117 -0.011 0.000 1.049 32 I CA -0.297 60.912 61.300 -0.152 0.000 1.063 32 I CB 2.355 40.271 38.000 -0.140 0.000 1.248 32 I HN 0.514 8.724 8.210 -0.000 0.000 0.424 33 D N 3.421 123.790 120.400 -0.051 0.000 2.654 33 D HA 0.188 4.829 4.640 0.001 0.000 0.231 33 D C -0.700 175.522 176.300 -0.130 0.000 1.239 33 D CA -0.312 53.658 54.000 -0.049 0.000 0.790 33 D CB 2.232 42.981 40.800 -0.085 0.000 1.480 33 D HN 0.825 9.195 8.370 -0.000 0.000 0.442 34 N N 1.424 120.077 118.700 -0.078 0.000 2.184 34 N HA 0.047 4.787 4.740 0.001 0.000 0.206 34 N C 0.398 176.055 175.510 0.246 0.000 1.151 34 N CA -0.036 53.061 53.050 0.079 0.000 0.878 34 N CB -0.109 38.442 38.487 0.108 0.000 1.014 34 N HN 0.513 8.893 8.380 -0.000 0.000 0.512 35 F N -0.720 119.322 119.950 0.153 0.000 2.965 35 F HA -0.240 4.288 4.527 0.001 0.000 0.287 35 F C 1.438 177.301 175.800 0.104 0.000 0.790 35 F CA 0.648 58.715 58.000 0.111 0.000 1.279 35 F CB -2.502 36.536 39.000 0.064 0.000 1.409 35 F HN 0.302 8.602 8.300 -0.000 0.000 0.446 36 H N 0.550 119.718 119.070 0.163 0.000 2.353 36 H HA -0.015 4.541 4.556 0.000 0.000 0.300 36 H C 1.618 177.017 175.328 0.117 0.000 1.090 36 H CA 2.520 58.639 56.048 0.119 0.000 1.327 36 H CB 0.123 29.925 29.762 0.068 0.000 1.383 36 H HN 0.271 8.551 8.280 -0.000 0.000 0.508 37 N N -0.099 118.630 118.700 0.049 0.000 2.433 37 N HA 0.383 5.123 4.740 0.001 0.000 0.270 37 N C -1.659 173.927 175.510 0.127 0.000 1.354 37 N CA 0.428 53.502 53.050 0.039 0.000 0.889 37 N CB 0.890 39.432 38.487 0.092 0.000 1.285 37 N HN 0.464 8.844 8.380 -0.000 0.000 0.503 38 A N -0.276 122.657 122.820 0.189 0.000 2.527 38 A HA 0.631 4.951 4.320 0.001 0.000 0.293 38 A C -1.734 176.110 177.584 0.434 0.000 1.117 38 A CA -0.628 51.574 52.037 0.274 0.000 0.723 38 A CB 0.828 19.908 19.000 0.132 0.000 1.313 38 A HN 0.197 8.347 8.150 -0.000 0.000 0.411 39 F N 1.862 121.978 119.950 0.276 0.000 2.308 39 F HA 0.426 4.953 4.527 0.001 0.000 0.370 39 F C 0.811 176.683 175.800 0.119 0.000 1.100 39 F CA -0.457 57.657 58.000 0.188 0.000 1.108 39 F CB 0.650 39.774 39.000 0.206 0.000 1.293 39 F HN 0.609 8.909 8.300 -0.000 0.000 0.478 40 R N 4.047 124.285 120.500 -0.437 0.000 2.488 40 R HA 0.058 4.399 4.340 0.001 0.000 0.317 40 R C 0.963 177.014 176.300 -0.415 0.000 0.941 40 R CA 0.578 56.253 56.100 -0.707 0.000 1.076 40 R CB 0.119 29.778 30.300 -1.068 0.000 0.917 40 R HN 0.938 9.208 8.270 -0.000 0.000 0.407 41 G N 2.012 110.749 108.800 -0.104 0.000 2.418 41 G HA2 -0.028 3.932 3.960 0.001 0.000 0.276 41 G HA3 -0.028 3.932 3.960 0.001 0.000 0.276 41 G C 1.010 175.888 174.900 -0.036 0.000 1.442 41 G CA 0.138 45.254 45.100 0.026 0.000 1.066 41 G HN 0.684 8.974 8.290 -0.000 0.000 0.553 42 G N -1.378 107.437 108.800 0.025 0.000 2.683 42 G HA2 0.416 4.376 3.960 0.001 0.000 0.213 42 G HA3 0.416 4.376 3.960 0.001 0.000 0.213 42 G C 0.779 175.672 174.900 -0.011 0.000 1.142 42 G CA 1.174 46.280 45.100 0.010 0.000 0.793 42 G HN 0.920 9.210 8.290 -0.000 0.000 0.534 43 G N 0.102 108.895 108.800 -0.012 0.000 3.175 43 G HA2 0.390 4.350 3.960 0.001 0.000 0.153 43 G HA3 0.390 4.350 3.960 0.001 0.000 0.153 43 G C 1.413 176.314 174.900 0.002 0.000 1.216 43 G CA 0.873 45.971 45.100 -0.003 0.000 0.943 43 G HN 0.228 8.518 8.290 -0.000 0.000 0.611 44 S N -0.680 115.044 115.700 0.040 0.000 2.357 44 S HA 0.124 4.595 4.470 0.001 0.000 0.221 44 S C 1.296 175.970 174.600 0.124 0.000 1.031 44 S CA 0.119 58.385 58.200 0.110 0.000 0.982 44 S CB -0.553 62.738 63.200 0.151 0.000 0.853 44 S HN 0.249 8.559 8.310 -0.000 0.000 0.458 45 L N 3.166 124.394 121.223 0.009 0.000 2.461 45 L HA 0.268 4.608 4.340 0.001 0.000 0.272 45 L C -2.398 174.374 176.870 -0.163 0.000 1.197 45 L CA -1.990 52.734 54.840 -0.193 0.000 0.836 45 L CB 0.158 42.118 42.059 -0.166 0.000 1.105 45 L HN 0.058 8.288 8.230 -0.000 0.000 0.477 46 P HA 0.018 4.438 4.420 -0.000 0.000 0.271 46 P C 0.213 177.412 177.300 -0.170 0.000 1.218 46 P CA -0.187 62.888 63.100 -0.042 0.000 0.780 46 P CB 0.802 32.427 31.700 -0.124 0.000 0.901 47 E N 2.557 122.696 120.200 -0.101 0.000 2.114 47 E HA -0.258 4.092 4.350 0.001 0.000 0.199 47 E C 1.729 177.996 176.600 -0.555 0.000 1.008 47 E CA 2.560 58.814 56.400 -0.244 0.000 0.810 47 E CB -0.694 28.933 29.700 -0.121 0.000 0.739 47 E HN 0.446 8.806 8.360 -0.000 0.000 0.456 48 S N -0.064 115.124 115.700 -0.853 0.000 2.370 48 S HA -0.198 4.272 4.470 0.001 0.000 0.226 48 S C 2.072 176.426 174.600 -0.411 0.000 1.033 48 S CA 1.568 59.306 58.200 -0.771 0.000 1.011 48 S CB -0.685 62.160 63.200 -0.591 0.000 0.852 48 S HN 0.377 8.687 8.310 -0.000 0.000 0.457 49 L N 0.615 121.629 121.223 -0.349 0.000 2.240 49 L HA 0.164 4.504 4.340 0.001 0.000 0.211 49 L C 3.060 179.809 176.870 -0.201 0.000 1.106 49 L CA 0.873 55.554 54.840 -0.266 0.000 0.793 49 L CB -0.486 41.400 42.059 -0.288 0.000 0.927 49 L HN 0.297 8.527 8.230 -0.000 0.000 0.446 50 R N 0.759 121.142 120.500 -0.196 0.000 2.081 50 R HA -0.138 4.202 4.340 0.001 0.000 0.235 50 R C 2.450 178.687 176.300 -0.105 0.000 1.131 50 R CA 1.379 57.406 56.100 -0.123 0.000 0.960 50 R CB 0.000 30.242 30.300 -0.097 0.000 0.856 50 R HN 0.289 8.559 8.270 -0.000 0.000 0.436 51 R N -0.394 120.028 120.500 -0.130 0.000 2.092 51 R HA -0.056 4.284 4.340 0.001 0.000 0.231 51 R C 2.284 178.507 176.300 -0.127 0.000 1.119 51 R CA 1.258 57.303 56.100 -0.091 0.000 0.970 51 R CB -0.241 30.034 30.300 -0.041 0.000 0.864 51 R HN 0.085 8.355 8.270 -0.000 0.000 0.440 52 V N 1.508 121.315 119.914 -0.178 0.000 2.332 52 V HA -0.295 3.825 4.120 0.001 0.000 0.248 52 V C 2.312 178.330 176.094 -0.127 0.000 1.055 52 V CA 1.785 63.970 62.300 -0.192 0.000 1.038 52 V CB -0.469 31.229 31.823 -0.209 0.000 0.651 52 V HN 0.390 8.580 8.190 -0.000 0.000 0.450 53 Q N -0.552 119.189 119.800 -0.098 0.000 2.084 53 Q HA -0.262 4.079 4.340 0.001 0.000 0.202 53 Q C 2.315 178.287 176.000 -0.047 0.000 0.978 53 Q CA 1.939 57.706 55.803 -0.060 0.000 0.844 53 Q CB -0.182 28.527 28.738 -0.047 0.000 0.898 53 Q HN 0.710 8.980 8.270 -0.000 0.000 0.426 54 E N 0.527 120.698 120.200 -0.049 0.000 2.058 54 E HA -0.185 4.165 4.350 0.001 0.000 0.194 54 E C 2.039 178.622 176.600 -0.029 0.000 0.997 54 E CA 0.965 57.347 56.400 -0.030 0.000 0.801 54 E CB -0.107 29.581 29.700 -0.020 0.000 0.746 54 E HN 0.296 8.656 8.360 -0.000 0.000 0.450 55 L N 0.512 121.701 121.223 -0.056 0.000 2.191 55 L HA -0.137 4.204 4.340 0.001 0.000 0.212 55 L C 2.605 179.457 176.870 -0.029 0.000 1.103 55 L CA 1.495 56.303 54.840 -0.052 0.000 0.769 55 L CB -0.463 41.499 42.059 -0.161 0.000 0.908 55 L HN 0.314 8.544 8.230 -0.000 0.000 0.438 56 T N -5.062 109.469 114.554 -0.039 0.000 3.014 56 T HA 0.236 4.587 4.350 0.001 0.000 0.250 56 T C 1.533 176.231 174.700 -0.003 0.000 1.060 56 T CA 0.430 62.521 62.100 -0.015 0.000 1.040 56 T CB 0.647 69.502 68.868 -0.023 0.000 0.971 56 T HN 0.374 8.614 8.240 -0.000 0.000 0.497 57 G N 2.372 111.168 108.800 -0.007 0.000 2.166 57 G HA2 -0.261 3.699 3.960 0.001 0.000 0.260 57 G HA3 -0.261 3.699 3.960 0.001 0.000 0.260 57 G C 0.103 175.004 174.900 0.002 0.000 0.986 57 G CA 0.214 45.314 45.100 -0.000 0.000 0.683 57 G HN 0.732 9.022 8.290 -0.000 0.000 0.527 58 R N -0.255 120.244 120.500 -0.001 0.000 2.832 58 R HA 0.687 5.027 4.340 0.001 0.000 0.271 58 R C -0.478 175.823 176.300 0.002 0.000 0.996 58 R CA -0.604 55.499 56.100 0.005 0.000 0.977 58 R CB 1.571 31.878 30.300 0.011 0.000 1.168 58 R HN 0.110 8.380 8.270 -0.000 0.000 0.482 59 S N 0.451 116.159 115.700 0.012 0.000 2.585 59 S HA 0.351 4.821 4.470 0.001 0.000 0.277 59 S C -0.444 174.169 174.600 0.021 0.000 1.241 59 S CA -0.568 57.642 58.200 0.016 0.000 1.041 59 S CB 1.076 64.292 63.200 0.027 0.000 0.987 59 S HN 0.279 8.589 8.310 -0.000 0.000 0.512 60 V N 4.551 124.477 119.914 0.020 0.000 2.384 60 V HA 0.346 4.466 4.120 0.001 0.000 0.287 60 V C -0.035 176.103 176.094 0.074 0.000 1.020 60 V CA -0.673 61.645 62.300 0.030 0.000 0.850 60 V CB 1.546 33.366 31.823 -0.005 0.000 0.987 60 V HN 0.823 9.013 8.190 -0.000 0.000 0.436 61 E N 4.160 124.408 120.200 0.079 0.000 2.259 61 E HA 0.389 4.740 4.350 0.001 0.000 0.281 61 E C -1.217 175.482 176.600 0.165 0.000 1.037 61 E CA -0.107 56.356 56.400 0.106 0.000 0.854 61 E CB 1.672 31.408 29.700 0.060 0.000 1.051 61 E HN 0.514 8.874 8.360 -0.000 0.000 0.409 62 F N 1.962 121.917 119.950 0.009 0.000 2.588 62 F HA 0.380 4.907 4.527 0.000 0.000 0.310 62 F C -1.068 174.753 175.800 0.035 0.000 1.082 62 F CA -0.737 57.262 58.000 -0.001 0.000 0.929 62 F CB 1.947 40.945 39.000 -0.004 0.000 1.254 62 F HN 0.280 8.580 8.300 -0.000 0.000 0.455 63 E N 3.363 122.955 120.200 -1.012 0.000 2.260 63 E HA 0.153 4.504 4.350 0.001 0.000 0.266 63 E C -1.543 174.410 176.600 -1.078 0.000 0.887 63 E CA -0.684 55.252 56.400 -0.774 0.000 0.777 63 E CB 1.575 31.112 29.700 -0.271 0.000 1.205 63 E HN 0.682 9.043 8.360 -0.000 0.000 0.414 64 E N 5.783 125.557 120.200 -0.709 0.000 2.265 64 E HA 0.256 4.606 4.350 0.001 0.000 0.272 64 E C -0.675 175.859 176.600 -0.111 0.000 1.067 64 E CA 0.161 56.403 56.400 -0.264 0.000 0.900 64 E CB 0.300 30.136 29.700 0.227 0.000 1.017 64 E HN 0.479 8.839 8.360 -0.000 0.000 0.431 65 M N 2.294 121.842 119.600 -0.087 0.000 2.833 65 M HA 0.427 4.907 4.480 0.001 0.000 0.270 65 M C -1.702 174.607 176.300 0.014 0.000 1.209 65 M CA -1.156 54.134 55.300 -0.017 0.000 0.826 65 M CB 1.814 34.400 32.600 -0.023 0.000 1.657 65 M HN 0.091 8.381 8.290 -0.000 0.000 0.492 66 D N 1.577 121.999 120.400 0.036 0.000 2.256 66 D HA 0.446 5.086 4.640 0.001 0.000 0.240 66 D C 0.938 177.266 176.300 0.046 0.000 1.062 66 D CA -0.576 53.451 54.000 0.045 0.000 0.832 66 D CB 1.655 42.484 40.800 0.049 0.000 1.135 66 D HN 0.813 9.183 8.370 -0.000 0.000 0.484 67 I N 1.060 121.664 120.570 0.057 0.000 2.850 67 I HA -0.138 4.032 4.170 0.001 0.000 0.266 67 I C 1.493 177.636 176.117 0.045 0.000 1.257 67 I CA 0.717 62.054 61.300 0.062 0.000 1.465 67 I CB -0.139 37.920 38.000 0.097 0.000 1.091 67 I HN 0.273 8.483 8.210 -0.000 0.000 0.467 68 L N 0.665 121.912 121.223 0.040 0.000 2.478 68 L HA 0.064 4.405 4.340 0.001 0.000 0.223 68 L C 0.681 177.568 176.870 0.028 0.000 1.140 68 L CA 0.431 55.289 54.840 0.030 0.000 0.842 68 L CB -0.439 41.636 42.059 0.026 0.000 0.953 68 L HN 0.255 8.485 8.230 -0.000 0.000 0.452 69 D N 0.242 120.663 120.400 0.034 0.000 2.441 69 D HA 0.059 4.699 4.640 0.001 0.000 0.221 69 D C 1.052 177.373 176.300 0.036 0.000 1.156 69 D CA -0.035 53.985 54.000 0.034 0.000 0.896 69 D CB 0.990 41.813 40.800 0.039 0.000 1.028 69 D HN 0.164 8.534 8.370 -0.000 0.000 0.509 70 Q N 2.020 121.836 119.800 0.027 0.000 2.096 70 Q HA -0.175 4.165 4.340 0.001 0.000 0.208 70 Q C 1.966 177.991 176.000 0.041 0.000 0.993 70 Q CA 1.744 57.562 55.803 0.025 0.000 0.862 70 Q CB -0.078 28.669 28.738 0.015 0.000 0.915 70 Q HN 0.627 8.897 8.270 -0.000 0.000 0.416 71 G N 0.815 109.640 108.800 0.041 0.000 2.491 71 G HA2 -0.299 3.661 3.960 0.001 0.000 0.218 71 G HA3 -0.299 3.661 3.960 0.001 0.000 0.218 71 G C 1.520 176.457 174.900 0.061 0.000 1.180 71 G CA 1.136 46.264 45.100 0.047 0.000 0.774 71 G HN 0.460 8.750 8.290 -0.000 0.000 0.562 72 A N 0.239 123.094 122.820 0.059 0.000 1.933 72 A HA 0.116 4.436 4.320 0.001 0.000 0.218 72 A C 2.476 180.123 177.584 0.104 0.000 1.175 72 A CA 1.358 53.436 52.037 0.068 0.000 0.628 72 A CB -0.384 18.648 19.000 0.052 0.000 0.814 72 A HN 0.367 8.517 8.150 -0.000 0.000 0.444 73 L N -0.922 120.367 121.223 0.110 0.000 2.056 73 L HA -0.250 4.091 4.340 0.001 0.000 0.207 73 L C 2.924 179.928 176.870 0.222 0.000 1.078 73 L CA 1.563 56.508 54.840 0.176 0.000 0.749 73 L CB -0.513 41.605 42.059 0.098 0.000 0.901 73 L HN 0.483 8.713 8.230 -0.000 0.000 0.433 74 Q N -0.411 119.470 119.800 0.135 0.000 2.030 74 Q HA -0.234 4.106 4.340 0.001 0.000 0.204 74 Q C 2.348 178.456 176.000 0.180 0.000 0.986 74 Q CA 1.650 57.546 55.803 0.155 0.000 0.843 74 Q CB -0.184 28.632 28.738 0.130 0.000 0.904 74 Q HN 0.432 8.702 8.270 -0.000 0.000 0.420 75 R N 0.245 120.828 120.500 0.139 0.000 2.083 75 R HA -0.178 4.162 4.340 0.001 0.000 0.237 75 R C 2.397 178.767 176.300 0.117 0.000 1.137 75 R CA 1.317 57.481 56.100 0.107 0.000 0.951 75 R CB -0.672 29.673 30.300 0.074 0.000 0.851 75 R HN 0.186 8.456 8.270 -0.000 0.000 0.434 76 L N 0.386 121.714 121.223 0.174 0.000 2.013 76 L HA -0.181 4.160 4.340 0.001 0.000 0.212 76 L C 1.934 178.929 176.870 0.209 0.000 1.073 76 L CA 1.802 56.780 54.840 0.230 0.000 0.753 76 L CB -0.463 41.749 42.059 0.256 0.000 0.890 76 L HN 0.016 8.246 8.230 -0.000 0.000 0.432 77 F N -0.314 119.658 119.950 0.038 0.000 2.451 77 F HA -0.102 4.425 4.527 0.000 0.000 0.299 77 F C 2.461 178.124 175.800 -0.227 0.000 1.101 77 F CA 1.267 59.168 58.000 -0.164 0.000 1.436 77 F CB -0.365 38.242 39.000 -0.656 0.000 1.074 77 F HN 0.134 8.434 8.300 -0.000 0.000 0.553 78 K N 0.747 121.197 120.400 0.083 0.000 2.137 78 K HA -0.124 4.196 4.320 0.001 0.000 0.202 78 K C 2.180 178.747 176.600 -0.056 0.000 1.052 78 K CA 0.773 57.124 56.287 0.107 0.000 0.961 78 K CB -0.018 32.570 32.500 0.147 0.000 0.741 78 K HN 0.172 8.422 8.250 -0.000 0.000 0.452 79 K N -0.545 119.771 120.400 -0.140 0.000 2.057 79 K HA -0.106 4.214 4.320 0.001 0.000 0.206 79 K C -0.087 176.118 176.600 -0.659 0.000 1.050 79 K CA 1.169 57.224 56.287 -0.387 0.000 0.935 79 K CB 0.067 32.296 32.500 -0.453 0.000 0.715 79 K HN -0.012 8.238 8.250 -0.000 0.000 0.439 80 Y N -0.513 119.545 120.300 -0.404 0.000 2.549 80 Y HA 0.282 4.832 4.550 0.001 0.000 0.339 80 Y C -0.368 175.041 175.900 -0.819 0.000 1.053 80 Y CA -1.150 56.543 58.100 -0.679 0.000 1.105 80 Y CB 2.244 39.996 38.460 -1.180 0.000 1.258 80 Y HN -0.224 8.056 8.280 -0.000 0.000 0.478 81 S N 2.611 118.041 115.700 -0.449 0.000 2.488 81 S HA 0.455 4.926 4.470 0.001 0.000 0.310 81 S C -0.967 173.449 174.600 -0.306 0.000 1.093 81 S CA -0.719 57.297 58.200 -0.307 0.000 1.129 81 S CB -0.608 62.521 63.200 -0.118 0.000 0.989 81 S HN 0.386 8.696 8.310 -0.000 0.000 0.479 82 F N 2.720 122.656 119.950 -0.025 0.000 2.384 82 F HA 0.288 4.816 4.527 0.001 0.000 0.338 82 F C 1.638 177.431 175.800 -0.011 0.000 1.103 82 F CA -1.011 56.955 58.000 -0.057 0.000 1.157 82 F CB 1.029 39.936 39.000 -0.155 0.000 1.167 82 F HN 0.527 8.827 8.300 -0.000 0.000 0.529 83 M N 1.437 121.163 119.600 0.210 0.000 2.510 83 M HA 0.601 5.081 4.480 0.001 0.000 0.256 83 M C 0.041 176.397 176.300 0.093 0.000 1.132 83 M CA 0.440 55.814 55.300 0.123 0.000 1.105 83 M CB 0.560 33.224 32.600 0.105 0.000 1.375 83 M HN 0.450 8.740 8.290 -0.000 0.000 0.477 84 A N -0.067 122.812 122.820 0.099 0.000 2.544 84 A HA 0.709 5.029 4.320 0.001 0.000 0.291 84 A C -1.524 176.036 177.584 -0.040 0.000 1.055 84 A CA -0.748 51.307 52.037 0.030 0.000 0.651 84 A CB 1.196 20.207 19.000 0.018 0.000 1.296 84 A HN 0.056 8.206 8.150 -0.000 0.000 0.431 85 V N 0.703 120.594 119.914 -0.038 0.000 2.709 85 V HA 0.545 4.665 4.120 0.001 0.000 0.308 85 V C -0.857 175.220 176.094 -0.029 0.000 1.062 85 V CA -0.208 62.042 62.300 -0.084 0.000 0.901 85 V CB 1.724 33.526 31.823 -0.035 0.000 1.003 85 V HN 0.679 8.869 8.190 -0.000 0.000 0.425 86 I N 3.871 124.403 120.570 -0.063 0.000 2.382 86 I HA 0.378 4.549 4.170 0.001 0.000 0.285 86 I C -0.742 175.323 176.117 -0.088 0.000 1.007 86 I CA -0.547 60.690 61.300 -0.105 0.000 1.142 86 I CB 1.193 39.101 38.000 -0.153 0.000 1.289 86 I HN 0.655 8.865 8.210 -0.000 0.000 0.453 87 H N 6.605 125.566 119.070 -0.182 0.000 2.690 87 H HA 0.363 4.919 4.556 0.001 0.000 0.280 87 H C -0.446 174.819 175.328 -0.105 0.000 1.138 87 H CA -0.731 55.286 56.048 -0.052 0.000 1.241 87 H CB 0.423 30.263 29.762 0.130 0.000 1.394 87 H HN 0.438 8.718 8.280 -0.000 0.000 0.489 88 F N 2.269 122.205 119.950 -0.022 0.000 2.656 88 F HA 0.354 4.881 4.527 -0.000 0.000 0.291 88 F C 1.660 177.365 175.800 -0.157 0.000 1.122 88 F CA 0.444 58.384 58.000 -0.100 0.000 1.427 88 F CB -0.128 38.854 39.000 -0.029 0.000 1.125 88 F HN 0.561 8.861 8.300 -0.000 0.000 0.583 89 A N 0.821 123.680 122.820 0.065 0.000 2.546 89 A HA 0.470 4.790 4.320 0.001 0.000 0.243 89 A C 0.756 178.322 177.584 -0.029 0.000 1.063 89 A CA 1.081 53.156 52.037 0.064 0.000 0.757 89 A CB -0.805 18.295 19.000 0.167 0.000 0.991 89 A HN 0.555 8.705 8.150 -0.000 0.000 0.503 90 G N 0.327 109.137 108.800 0.016 0.000 2.337 90 G HA2 0.418 4.378 3.960 0.001 0.000 0.298 90 G HA3 0.418 4.378 3.960 0.001 0.000 0.298 90 G C -1.230 173.641 174.900 -0.047 0.000 1.335 90 G CA -0.955 44.138 45.100 -0.011 0.000 0.875 90 G HN 0.878 9.168 8.290 -0.000 0.000 0.579 91 L N 0.089 121.209 121.223 -0.172 0.000 2.307 91 L HA 0.585 4.926 4.340 0.001 0.000 0.282 91 L C 0.932 177.742 176.870 -0.100 0.000 1.051 91 L CA -0.700 53.911 54.840 -0.382 0.000 0.804 91 L CB 1.810 43.189 42.059 -1.133 0.000 1.197 91 L HN 0.893 9.123 8.230 -0.000 0.000 0.431 92 K N 0.653 121.012 120.400 -0.069 0.000 2.483 92 K HA 0.458 4.778 4.320 0.001 0.000 0.206 92 K C -0.069 176.123 176.600 -0.679 0.000 1.086 92 K CA -0.300 55.787 56.287 -0.333 0.000 1.052 92 K CB 1.090 33.543 32.500 -0.077 0.000 0.904 92 K HN 0.440 8.690 8.250 -0.000 0.000 0.557 93 A N 1.112 123.791 122.820 -0.234 0.000 2.260 93 A HA 0.425 4.745 4.320 0.001 0.000 0.308 93 A C 1.156 178.545 177.584 -0.325 0.000 1.254 93 A CA -0.786 51.108 52.037 -0.240 0.000 0.874 93 A CB 0.756 19.742 19.000 -0.024 0.000 1.153 93 A HN 0.026 8.176 8.150 -0.000 0.000 0.527 94 V N 3.730 123.483 119.914 -0.268 0.000 2.231 94 V HA -0.302 3.819 4.120 0.001 0.000 0.250 94 V C 2.746 178.745 176.094 -0.158 0.000 1.058 94 V CA 3.014 65.244 62.300 -0.117 0.000 1.022 94 V CB -1.159 30.651 31.823 -0.022 0.000 0.640 94 V HN 1.016 9.206 8.190 -0.000 0.000 0.445 95 G N -1.120 107.604 108.800 -0.128 0.000 2.402 95 G HA2 -0.288 3.673 3.960 0.001 0.000 0.216 95 G HA3 -0.288 3.673 3.960 0.001 0.000 0.216 95 G C 1.542 176.352 174.900 -0.150 0.000 1.162 95 G CA 0.889 45.907 45.100 -0.138 0.000 0.777 95 G HN 0.630 8.920 8.290 -0.000 0.000 0.539 96 E N 1.183 121.305 120.200 -0.130 0.000 2.150 96 E HA -0.163 4.187 4.350 0.001 0.000 0.193 96 E C 2.588 179.045 176.600 -0.239 0.000 0.985 96 E CA 1.469 57.816 56.400 -0.089 0.000 0.814 96 E CB -0.232 29.496 29.700 0.046 0.000 0.752 96 E HN 0.497 8.857 8.360 -0.000 0.000 0.466 97 S N 0.007 115.362 115.700 -0.575 0.000 2.383 97 S HA -0.151 4.320 4.470 0.001 0.000 0.229 97 S C 2.066 176.408 174.600 -0.430 0.000 1.030 97 S CA 1.322 58.934 58.200 -0.979 0.000 1.002 97 S CB -0.614 61.837 63.200 -1.248 0.000 0.829 97 S HN 0.193 8.503 8.310 -0.000 0.000 0.467 98 V N 2.125 121.881 119.914 -0.264 0.000 2.469 98 V HA -0.143 3.977 4.120 0.001 0.000 0.251 98 V C 2.700 178.739 176.094 -0.093 0.000 1.064 98 V CA 1.947 64.160 62.300 -0.146 0.000 1.066 98 V CB -0.713 31.043 31.823 -0.111 0.000 0.667 98 V HN 0.608 8.798 8.190 -0.000 0.000 0.461 99 Q N -0.257 119.492 119.800 -0.085 0.000 2.396 99 Q HA 0.090 4.430 4.340 0.001 0.000 0.209 99 Q C 0.848 176.847 176.000 -0.002 0.000 0.906 99 Q CA 0.460 56.244 55.803 -0.032 0.000 0.927 99 Q CB 0.224 28.951 28.738 -0.019 0.000 1.069 99 Q HN 0.548 8.818 8.270 -0.000 0.000 0.523 100 K N 1.062 121.455 120.400 -0.011 0.000 3.271 100 K HA 0.197 4.517 4.320 0.001 0.000 0.192 100 K C -2.018 174.628 176.600 0.077 0.000 1.108 100 K CA -1.246 55.081 56.287 0.066 0.000 0.902 100 K CB 1.282 33.868 32.500 0.143 0.000 0.889 100 K HN -0.137 8.113 8.250 -0.000 0.000 0.520 101 P HA -0.243 4.177 4.420 -0.000 0.000 0.216 101 P C 1.205 178.561 177.300 0.094 0.000 1.157 101 P CA 1.329 64.412 63.100 -0.028 0.000 0.880 101 P CB 0.232 31.994 31.700 0.104 0.000 0.791 102 L N -0.470 120.872 121.223 0.197 0.000 2.079 102 L HA -0.177 4.163 4.340 0.001 0.000 0.210 102 L C 2.287 179.264 176.870 0.179 0.000 1.081 102 L CA 1.702 56.682 54.840 0.233 0.000 0.752 102 L CB -1.107 41.052 42.059 0.167 0.000 0.896 102 L HN -0.022 8.208 8.230 -0.000 0.000 0.433 103 D N -0.677 119.812 120.400 0.147 0.000 2.117 103 D HA -0.202 4.439 4.640 0.001 0.000 0.197 103 D C 2.078 178.390 176.300 0.020 0.000 0.987 103 D CA 1.457 55.505 54.000 0.079 0.000 0.829 103 D CB -0.209 40.632 40.800 0.068 0.000 0.961 103 D HN 0.297 8.667 8.370 -0.000 0.000 0.460 104 Y N 0.054 120.308 120.300 -0.076 0.000 2.200 104 Y HA -0.170 4.380 4.550 0.000 0.000 0.290 104 Y C 2.356 178.209 175.900 -0.079 0.000 1.137 104 Y CA 0.968 58.994 58.100 -0.124 0.000 1.163 104 Y CB -0.800 37.501 38.460 -0.266 0.000 0.988 104 Y HN 0.123 8.403 8.280 -0.000 0.000 0.518 105 Y N -0.691 119.737 120.300 0.215 0.000 2.181 105 Y HA -0.256 4.294 4.550 0.000 0.000 0.288 105 Y C 2.755 178.714 175.900 0.098 0.000 1.146 105 Y CA 1.355 59.547 58.100 0.153 0.000 1.164 105 Y CB -0.264 38.286 38.460 0.150 0.000 0.982 105 Y HN -0.039 8.241 8.280 -0.000 0.000 0.515 106 R N 0.434 121.063 120.500 0.214 0.000 2.061 106 R HA -0.148 4.192 4.340 0.001 0.000 0.230 106 R C 2.057 178.401 176.300 0.073 0.000 1.140 106 R CA 1.978 58.150 56.100 0.119 0.000 0.940 106 R CB -0.712 29.636 30.300 0.079 0.000 0.839 106 R HN 0.179 8.449 8.270 -0.000 0.000 0.429 107 V N 2.144 122.068 119.914 0.017 0.000 2.295 107 V HA -0.252 3.869 4.120 0.001 0.000 0.246 107 V C 1.956 178.078 176.094 0.047 0.000 1.049 107 V CA 2.107 64.399 62.300 -0.013 0.000 1.024 107 V CB -0.717 31.031 31.823 -0.124 0.000 0.648 107 V HN 0.434 8.624 8.190 -0.000 0.000 0.447 108 N N 0.222 118.960 118.700 0.064 0.000 2.092 108 N HA -0.033 4.707 4.740 0.001 0.000 0.189 108 N C 1.814 177.420 175.510 0.161 0.000 1.040 108 N CA 1.366 54.494 53.050 0.129 0.000 0.845 108 N CB -0.507 38.065 38.487 0.142 0.000 1.017 108 N HN 0.330 8.710 8.380 -0.000 0.000 0.426 109 L N 0.365 121.695 121.223 0.179 0.000 2.007 109 L HA -0.063 4.278 4.340 0.001 0.000 0.205 109 L C 2.181 179.100 176.870 0.082 0.000 1.073 109 L CA 1.235 56.163 54.840 0.148 0.000 0.744 109 L CB -0.935 41.249 42.059 0.209 0.000 0.898 109 L HN 0.168 8.398 8.230 -0.000 0.000 0.435 110 T N -0.156 114.448 114.554 0.084 0.000 2.746 110 T HA -0.115 4.235 4.350 0.001 0.000 0.267 110 T C 1.793 176.514 174.700 0.035 0.000 1.039 110 T CA 1.274 63.400 62.100 0.044 0.000 1.142 110 T CB -0.535 68.359 68.868 0.044 0.000 0.866 110 T HN 0.556 8.796 8.240 -0.000 0.000 0.444 111 G N 1.251 110.089 108.800 0.063 0.000 2.446 111 G HA2 -0.238 3.722 3.960 0.001 0.000 0.217 111 G HA3 -0.238 3.722 3.960 0.001 0.000 0.217 111 G C 1.727 176.660 174.900 0.055 0.000 1.168 111 G CA 1.522 46.667 45.100 0.074 0.000 0.771 111 G HN 0.452 8.742 8.290 -0.000 0.000 0.551 112 T N 1.301 115.911 114.554 0.093 0.000 2.746 112 T HA -0.038 4.312 4.350 0.001 0.000 0.267 112 T C 2.413 177.051 174.700 -0.102 0.000 1.039 112 T CA 1.031 63.136 62.100 0.008 0.000 1.142 112 T CB -0.158 68.754 68.868 0.073 0.000 0.866 112 T HN 0.250 8.490 8.240 -0.000 0.000 0.444 113 I N 1.002 121.528 120.570 -0.073 0.000 2.163 113 I HA -0.232 3.939 4.170 0.001 0.000 0.243 113 I C 2.856 178.917 176.117 -0.093 0.000 1.085 113 I CA 1.421 62.662 61.300 -0.098 0.000 1.347 113 I CB -0.407 37.546 38.000 -0.077 0.000 1.044 113 I HN 0.270 8.480 8.210 -0.000 0.000 0.408 114 Q N 0.047 119.807 119.800 -0.066 0.000 2.124 114 Q HA -0.239 4.101 4.340 0.001 0.000 0.202 114 Q C 2.283 178.224 176.000 -0.099 0.000 0.977 114 Q CA 1.467 57.231 55.803 -0.065 0.000 0.850 114 Q CB -0.193 28.524 28.738 -0.035 0.000 0.901 114 Q HN 0.402 8.672 8.270 -0.000 0.000 0.429 115 L N 0.524 121.675 121.223 -0.120 0.000 2.017 115 L HA -0.179 4.161 4.340 0.001 0.000 0.208 115 L C 1.932 178.712 176.870 -0.150 0.000 1.073 115 L CA 1.635 56.378 54.840 -0.163 0.000 0.745 115 L CB -0.446 41.449 42.059 -0.273 0.000 0.894 115 L HN 0.190 8.420 8.230 -0.000 0.000 0.432 116 L N -0.603 120.540 121.223 -0.133 0.000 2.079 116 L HA -0.211 4.129 4.340 0.001 0.000 0.210 116 L C 2.592 179.443 176.870 -0.032 0.000 1.081 116 L CA 1.458 56.251 54.840 -0.079 0.000 0.752 116 L CB -0.771 41.165 42.059 -0.206 0.000 0.896 116 L HN 0.389 8.619 8.230 -0.000 0.000 0.433 117 E N 0.146 120.300 120.200 -0.077 0.000 2.051 117 E HA -0.206 4.145 4.350 0.001 0.000 0.192 117 E C 2.323 178.890 176.600 -0.055 0.000 0.991 117 E CA 1.093 57.462 56.400 -0.052 0.000 0.799 117 E CB -0.013 29.651 29.700 -0.060 0.000 0.748 117 E HN 0.424 8.784 8.360 -0.000 0.000 0.449 118 I N 0.985 121.464 120.570 -0.151 0.000 2.226 118 I HA -0.268 3.902 4.170 0.001 0.000 0.245 118 I C 2.524 178.436 176.117 -0.341 0.000 1.100 118 I CA 1.291 62.422 61.300 -0.281 0.000 1.374 118 I CB -0.696 36.970 38.000 -0.556 0.000 1.057 118 I HN 0.199 8.409 8.210 -0.000 0.000 0.413 119 M N 0.412 119.821 119.600 -0.319 0.000 2.065 119 M HA -0.268 4.213 4.480 0.001 0.000 0.259 119 M C 2.389 178.756 176.300 0.111 0.000 1.069 119 M CA 1.977 57.237 55.300 -0.067 0.000 1.110 119 M CB -0.602 32.109 32.600 0.184 0.000 1.328 119 M HN 0.125 8.415 8.290 -0.000 0.000 0.405 120 K N 0.864 121.415 120.400 0.252 0.000 2.044 120 K HA -0.191 4.130 4.320 0.001 0.000 0.210 120 K C 1.915 178.592 176.600 0.127 0.000 1.049 120 K CA 1.828 58.289 56.287 0.291 0.000 0.927 120 K CB -0.269 32.423 32.500 0.320 0.000 0.713 120 K HN 0.298 8.548 8.250 -0.000 0.000 0.443 121 A N 0.468 123.336 122.820 0.080 0.000 2.076 121 A HA -0.158 4.162 4.320 0.001 0.000 0.220 121 A C 0.916 178.469 177.584 -0.052 0.000 1.160 121 A CA 1.644 53.685 52.037 0.007 0.000 0.653 121 A CB -0.597 18.394 19.000 -0.015 0.000 0.801 121 A HN 0.561 8.711 8.150 -0.000 0.000 0.455 122 H N -1.940 117.134 119.070 0.005 0.000 2.592 122 H HA 0.396 4.952 4.556 0.000 0.000 0.279 122 H C 1.342 176.704 175.328 0.057 0.000 1.089 122 H CA 0.128 56.214 56.048 0.063 0.000 1.150 122 H CB 0.224 30.093 29.762 0.177 0.000 1.575 122 H HN 0.500 8.780 8.280 -0.000 0.000 0.547 123 G N 0.891 109.748 108.800 0.095 0.000 2.225 123 G HA2 -0.281 3.680 3.960 0.001 0.000 0.267 123 G HA3 -0.281 3.680 3.960 0.001 0.000 0.267 123 G C -0.075 174.809 174.900 -0.026 0.000 1.024 123 G CA 0.551 45.657 45.100 0.009 0.000 0.784 123 G HN 0.273 8.563 8.290 -0.000 0.000 0.507 124 V N 0.654 120.572 119.914 0.007 0.000 2.247 124 V HA 0.291 4.412 4.120 0.001 0.000 0.262 124 V C 0.916 176.787 176.094 -0.372 0.000 1.096 124 V CA -0.062 62.233 62.300 -0.008 0.000 0.895 124 V CB 0.861 32.863 31.823 0.299 0.000 1.141 124 V HN 0.396 8.586 8.190 -0.000 0.000 0.478 125 K N 2.556 122.562 120.400 -0.658 0.000 2.681 125 K HA 0.328 4.649 4.320 0.001 0.000 0.211 125 K C -0.205 175.869 176.600 -0.876 0.000 1.075 125 K CA -0.241 55.138 56.287 -1.513 0.000 1.141 125 K CB 0.293 31.742 32.500 -1.750 0.000 0.896 125 K HN 0.445 8.695 8.250 -0.000 0.000 0.470 126 N N 1.781 120.251 118.700 -0.384 0.000 2.399 126 N HA 0.334 5.074 4.740 0.001 0.000 0.280 126 N C -1.443 174.085 175.510 0.029 0.000 1.008 126 N CA -0.518 52.476 53.050 -0.093 0.000 0.894 126 N CB 2.268 40.725 38.487 -0.049 0.000 1.273 126 N HN 0.064 8.444 8.380 -0.000 0.000 0.486 127 L N 1.506 122.813 121.223 0.139 0.000 2.393 127 L HA 0.656 4.996 4.340 0.001 0.000 0.260 127 L C -1.590 175.357 176.870 0.128 0.000 1.002 127 L CA -0.668 54.270 54.840 0.164 0.000 0.818 127 L CB 2.183 44.424 42.059 0.302 0.000 1.369 127 L HN 0.183 8.413 8.230 -0.000 0.000 0.412 128 V N 4.228 124.201 119.914 0.097 0.000 2.407 128 V HA 0.439 4.559 4.120 0.001 0.000 0.291 128 V C -0.779 175.374 176.094 0.098 0.000 1.018 128 V CA -0.318 62.016 62.300 0.057 0.000 0.842 128 V CB 1.158 32.976 31.823 -0.008 0.000 0.996 128 V HN 0.656 8.846 8.190 -0.000 0.000 0.426 129 F N 3.112 123.022 119.950 -0.067 0.000 2.469 129 F HA 0.516 5.044 4.527 0.000 0.000 0.332 129 F C 0.772 176.451 175.800 -0.201 0.000 1.103 129 F CA -0.263 57.684 58.000 -0.089 0.000 0.979 129 F CB 1.870 40.840 39.000 -0.049 0.000 1.137 129 F HN 0.403 8.703 8.300 -0.000 0.000 0.463 130 S N 4.446 119.472 115.700 -1.124 0.000 2.700 130 S HA 0.115 4.585 4.470 0.001 0.000 0.321 130 S C 0.141 173.729 174.600 -1.687 0.000 1.161 130 S CA -0.252 57.227 58.200 -1.201 0.000 1.078 130 S CB 0.274 63.111 63.200 -0.605 0.000 1.302 130 S HN 0.677 8.987 8.310 -0.000 0.000 0.540 131 S N 2.224 117.137 115.700 -1.312 0.000 2.566 131 S HA 0.766 5.237 4.470 0.001 0.000 0.277 131 S C 0.050 174.249 174.600 -0.668 0.000 1.150 131 S CA -0.500 57.216 58.200 -0.806 0.000 1.032 131 S CB 1.189 64.176 63.200 -0.355 0.000 1.157 131 S HN 0.613 8.923 8.310 -0.000 0.000 0.507 132 S N -1.372 114.066 115.700 -0.438 0.000 2.552 132 S HA 0.580 5.050 4.470 0.001 0.000 0.272 132 S C 0.257 174.619 174.600 -0.396 0.000 1.150 132 S CA 0.029 58.019 58.200 -0.351 0.000 0.849 132 S CB 0.799 63.841 63.200 -0.263 0.000 1.113 132 S HN 1.040 9.350 8.310 -0.000 0.000 0.458 133 A N 1.996 124.519 122.820 -0.494 0.000 2.125 133 A HA 0.021 4.341 4.320 0.001 0.000 0.219 133 A C 2.078 179.485 177.584 -0.294 0.000 1.156 133 A CA 2.239 53.919 52.037 -0.594 0.000 0.671 133 A CB -1.488 16.714 19.000 -1.329 0.000 0.794 133 A HN 1.470 9.620 8.150 -0.000 0.000 0.459 134 T N -1.453 112.947 114.554 -0.256 0.000 2.977 134 T HA -0.129 4.222 4.350 0.001 0.000 0.271 134 T C 1.611 176.174 174.700 -0.227 0.000 1.105 134 T CA 1.428 63.420 62.100 -0.180 0.000 1.116 134 T CB -1.198 67.600 68.868 -0.116 0.000 0.878 134 T HN 0.848 9.088 8.240 -0.000 0.000 0.509 135 V N -1.855 117.863 119.914 -0.327 0.000 2.913 135 V HA 0.016 4.136 4.120 0.001 0.000 0.260 135 V C 2.003 177.892 176.094 -0.342 0.000 1.098 135 V CA 0.707 62.814 62.300 -0.323 0.000 1.121 135 V CB -1.572 30.086 31.823 -0.275 0.000 0.714 135 V HN 0.556 8.746 8.190 -0.000 0.000 0.487 136 Y N 2.009 122.210 120.300 -0.166 0.000 2.544 136 Y HA 0.444 4.996 4.550 0.004 0.000 0.286 136 Y C 2.095 177.924 175.900 -0.118 0.000 1.141 136 Y CA 0.539 58.555 58.100 -0.141 0.000 1.299 136 Y CB -0.258 38.006 38.460 -0.328 0.000 1.030 136 Y HN 0.550 8.830 8.280 -0.000 0.000 0.543 137 G N 1.055 109.839 108.800 -0.027 0.000 2.566 137 G HA2 -0.399 3.562 3.960 0.001 0.000 0.280 137 G HA3 -0.399 3.562 3.960 0.001 0.000 0.280 137 G C -0.385 174.503 174.900 -0.021 0.000 1.225 137 G CA 0.063 45.135 45.100 -0.046 0.000 0.966 137 G HN 0.424 8.714 8.290 -0.000 0.000 0.560 138 N N 2.600 121.297 118.700 -0.005 0.000 2.420 138 N HA 0.513 5.254 4.740 0.001 0.000 0.262 138 N C -2.340 173.178 175.510 0.013 0.000 1.144 138 N CA -0.923 52.124 53.050 -0.005 0.000 0.952 138 N CB 0.869 39.363 38.487 0.010 0.000 1.081 138 N HN 0.341 8.721 8.380 -0.000 0.000 0.480 139 P HA -0.040 4.380 4.420 -0.000 0.000 0.264 139 P C -0.348 176.985 177.300 0.055 0.000 1.183 139 P CA 0.339 63.362 63.100 -0.128 0.000 0.763 139 P CB 0.638 32.167 31.700 -0.285 0.000 0.807 140 Q N 1.530 121.490 119.800 0.267 0.000 2.384 140 Q HA 0.091 4.431 4.340 0.001 0.000 0.207 140 Q C -0.193 175.937 176.000 0.217 0.000 0.904 140 Q CA 0.539 56.437 55.803 0.158 0.000 0.933 140 Q CB 0.040 28.826 28.738 0.080 0.000 1.077 140 Q HN 0.650 8.920 8.270 -0.000 0.000 0.522 141 Y N -3.202 117.166 120.300 0.113 0.000 2.702 141 Y HA 0.618 5.169 4.550 0.002 0.000 0.336 141 Y C -1.828 174.024 175.900 -0.081 0.000 1.203 141 Y CA -1.627 56.487 58.100 0.023 0.000 1.072 141 Y CB 0.911 39.391 38.460 0.033 0.000 1.327 141 Y HN -0.258 8.022 8.280 -0.000 0.000 0.456 142 L N 2.729 123.997 121.223 0.075 0.000 2.409 142 L HA 0.714 5.054 4.340 0.001 0.000 0.262 142 L C -2.418 174.466 176.870 0.023 0.000 0.992 142 L CA -1.921 52.805 54.840 -0.190 0.000 0.817 142 L CB 2.524 44.314 42.059 -0.448 0.000 1.350 142 L HN 0.605 8.835 8.230 -0.000 0.000 0.411 143 P HA 0.271 4.691 4.420 -0.000 0.000 0.274 143 P C -1.072 176.089 177.300 -0.231 0.000 1.246 143 P CA -0.459 62.482 63.100 -0.265 0.000 0.795 143 P CB 0.778 32.482 31.700 0.006 0.000 1.006 144 L N 1.864 122.841 121.223 -0.410 0.000 2.315 144 L HA 0.201 4.541 4.340 0.001 0.000 0.283 144 L C 0.632 177.343 176.870 -0.266 0.000 1.089 144 L CA -0.479 54.036 54.840 -0.541 0.000 0.833 144 L CB -0.056 41.483 42.059 -0.866 0.000 1.170 144 L HN 0.444 8.674 8.230 -0.000 0.000 0.442 145 D N 0.677 121.023 120.400 -0.091 0.000 2.387 145 D HA 0.197 4.837 4.640 0.001 0.000 0.255 145 D C 0.558 176.950 176.300 0.153 0.000 1.081 145 D CA -0.750 53.301 54.000 0.085 0.000 0.994 145 D CB 0.925 41.831 40.800 0.175 0.000 1.127 145 D HN 0.300 8.670 8.370 -0.000 0.000 0.513 146 E N -0.176 120.164 120.200 0.234 0.000 2.204 146 E HA -0.073 4.277 4.350 0.001 0.000 0.195 146 E C 1.738 178.516 176.600 0.297 0.000 0.990 146 E CA 1.445 58.024 56.400 0.299 0.000 0.821 146 E CB -0.333 29.475 29.700 0.180 0.000 0.750 146 E HN 0.553 8.913 8.360 -0.000 0.000 0.477 147 A N 0.675 123.639 122.820 0.241 0.000 2.235 147 A HA -0.075 4.245 4.320 0.001 0.000 0.208 147 A C 0.803 178.551 177.584 0.273 0.000 1.172 147 A CA 0.025 52.192 52.037 0.217 0.000 0.786 147 A CB -0.535 18.561 19.000 0.161 0.000 0.804 147 A HN 0.270 8.420 8.150 -0.000 0.000 0.479 148 H N 1.334 120.524 119.070 0.200 0.000 2.815 148 H HA 0.183 4.738 4.556 -0.001 0.000 0.350 148 H C -2.555 172.884 175.328 0.186 0.000 1.080 148 H CA -1.599 54.502 56.048 0.090 0.000 1.433 148 H CB 0.686 30.210 29.762 -0.397 0.000 1.432 148 H HN 0.032 8.312 8.280 -0.000 0.000 0.592 149 P HA -0.021 4.399 4.420 -0.000 0.000 0.265 149 P C -0.544 176.885 177.300 0.216 0.000 1.187 149 P CA 0.269 63.366 63.100 -0.006 0.000 0.766 149 P CB 0.326 31.917 31.700 -0.183 0.000 0.820 150 T N -0.664 113.935 114.554 0.075 0.000 2.912 150 T HA 0.769 5.119 4.350 0.001 0.000 0.288 150 T C 0.220 174.621 174.700 -0.497 0.000 1.030 150 T CA -0.087 61.962 62.100 -0.085 0.000 1.020 150 T CB 1.669 70.557 68.868 0.035 0.000 1.056 150 T HN 0.781 9.021 8.240 -0.000 0.000 0.480 151 G N -0.018 108.227 108.800 -0.926 0.000 2.566 151 G HA2 0.378 4.338 3.960 0.001 0.000 0.599 151 G HA3 0.378 4.338 3.960 0.001 0.000 0.599 151 G C 0.524 175.122 174.900 -0.503 0.000 1.292 151 G CA 0.164 44.490 45.100 -1.290 0.000 0.922 151 G HN 2.391 10.681 8.290 -0.000 0.000 0.514 152 G N -1.987 106.612 108.800 -0.335 0.000 2.249 152 G HA2 0.006 3.966 3.960 0.001 0.000 0.273 152 G HA3 0.006 3.966 3.960 0.001 0.000 0.273 152 G C 0.965 175.782 174.900 -0.139 0.000 1.036 152 G CA 1.063 46.069 45.100 -0.157 0.000 0.824 152 G HN 1.945 10.235 8.290 -0.000 0.000 0.504 153 C N -0.131 119.059 119.300 -0.184 0.000 2.702 153 C HA 0.438 4.898 4.460 0.001 0.000 0.411 153 C C 2.282 177.220 174.990 -0.087 0.000 1.286 153 C CA 0.684 59.612 59.018 -0.150 0.000 1.979 153 C CB 0.591 28.215 27.740 -0.193 0.000 2.728 153 C HN 0.885 9.115 8.230 -0.000 0.000 0.652 154 T N -1.455 113.055 114.554 -0.073 0.000 3.107 154 T HA 0.128 4.478 4.350 0.001 0.000 0.249 154 T C 0.043 174.715 174.700 -0.047 0.000 1.096 154 T CA 0.081 62.154 62.100 -0.045 0.000 1.012 154 T CB -0.627 68.222 68.868 -0.031 0.000 0.977 154 T HN 0.939 9.179 8.240 -0.000 0.000 0.527 155 N N -1.162 117.499 118.700 -0.066 0.000 2.710 155 N HA 0.448 5.188 4.740 0.001 0.000 0.257 155 N C -2.961 172.484 175.510 -0.109 0.000 1.327 155 N CA -1.814 51.189 53.050 -0.078 0.000 0.861 155 N CB 1.006 39.449 38.487 -0.074 0.000 1.532 155 N HN -0.345 8.035 8.380 -0.000 0.000 0.499 156 P HA -0.178 4.242 4.420 -0.000 0.000 0.216 156 P C 0.885 178.017 177.300 -0.280 0.000 1.150 156 P CA 1.134 64.095 63.100 -0.232 0.000 0.837 156 P CB -0.103 31.369 31.700 -0.380 0.000 0.786 157 Y N 0.755 120.833 120.300 -0.370 0.000 2.097 157 Y HA -0.193 4.357 4.550 0.000 0.000 0.282 157 Y C 2.477 178.310 175.900 -0.111 0.000 1.152 157 Y CA 2.183 60.170 58.100 -0.189 0.000 1.136 157 Y CB -1.074 37.276 38.460 -0.183 0.000 0.975 157 Y HN -0.103 8.177 8.280 -0.000 0.000 0.498 158 G N 0.162 108.762 108.800 -0.334 0.000 2.422 158 G HA2 -0.242 3.718 3.960 0.001 0.000 0.218 158 G HA3 -0.242 3.718 3.960 0.001 0.000 0.218 158 G C 1.625 176.326 174.900 -0.332 0.000 1.146 158 G CA 0.930 45.795 45.100 -0.391 0.000 0.769 158 G HN 0.376 8.666 8.290 -0.000 0.000 0.547 159 K N 0.793 121.002 120.400 -0.318 0.000 2.026 159 K HA -0.120 4.200 4.320 0.001 0.000 0.208 159 K C 3.064 179.223 176.600 -0.735 0.000 1.048 159 K CA 1.555 57.521 56.287 -0.535 0.000 0.929 159 K CB -0.239 31.975 32.500 -0.477 0.000 0.713 159 K HN 0.452 8.702 8.250 -0.000 0.000 0.439 160 S N 1.356 116.855 115.700 -0.335 0.000 2.365 160 S HA -0.186 4.284 4.470 0.001 0.000 0.225 160 S C 1.884 176.444 174.600 -0.066 0.000 1.039 160 S CA 1.166 59.324 58.200 -0.070 0.000 1.033 160 S CB -0.175 63.058 63.200 0.056 0.000 0.887 160 S HN 0.113 8.423 8.310 -0.000 0.000 0.447 161 K N 0.565 120.860 120.400 -0.175 0.000 2.057 161 K HA 0.030 4.351 4.320 0.001 0.000 0.207 161 K C 1.828 178.436 176.600 0.013 0.000 1.049 161 K CA 1.235 57.480 56.287 -0.071 0.000 0.931 161 K CB -0.952 31.377 32.500 -0.286 0.000 0.714 161 K HN 0.569 8.819 8.250 -0.000 0.000 0.440 162 F N 1.440 121.275 119.950 -0.192 0.000 2.102 162 F HA -0.194 4.333 4.527 0.001 0.000 0.298 162 F C 1.940 177.788 175.800 0.079 0.000 1.105 162 F CA 1.212 59.150 58.000 -0.103 0.000 1.239 162 F CB -0.372 38.538 39.000 -0.150 0.000 0.991 162 F HN -0.153 8.147 8.300 -0.000 0.000 0.474 163 F N 0.898 120.725 119.950 -0.205 0.000 2.095 163 F HA -0.210 4.317 4.527 0.001 0.000 0.298 163 F C 2.481 178.089 175.800 -0.320 0.000 1.104 163 F CA 1.138 58.954 58.000 -0.308 0.000 1.232 163 F CB -1.619 37.332 39.000 -0.081 0.000 0.987 163 F HN 0.040 8.340 8.300 -0.000 0.000 0.475 164 I N -0.113 120.430 120.570 -0.044 0.000 2.226 164 I HA -0.273 3.897 4.170 0.001 0.000 0.245 164 I C 2.336 178.236 176.117 -0.362 0.000 1.100 164 I CA 1.333 62.485 61.300 -0.246 0.000 1.374 164 I CB -0.516 37.278 38.000 -0.344 0.000 1.057 164 I HN 0.169 8.379 8.210 -0.000 0.000 0.413 165 E N 0.537 120.578 120.200 -0.265 0.000 2.058 165 E HA -0.240 4.110 4.350 0.001 0.000 0.194 165 E C 2.126 178.552 176.600 -0.289 0.000 0.997 165 E CA 1.159 57.419 56.400 -0.234 0.000 0.801 165 E CB -0.091 29.532 29.700 -0.128 0.000 0.746 165 E HN 0.427 8.787 8.360 -0.000 0.000 0.450 166 E N 0.405 120.373 120.200 -0.388 0.000 2.077 166 E HA -0.165 4.186 4.350 0.001 0.000 0.193 166 E C 2.079 178.503 176.600 -0.293 0.000 0.989 166 E CA 1.053 57.225 56.400 -0.380 0.000 0.800 166 E CB -0.234 29.141 29.700 -0.542 0.000 0.746 166 E HN 0.365 8.725 8.360 -0.000 0.000 0.452 167 M N -0.079 119.345 119.600 -0.292 0.000 2.117 167 M HA -0.119 4.361 4.480 0.001 0.000 0.262 167 M C 2.398 178.515 176.300 -0.304 0.000 1.065 167 M CA 1.207 56.342 55.300 -0.276 0.000 1.114 167 M CB -0.328 32.116 32.600 -0.261 0.000 1.361 167 M HN 0.045 8.335 8.290 -0.000 0.000 0.408 168 I N -0.264 120.109 120.570 -0.329 0.000 2.252 168 I HA -0.276 3.895 4.170 0.001 0.000 0.245 168 I C 2.535 178.487 176.117 -0.274 0.000 1.102 168 I CA 1.273 62.368 61.300 -0.342 0.000 1.385 168 I CB -0.372 37.430 38.000 -0.330 0.000 1.064 168 I HN 0.251 8.461 8.210 -0.000 0.000 0.414 169 R N 0.629 120.996 120.500 -0.221 0.000 2.081 169 R HA -0.173 4.167 4.340 0.001 0.000 0.235 169 R C 1.852 178.050 176.300 -0.171 0.000 1.131 169 R CA 1.615 57.616 56.100 -0.166 0.000 0.960 169 R CB -0.478 29.736 30.300 -0.143 0.000 0.856 169 R HN 0.380 8.650 8.270 -0.000 0.000 0.436 170 D N 0.910 121.192 120.400 -0.196 0.000 2.117 170 D HA -0.149 4.491 4.640 0.001 0.000 0.197 170 D C 1.881 178.057 176.300 -0.207 0.000 0.987 170 D CA 0.824 54.716 54.000 -0.181 0.000 0.829 170 D CB -0.202 40.488 40.800 -0.182 0.000 0.961 170 D HN 0.063 8.433 8.370 -0.000 0.000 0.460 171 L N 0.661 121.708 121.223 -0.294 0.000 2.046 171 L HA -0.138 4.202 4.340 0.001 0.000 0.208 171 L C 2.139 178.795 176.870 -0.358 0.000 1.077 171 L CA 1.592 56.187 54.840 -0.408 0.000 0.747 171 L CB -0.552 41.110 42.059 -0.661 0.000 0.896 171 L HN 0.025 8.255 8.230 -0.000 0.000 0.432 172 C N -0.684 118.450 119.300 -0.277 0.000 2.432 172 C HA -0.078 4.382 4.460 0.001 0.000 0.280 172 C C 2.729 177.690 174.990 -0.048 0.000 1.353 172 C CA 0.280 59.232 59.018 -0.109 0.000 1.766 172 C CB -0.866 26.846 27.740 -0.048 0.000 1.924 172 C HN 0.601 8.831 8.230 -0.000 0.000 0.509 173 Q N 0.661 120.412 119.800 -0.081 0.000 2.083 173 Q HA -0.013 4.327 4.340 0.001 0.000 0.198 173 Q C 2.522 178.498 176.000 -0.039 0.000 0.969 173 Q CA 1.819 57.591 55.803 -0.052 0.000 0.838 173 Q CB -0.528 28.169 28.738 -0.067 0.000 0.900 173 Q HN 0.681 8.951 8.270 -0.000 0.000 0.436 174 A N 0.423 123.204 122.820 -0.065 0.000 2.015 174 A HA -0.096 4.225 4.320 0.001 0.000 0.219 174 A C 0.520 178.102 177.584 -0.004 0.000 1.163 174 A CA 1.197 53.206 52.037 -0.047 0.000 0.646 174 A CB 0.110 19.063 19.000 -0.078 0.000 0.806 174 A HN 0.202 8.352 8.150 -0.000 0.000 0.448 175 D N -1.237 119.176 120.400 0.021 0.000 2.336 175 D HA 0.265 4.905 4.640 0.001 0.000 0.248 175 D C 0.475 176.877 176.300 0.170 0.000 1.326 175 D CA -0.476 53.599 54.000 0.125 0.000 0.973 175 D CB 0.658 41.600 40.800 0.237 0.000 1.255 175 D HN -0.150 8.220 8.370 -0.000 0.000 0.558 176 K N 0.730 121.195 120.400 0.107 0.000 2.360 176 K HA -0.083 4.237 4.320 0.001 0.000 0.201 176 K C 1.682 178.352 176.600 0.115 0.000 1.046 176 K CA 1.176 57.520 56.287 0.095 0.000 0.940 176 K CB -0.611 31.923 32.500 0.056 0.000 0.748 176 K HN 0.582 8.832 8.250 -0.000 0.000 0.465 177 T N -3.176 111.455 114.554 0.129 0.000 3.085 177 T HA -0.072 4.278 4.350 0.001 0.000 0.263 177 T C 0.573 175.319 174.700 0.076 0.000 1.127 177 T CA -0.300 61.845 62.100 0.076 0.000 1.103 177 T CB -0.174 68.709 68.868 0.025 0.000 0.921 177 T HN 0.062 8.302 8.240 -0.000 0.000 0.510 178 W N 2.735 124.036 121.300 0.002 0.000 2.190 178 W HA 0.459 5.119 4.660 0.000 0.000 0.330 178 W C 0.018 176.541 176.519 0.007 0.000 1.299 178 W CA -0.588 56.758 57.345 0.002 0.000 1.215 178 W CB 0.462 29.914 29.460 -0.014 0.000 1.147 178 W HN 0.081 8.261 8.180 -0.000 0.000 0.563 179 N N 2.579 121.401 118.700 0.204 0.000 2.354 179 N HA 0.628 5.368 4.740 0.001 0.000 0.287 179 N C -1.120 174.516 175.510 0.210 0.000 1.016 179 N CA -0.465 52.678 53.050 0.155 0.000 0.871 179 N CB 1.601 40.136 38.487 0.079 0.000 1.299 179 N HN 0.353 8.733 8.380 -0.000 0.000 0.482 180 V N 0.615 120.639 119.914 0.183 0.000 2.668 180 V HA 0.511 4.631 4.120 0.001 0.000 0.304 180 V C -0.549 175.610 176.094 0.108 0.000 1.071 180 V CA -0.765 61.637 62.300 0.170 0.000 0.894 180 V CB 2.114 34.035 31.823 0.164 0.000 1.008 180 V HN 0.275 8.465 8.190 -0.000 0.000 0.425 181 V N 6.128 126.107 119.914 0.108 0.000 2.357 181 V HA 0.544 4.664 4.120 0.001 0.000 0.284 181 V C -0.035 176.105 176.094 0.077 0.000 1.018 181 V CA -0.616 61.743 62.300 0.098 0.000 0.841 181 V CB 1.230 33.130 31.823 0.128 0.000 0.991 181 V HN 0.721 8.911 8.190 -0.000 0.000 0.437 182 L N 6.398 127.646 121.223 0.042 0.000 2.257 182 L HA 0.540 4.881 4.340 0.001 0.000 0.290 182 L C -0.540 176.311 176.870 -0.033 0.000 1.044 182 L CA -0.348 54.519 54.840 0.045 0.000 0.810 182 L CB 0.947 43.043 42.059 0.062 0.000 1.193 182 L HN 0.425 8.655 8.230 -0.000 0.000 0.425 183 L N 4.804 125.948 121.223 -0.132 0.000 2.262 183 L HA 0.414 4.754 4.340 0.001 0.000 0.288 183 L C 0.352 177.041 176.870 -0.302 0.000 1.035 183 L CA -0.418 54.335 54.840 -0.146 0.000 0.820 183 L CB 0.831 42.808 42.059 -0.136 0.000 1.204 183 L HN 0.561 8.791 8.230 -0.000 0.000 0.424 184 R N 3.460 123.898 120.500 -0.104 0.000 2.419 184 R HA 0.232 4.572 4.340 0.001 0.000 0.305 184 R C -0.958 175.375 176.300 0.055 0.000 1.242 184 R CA -0.563 55.452 56.100 -0.142 0.000 1.105 184 R CB -0.074 30.189 30.300 -0.062 0.000 1.116 184 R HN 0.326 8.596 8.270 -0.000 0.000 0.523 185 Y N 1.971 122.248 120.300 -0.037 0.000 2.480 185 Y HA 0.050 4.599 4.550 -0.000 0.000 0.338 185 Y C 1.000 176.899 175.900 -0.002 0.000 1.220 185 Y CA -0.608 57.533 58.100 0.068 0.000 1.430 185 Y CB 0.027 38.523 38.460 0.061 0.000 1.311 185 Y HN 0.292 8.572 8.280 -0.000 0.000 0.575 186 F N 0.198 120.293 119.950 0.241 0.000 2.317 186 F HA 0.276 4.805 4.527 0.003 0.000 0.266 186 F C 0.418 176.286 175.800 0.113 0.000 0.913 186 F CA -0.900 57.184 58.000 0.140 0.000 1.117 186 F CB 0.262 39.327 39.000 0.109 0.000 1.980 186 F HN 0.299 8.599 8.300 -0.000 0.000 0.600 187 N N 1.967 120.773 118.700 0.175 0.000 2.402 187 N HA 0.206 4.947 4.740 0.001 0.000 0.252 187 N C -2.709 172.908 175.510 0.178 0.000 1.118 187 N CA -1.265 51.826 53.050 0.068 0.000 0.945 187 N CB 0.144 38.472 38.487 -0.265 0.000 1.147 187 N HN -0.020 8.360 8.380 -0.000 0.000 0.495 188 P HA 0.140 4.560 4.420 -0.000 0.000 0.276 188 P C -0.164 177.296 177.300 0.267 0.000 1.235 188 P CA -0.075 63.122 63.100 0.162 0.000 0.772 188 P CB 1.332 33.067 31.700 0.060 0.000 0.871 189 T N 0.797 115.462 114.554 0.185 0.000 2.671 189 T HA 0.675 5.025 4.350 0.001 0.000 0.300 189 T C -0.388 174.261 174.700 -0.085 0.000 1.238 189 T CA 0.493 62.691 62.100 0.162 0.000 1.020 189 T CB 0.858 69.839 68.868 0.188 0.000 1.503 189 T HN 0.719 8.959 8.240 -0.000 0.000 0.497 190 G N 0.440 109.149 108.800 -0.150 0.000 2.725 190 G HA2 0.441 4.402 3.960 0.001 0.000 0.220 190 G HA3 0.441 4.402 3.960 0.001 0.000 0.220 190 G C -0.301 174.451 174.900 -0.246 0.000 1.357 190 G CA -0.180 44.662 45.100 -0.431 0.000 0.866 190 G HN 1.816 10.106 8.290 -0.000 0.000 0.548 191 A N -1.681 121.033 122.820 -0.177 0.000 2.601 191 A HA 0.714 5.034 4.320 0.001 0.000 0.291 191 A C -0.252 177.527 177.584 0.325 0.000 1.075 191 A CA 0.470 52.553 52.037 0.077 0.000 0.671 191 A CB 0.915 19.956 19.000 0.069 0.000 1.277 191 A HN 1.927 10.077 8.150 -0.000 0.000 0.417 192 H N 1.063 120.384 119.070 0.418 0.000 3.064 192 H HA 0.164 4.720 4.556 0.001 0.000 0.329 192 H C 1.544 176.990 175.328 0.197 0.000 1.020 192 H CA 0.820 57.046 56.048 0.296 0.000 1.402 192 H CB 1.117 30.971 29.762 0.153 0.000 1.379 192 H HN 0.852 9.132 8.280 -0.000 0.000 0.594 193 A N 3.684 126.248 122.820 -0.426 0.000 2.084 193 A HA -0.241 4.079 4.320 0.001 0.000 0.221 193 A C 2.472 180.023 177.584 -0.056 0.000 1.161 193 A CA 1.934 53.844 52.037 -0.212 0.000 0.653 193 A CB -0.707 18.140 19.000 -0.255 0.000 0.802 193 A HN 0.820 8.970 8.150 -0.000 0.000 0.457 194 S N -1.885 113.846 115.700 0.053 0.000 2.428 194 S HA 0.270 4.740 4.470 0.001 0.000 0.230 194 S C 1.687 176.397 174.600 0.183 0.000 1.014 194 S CA 1.297 59.613 58.200 0.192 0.000 0.957 194 S CB -0.614 62.790 63.200 0.340 0.000 0.784 194 S HN 1.989 10.299 8.310 -0.000 0.000 0.499 195 G N 0.307 109.249 108.800 0.236 0.000 2.159 195 G HA2 -0.375 3.585 3.960 0.001 0.000 0.256 195 G HA3 -0.375 3.585 3.960 0.001 0.000 0.256 195 G C 1.084 176.196 174.900 0.354 0.000 0.977 195 G CA 0.551 45.808 45.100 0.261 0.000 0.652 195 G HN 1.375 9.665 8.290 -0.000 0.000 0.531 196 C N -0.063 119.421 119.300 0.306 0.000 2.464 196 C HA 0.683 5.144 4.460 0.001 0.000 0.278 196 C C 1.334 176.564 174.990 0.399 0.000 1.375 196 C CA 0.599 59.796 59.018 0.300 0.000 1.761 196 C CB -1.034 26.813 27.740 0.178 0.000 1.944 196 C HN 1.143 9.373 8.230 -0.000 0.000 0.509 197 I N -1.608 119.056 120.570 0.156 0.000 2.969 197 I HA 0.912 5.082 4.170 0.001 0.000 0.307 197 I C -0.030 175.547 176.117 -0.899 0.000 1.149 197 I CA -0.169 60.967 61.300 -0.273 0.000 1.008 197 I CB 1.788 39.683 38.000 -0.175 0.000 1.232 197 I HN 0.347 8.557 8.210 -0.000 0.000 0.435 198 G N 2.263 110.153 108.800 -1.517 0.000 2.335 198 G HA2 0.189 4.149 3.960 0.001 0.000 0.291 198 G HA3 0.189 4.149 3.960 0.001 0.000 0.291 198 G C -1.960 172.416 174.900 -0.873 0.000 1.261 198 G CA -0.776 43.530 45.100 -1.323 0.000 0.871 198 G HN 0.906 9.196 8.290 -0.000 0.000 0.491 199 E N 0.073 119.815 120.200 -0.763 0.000 2.290 199 E HA 0.354 4.704 4.350 0.001 0.000 0.277 199 E C -1.107 175.462 176.600 -0.051 0.000 1.035 199 E CA -0.170 55.859 56.400 -0.618 0.000 0.873 199 E CB 0.865 29.864 29.700 -1.168 0.000 1.029 199 E HN 0.297 8.657 8.360 -0.000 0.000 0.419 200 D N 6.323 126.755 120.400 0.054 0.000 2.551 200 D HA 0.264 4.905 4.640 0.001 0.000 0.294 200 D C -2.382 173.980 176.300 0.104 0.000 1.201 200 D CA -2.036 52.057 54.000 0.156 0.000 0.941 200 D CB 0.615 41.562 40.800 0.245 0.000 0.995 200 D HN 0.231 8.601 8.370 -0.000 0.000 0.502 201 P HA 0.112 4.532 4.420 -0.000 0.000 0.269 201 P C -0.648 176.682 177.300 0.050 0.000 1.209 201 P CA -0.077 63.048 63.100 0.041 0.000 0.776 201 P CB 0.610 32.325 31.700 0.025 0.000 0.876 202 Q N 1.201 121.033 119.800 0.053 0.000 2.271 202 Q HA 0.521 4.862 4.340 0.001 0.000 0.258 202 Q C 0.856 176.880 176.000 0.041 0.000 0.936 202 Q CA -0.487 55.346 55.803 0.051 0.000 0.909 202 Q CB 1.401 30.168 28.738 0.048 0.000 1.253 202 Q HN 0.786 9.056 8.270 -0.000 0.000 0.440 203 G N 2.166 110.987 108.800 0.036 0.000 2.562 203 G HA2 -0.304 3.656 3.960 0.001 0.000 0.250 203 G HA3 -0.304 3.656 3.960 0.001 0.000 0.250 203 G C -0.307 174.622 174.900 0.048 0.000 1.269 203 G CA -0.642 44.481 45.100 0.039 0.000 0.919 203 G HN 0.595 8.885 8.290 -0.000 0.000 0.574 204 I N 3.606 124.225 120.570 0.082 0.000 2.587 204 I HA 0.285 4.455 4.170 0.001 0.000 0.284 204 I C -1.532 174.689 176.117 0.173 0.000 1.134 204 I CA -1.046 60.341 61.300 0.145 0.000 1.410 204 I CB 0.816 38.940 38.000 0.207 0.000 1.392 204 I HN 0.243 8.453 8.210 -0.000 0.000 0.545 205 P HA 0.123 4.543 4.420 -0.000 0.000 0.271 205 P C -0.051 177.405 177.300 0.259 0.000 1.220 205 P CA -0.145 63.079 63.100 0.207 0.000 0.768 205 P CB 0.633 32.449 31.700 0.192 0.000 0.848 206 N N 1.549 120.349 118.700 0.166 0.000 2.250 206 N HA -0.043 4.697 4.740 0.001 0.000 0.181 206 N C 0.602 176.207 175.510 0.159 0.000 1.017 206 N CA 0.844 53.981 53.050 0.145 0.000 0.866 206 N CB -0.208 38.333 38.487 0.090 0.000 0.985 206 N HN 0.574 8.954 8.380 -0.000 0.000 0.429 207 N N 0.913 119.698 118.700 0.141 0.000 2.489 207 N HA 0.034 4.774 4.740 0.001 0.000 0.284 207 N C 1.141 176.738 175.510 0.144 0.000 1.158 207 N CA -0.527 52.606 53.050 0.138 0.000 0.965 207 N CB 1.263 39.819 38.487 0.115 0.000 1.195 207 N HN -0.118 8.262 8.380 -0.000 0.000 0.506 208 L N 0.616 121.920 121.223 0.134 0.000 1.951 208 L HA -0.208 4.133 4.340 0.001 0.000 0.222 208 L C 2.096 179.015 176.870 0.081 0.000 1.078 208 L CA 2.053 56.947 54.840 0.089 0.000 0.778 208 L CB -0.615 41.500 42.059 0.093 0.000 0.893 208 L HN 0.562 8.792 8.230 -0.000 0.000 0.436 209 M N -0.443 119.195 119.600 0.063 0.000 2.080 209 M HA -0.104 4.377 4.480 0.001 0.000 0.260 209 M C 0.075 176.402 176.300 0.046 0.000 1.068 209 M CA 1.880 57.193 55.300 0.021 0.000 1.109 209 M CB -2.816 29.773 32.600 -0.017 0.000 1.342 209 M HN 0.238 8.528 8.290 -0.000 0.000 0.405 210 P HA -0.157 4.263 4.420 -0.000 0.000 0.217 210 P C 1.731 179.050 177.300 0.031 0.000 1.150 210 P CA 1.349 64.466 63.100 0.028 0.000 0.832 210 P CB -0.369 31.336 31.700 0.009 0.000 0.787 211 Y N 0.317 120.615 120.300 -0.004 0.000 2.133 211 Y HA -0.195 4.355 4.550 0.000 0.000 0.287 211 Y C 2.337 178.229 175.900 -0.012 0.000 1.134 211 Y CA 1.228 59.325 58.100 -0.006 0.000 1.133 211 Y CB -0.830 37.626 38.460 -0.008 0.000 0.987 211 Y HN -0.321 7.959 8.280 -0.000 0.000 0.502 212 V N -0.119 119.905 119.914 0.182 0.000 2.282 212 V HA -0.378 3.742 4.120 0.001 0.000 0.249 212 V C 2.619 178.740 176.094 0.045 0.000 1.057 212 V CA 2.277 64.632 62.300 0.092 0.000 1.032 212 V CB -1.230 30.605 31.823 0.019 0.000 0.645 212 V HN 0.647 8.837 8.190 -0.000 0.000 0.447 213 S N -0.455 115.274 115.700 0.049 0.000 2.382 213 S HA -0.300 4.170 4.470 0.001 0.000 0.228 213 S C 1.919 176.550 174.600 0.051 0.000 1.027 213 S CA 1.842 60.102 58.200 0.100 0.000 0.991 213 S CB -0.480 62.788 63.200 0.114 0.000 0.823 213 S HN 0.716 9.026 8.310 -0.000 0.000 0.469 214 Q N 0.261 120.017 119.800 -0.073 0.000 2.167 214 Q HA -0.012 4.328 4.340 0.001 0.000 0.202 214 Q C 2.386 178.307 176.000 -0.132 0.000 0.970 214 Q CA 1.431 57.138 55.803 -0.159 0.000 0.855 214 Q CB -0.394 28.157 28.738 -0.312 0.000 0.911 214 Q HN 0.520 8.790 8.270 -0.000 0.000 0.438 215 V N 1.056 120.907 119.914 -0.105 0.000 2.270 215 V HA -0.284 3.836 4.120 0.001 0.000 0.245 215 V C 2.345 178.438 176.094 -0.001 0.000 1.043 215 V CA 1.882 64.157 62.300 -0.041 0.000 1.014 215 V CB -0.987 30.858 31.823 0.036 0.000 0.645 215 V HN 0.393 8.583 8.190 -0.000 0.000 0.447 216 A N -0.295 122.544 122.820 0.031 0.000 1.917 216 A HA -0.261 4.059 4.320 0.001 0.000 0.219 216 A C 2.104 179.787 177.584 0.164 0.000 1.182 216 A CA 2.379 54.450 52.037 0.057 0.000 0.633 216 A CB -0.638 18.353 19.000 -0.015 0.000 0.819 216 A HN 0.479 8.629 8.150 -0.000 0.000 0.448 217 I N -0.994 119.687 120.570 0.184 0.000 3.291 217 I HA 0.162 4.332 4.170 0.001 0.000 0.279 217 I C 1.464 177.595 176.117 0.023 0.000 1.294 217 I CA 1.162 62.533 61.300 0.118 0.000 1.428 217 I CB -0.207 37.771 38.000 -0.037 0.000 1.070 217 I HN 0.564 8.774 8.210 -0.000 0.000 0.478 218 G N 0.711 109.514 108.800 0.005 0.000 2.136 218 G HA2 -0.373 3.588 3.960 0.001 0.000 0.242 218 G HA3 -0.373 3.588 3.960 0.001 0.000 0.242 218 G C 1.315 176.184 174.900 -0.052 0.000 0.989 218 G CA 0.445 45.533 45.100 -0.020 0.000 0.682 218 G HN 0.449 8.739 8.290 -0.000 0.000 0.522 219 R N -0.626 119.823 120.500 -0.085 0.000 2.200 219 R HA 0.150 4.491 4.340 0.001 0.000 0.208 219 R C 0.798 177.022 176.300 -0.126 0.000 1.033 219 R CA 0.460 56.493 56.100 -0.110 0.000 1.000 219 R CB 0.036 30.253 30.300 -0.139 0.000 0.906 219 R HN 0.241 8.511 8.270 -0.000 0.000 0.462 220 R N 0.089 120.500 120.500 -0.147 0.000 2.740 220 R HA 0.168 4.508 4.340 0.001 0.000 0.282 220 R C 0.023 176.300 176.300 -0.038 0.000 0.969 220 R CA -0.517 55.495 56.100 -0.146 0.000 0.918 220 R CB 1.465 31.541 30.300 -0.373 0.000 1.175 220 R HN 0.104 8.374 8.270 -0.000 0.000 0.464 221 E N 0.710 120.922 120.200 0.021 0.000 2.107 221 E HA 0.077 4.428 4.350 0.001 0.000 0.191 221 E C 0.004 176.639 176.600 0.058 0.000 0.982 221 E CA 0.989 57.409 56.400 0.034 0.000 0.809 221 E CB 0.404 30.122 29.700 0.031 0.000 0.756 221 E HN 0.609 8.969 8.360 -0.000 0.000 0.459 222 A N -0.082 122.811 122.820 0.121 0.000 2.586 222 A HA 0.490 4.810 4.320 0.001 0.000 0.290 222 A C -1.910 175.834 177.584 0.266 0.000 1.086 222 A CA -0.783 51.339 52.037 0.142 0.000 0.665 222 A CB 0.811 19.860 19.000 0.082 0.000 1.279 222 A HN 0.087 8.237 8.150 -0.000 0.000 0.423 223 L N 0.597 121.948 121.223 0.212 0.000 2.307 223 L HA 0.564 4.904 4.340 0.001 0.000 0.282 223 L C -0.468 176.386 176.870 -0.027 0.000 1.051 223 L CA -0.099 54.820 54.840 0.132 0.000 0.804 223 L CB 0.906 43.028 42.059 0.105 0.000 1.197 223 L HN 0.667 8.897 8.230 -0.000 0.000 0.431 224 N N 3.382 121.914 118.700 -0.281 0.000 2.426 224 N HA 0.378 5.118 4.740 0.001 0.000 0.257 224 N C -1.250 173.930 175.510 -0.549 0.000 1.002 224 N CA -0.555 52.325 53.050 -0.283 0.000 0.942 224 N CB 1.641 39.997 38.487 -0.217 0.000 1.112 224 N HN 0.361 8.741 8.380 -0.000 0.000 0.499 225 V N 4.224 123.968 119.914 -0.283 0.000 2.334 225 V HA 0.173 4.293 4.120 0.001 0.000 0.267 225 V C -0.186 175.830 176.094 -0.129 0.000 1.040 225 V CA -0.473 61.652 62.300 -0.293 0.000 0.866 225 V CB -0.495 31.262 31.823 -0.109 0.000 1.019 225 V HN 0.660 8.850 8.190 -0.000 0.000 0.468 226 F N 4.442 124.414 119.950 0.036 0.000 2.685 226 F HA 0.445 4.972 4.527 0.000 0.000 0.349 226 F C 1.365 177.254 175.800 0.148 0.000 1.294 226 F CA 0.386 58.428 58.000 0.071 0.000 1.201 226 F CB -0.224 38.814 39.000 0.064 0.000 1.615 226 F HN 0.734 9.034 8.300 -0.000 0.000 0.674 227 G N 2.661 111.622 108.800 0.269 0.000 2.777 227 G HA2 -0.248 3.712 3.960 0.001 0.000 0.686 227 G HA3 -0.248 3.712 3.960 0.001 0.000 0.686 227 G C -0.135 174.870 174.900 0.176 0.000 1.177 227 G CA -0.413 44.788 45.100 0.168 0.000 0.775 227 G HN 0.724 9.014 8.290 -0.000 0.000 0.613 228 N N -0.079 118.664 118.700 0.072 0.000 2.184 228 N HA 0.121 4.861 4.740 0.001 0.000 0.234 228 N C 0.062 175.592 175.510 0.033 0.000 1.282 228 N CA 0.548 53.651 53.050 0.089 0.000 0.877 228 N CB 0.826 39.364 38.487 0.083 0.000 1.184 228 N HN 0.421 8.801 8.380 -0.000 0.000 0.510 229 D N -0.067 120.278 120.400 -0.093 0.000 2.463 229 D HA 0.133 4.774 4.640 0.001 0.000 0.224 229 D C -0.452 175.759 176.300 -0.148 0.000 1.174 229 D CA -0.288 53.642 54.000 -0.118 0.000 0.829 229 D CB -0.256 40.452 40.800 -0.154 0.000 0.993 229 D HN 0.195 8.565 8.370 -0.000 0.000 0.497 230 Y N 0.890 121.215 120.300 0.042 0.000 2.314 230 Y HA 0.127 4.677 4.550 -0.000 0.000 0.334 230 Y C 1.418 177.342 175.900 0.040 0.000 1.266 230 Y CA -0.655 57.470 58.100 0.042 0.000 1.391 230 Y CB 0.546 39.035 38.460 0.049 0.000 1.306 230 Y HN -0.194 8.086 8.280 -0.000 0.000 0.558 231 D N 0.872 121.411 120.400 0.233 0.000 2.813 231 D HA -0.020 4.620 4.640 0.001 0.000 0.248 231 D C -0.164 176.215 176.300 0.132 0.000 1.254 231 D CA 0.134 54.219 54.000 0.142 0.000 0.921 231 D CB -0.669 40.202 40.800 0.119 0.000 1.118 231 D HN 0.572 8.942 8.370 -0.000 0.000 0.450 232 T N -4.110 110.532 114.554 0.147 0.000 2.950 232 T HA 0.209 4.559 4.350 0.001 0.000 0.288 232 T C 1.190 175.944 174.700 0.089 0.000 1.035 232 T CA -0.837 61.330 62.100 0.113 0.000 1.028 232 T CB 1.821 70.758 68.868 0.115 0.000 1.109 232 T HN 0.059 8.299 8.240 -0.000 0.000 0.514 233 E N 0.969 121.210 120.200 0.068 0.000 2.164 233 E HA -0.299 4.051 4.350 0.001 0.000 0.206 233 E C 0.757 177.389 176.600 0.054 0.000 1.032 233 E CA 2.529 58.960 56.400 0.052 0.000 0.832 233 E CB -0.284 29.438 29.700 0.037 0.000 0.742 233 E HN 0.864 9.224 8.360 -0.000 0.000 0.460 234 D N -2.369 118.069 120.400 0.063 0.000 2.469 234 D HA 0.177 4.818 4.640 0.001 0.000 0.215 234 D C 1.195 177.542 176.300 0.078 0.000 1.154 234 D CA 0.617 54.653 54.000 0.060 0.000 0.832 234 D CB 0.363 41.190 40.800 0.046 0.000 1.008 234 D HN 0.338 8.708 8.370 -0.000 0.000 0.506 235 G N 0.316 109.179 108.800 0.105 0.000 2.184 235 G HA2 -0.289 3.672 3.960 0.001 0.000 0.264 235 G HA3 -0.289 3.672 3.960 0.001 0.000 0.264 235 G C 0.541 175.575 174.900 0.224 0.000 0.975 235 G CA 0.871 46.059 45.100 0.146 0.000 0.642 235 G HN 0.831 9.121 8.290 -0.000 0.000 0.536 236 T N -1.434 113.221 114.554 0.168 0.000 2.936 236 T HA 0.679 5.029 4.350 0.001 0.000 0.282 236 T C 0.976 175.741 174.700 0.109 0.000 1.003 236 T CA 0.174 62.378 62.100 0.173 0.000 1.005 236 T CB 1.864 70.769 68.868 0.062 0.000 1.097 236 T HN 1.505 9.745 8.240 -0.000 0.000 0.532 237 G N 0.185 109.001 108.800 0.027 0.000 2.305 237 G HA2 0.448 4.408 3.960 0.001 0.000 0.243 237 G HA3 0.448 4.408 3.960 0.001 0.000 0.243 237 G C -0.493 174.414 174.900 0.012 0.000 1.288 237 G CA -0.483 44.551 45.100 -0.110 0.000 0.901 237 G HN 0.768 9.058 8.290 -0.000 0.000 0.516 238 V N 4.787 124.704 119.914 0.005 0.000 2.435 238 V HA 0.647 4.767 4.120 0.001 0.000 0.290 238 V C 0.037 176.189 176.094 0.096 0.000 1.030 238 V CA -0.769 61.587 62.300 0.092 0.000 0.881 238 V CB 1.394 33.279 31.823 0.104 0.000 0.983 238 V HN 0.782 8.972 8.190 -0.000 0.000 0.445 239 R N 1.864 122.436 120.500 0.120 0.000 2.774 239 R HA 0.390 4.730 4.340 0.001 0.000 0.272 239 R C -1.358 174.912 176.300 -0.051 0.000 1.000 239 R CA -0.859 55.220 56.100 -0.036 0.000 0.906 239 R CB 2.049 32.127 30.300 -0.371 0.000 1.227 239 R HN 0.708 8.978 8.270 -0.000 0.000 0.468 240 D N 1.850 122.240 120.400 -0.016 0.000 2.456 240 D HA 0.149 4.789 4.640 0.001 0.000 0.219 240 D C -0.743 175.541 176.300 -0.027 0.000 1.126 240 D CA -0.241 53.792 54.000 0.055 0.000 0.890 240 D CB -0.047 40.813 40.800 0.101 0.000 1.025 240 D HN 0.237 8.607 8.370 -0.000 0.000 0.511 241 Y N 2.923 123.368 120.300 0.242 0.000 2.377 241 Y HA 0.265 4.815 4.550 -0.000 0.000 0.330 241 Y C 0.777 176.800 175.900 0.204 0.000 1.108 241 Y CA -0.337 57.893 58.100 0.217 0.000 1.308 241 Y CB 0.912 39.483 38.460 0.185 0.000 1.216 241 Y HN 0.300 8.580 8.280 -0.000 0.000 0.518 242 I N 3.240 123.990 120.570 0.300 0.000 2.545 242 I HA 0.279 4.449 4.170 0.001 0.000 0.292 242 I C -0.624 175.626 176.117 0.222 0.000 1.040 242 I CA -0.937 60.521 61.300 0.265 0.000 1.068 242 I CB 1.054 39.224 38.000 0.283 0.000 1.251 242 I HN 0.614 8.824 8.210 -0.000 0.000 0.424 243 H N 6.239 125.387 119.070 0.129 0.000 2.964 243 H HA 0.011 4.567 4.556 -0.000 0.000 0.328 243 H C 0.902 176.224 175.328 -0.010 0.000 1.030 243 H CA 0.930 57.015 56.048 0.061 0.000 1.445 243 H CB 1.919 31.709 29.762 0.046 0.000 1.449 243 H HN 0.684 8.964 8.280 -0.000 0.000 0.581 244 V N 5.905 125.790 119.914 -0.047 0.000 2.453 244 V HA -0.246 3.874 4.120 0.001 0.000 0.252 244 V C 2.056 178.113 176.094 -0.062 0.000 1.068 244 V CA 2.005 64.142 62.300 -0.270 0.000 1.070 244 V CB -0.299 31.024 31.823 -0.833 0.000 0.664 244 V HN 0.639 8.829 8.190 -0.000 0.000 0.461 245 V N 0.008 120.067 119.914 0.242 0.000 2.427 245 V HA -0.179 3.941 4.120 0.001 0.000 0.248 245 V C 2.345 178.526 176.094 0.146 0.000 1.051 245 V CA 2.281 64.669 62.300 0.147 0.000 1.048 245 V CB -0.706 31.143 31.823 0.044 0.000 0.666 245 V HN 0.587 8.777 8.190 -0.000 0.000 0.456 246 D N 0.006 120.516 120.400 0.184 0.000 2.117 246 D HA -0.096 4.544 4.640 0.001 0.000 0.198 246 D C 2.193 178.776 176.300 0.473 0.000 0.982 246 D CA 1.080 55.264 54.000 0.306 0.000 0.828 246 D CB -0.087 40.881 40.800 0.280 0.000 0.967 246 D HN 0.325 8.695 8.370 -0.000 0.000 0.464 247 L N 0.830 122.213 121.223 0.268 0.000 2.012 247 L HA -0.206 4.134 4.340 0.001 0.000 0.210 247 L C 2.611 179.601 176.870 0.199 0.000 1.073 247 L CA 1.286 56.194 54.840 0.114 0.000 0.748 247 L CB -0.421 41.558 42.059 -0.134 0.000 0.891 247 L HN -0.023 8.207 8.230 -0.000 0.000 0.431 248 A N 0.112 123.010 122.820 0.131 0.000 1.883 248 A HA -0.251 4.069 4.320 0.001 0.000 0.217 248 A C 2.293 180.012 177.584 0.224 0.000 1.186 248 A CA 1.922 54.037 52.037 0.130 0.000 0.624 248 A CB -0.431 18.605 19.000 0.061 0.000 0.822 248 A HN 0.348 8.498 8.150 -0.000 0.000 0.444 249 K N -0.827 119.723 120.400 0.250 0.000 2.147 249 K HA -0.104 4.216 4.320 0.001 0.000 0.205 249 K C 2.044 178.793 176.600 0.250 0.000 1.049 249 K CA 0.963 57.418 56.287 0.280 0.000 0.936 249 K CB -0.449 32.246 32.500 0.326 0.000 0.722 249 K HN 0.494 8.744 8.250 -0.000 0.000 0.446 250 G N 0.597 109.450 108.800 0.090 0.000 2.450 250 G HA2 -0.256 3.704 3.960 0.001 0.000 0.220 250 G HA3 -0.256 3.704 3.960 0.001 0.000 0.220 250 G C 0.951 175.650 174.900 -0.335 0.000 1.130 250 G CA 0.984 45.715 45.100 -0.615 0.000 0.760 250 G HN 0.342 8.632 8.290 -0.000 0.000 0.557 251 H N 0.097 119.091 119.070 -0.128 0.000 2.389 251 H HA 0.054 4.610 4.556 0.001 0.000 0.299 251 H C 2.562 177.836 175.328 -0.090 0.000 1.081 251 H CA 0.975 56.975 56.048 -0.080 0.000 1.345 251 H CB 0.088 29.849 29.762 -0.002 0.000 1.393 251 H HN 0.247 8.527 8.280 -0.000 0.000 0.520 252 I N 0.295 120.901 120.570 0.060 0.000 2.252 252 I HA -0.135 4.036 4.170 0.001 0.000 0.245 252 I C 2.519 178.655 176.117 0.031 0.000 1.102 252 I CA 1.148 62.453 61.300 0.009 0.000 1.385 252 I CB -1.413 36.653 38.000 0.111 0.000 1.064 252 I HN 0.246 8.456 8.210 -0.000 0.000 0.414 253 A N 1.150 123.991 122.820 0.035 0.000 1.933 253 A HA -0.089 4.231 4.320 0.001 0.000 0.218 253 A C 2.595 180.156 177.584 -0.038 0.000 1.175 253 A CA 1.892 53.943 52.037 0.023 0.000 0.628 253 A CB -0.673 18.353 19.000 0.042 0.000 0.814 253 A HN 0.411 8.561 8.150 -0.000 0.000 0.444 254 A N -0.176 122.586 122.820 -0.096 0.000 1.877 254 A HA -0.050 4.270 4.320 0.001 0.000 0.216 254 A C 2.148 179.720 177.584 -0.021 0.000 1.186 254 A CA 1.450 53.440 52.037 -0.078 0.000 0.620 254 A CB -0.623 18.297 19.000 -0.134 0.000 0.822 254 A HN 0.466 8.616 8.150 -0.000 0.000 0.443 255 L N -1.006 120.193 121.223 -0.039 0.000 2.079 255 L HA -0.222 4.118 4.340 0.001 0.000 0.210 255 L C 2.895 179.795 176.870 0.051 0.000 1.081 255 L CA 1.469 56.291 54.840 -0.030 0.000 0.752 255 L CB -0.446 41.507 42.059 -0.177 0.000 0.896 255 L HN 0.412 8.642 8.230 -0.000 0.000 0.433 256 R N -0.184 120.358 120.500 0.070 0.000 2.092 256 R HA -0.176 4.165 4.340 0.001 0.000 0.231 256 R C 2.268 178.609 176.300 0.070 0.000 1.119 256 R CA 0.998 57.156 56.100 0.097 0.000 0.970 256 R CB -0.244 30.116 30.300 0.100 0.000 0.864 256 R HN 0.053 8.323 8.270 -0.000 0.000 0.440 257 K N 1.619 122.049 120.400 0.050 0.000 2.152 257 K HA -0.097 4.224 4.320 0.001 0.000 0.206 257 K C 1.794 178.439 176.600 0.075 0.000 1.048 257 K CA 1.309 57.634 56.287 0.062 0.000 0.933 257 K CB -0.361 32.178 32.500 0.065 0.000 0.721 257 K HN 0.140 8.390 8.250 -0.000 0.000 0.447 258 L N 0.164 121.428 121.223 0.068 0.000 2.191 258 L HA -0.136 4.204 4.340 0.001 0.000 0.212 258 L C 1.851 178.757 176.870 0.059 0.000 1.103 258 L CA 0.859 55.738 54.840 0.065 0.000 0.769 258 L CB -0.382 41.709 42.059 0.054 0.000 0.908 258 L HN 0.051 8.281 8.230 -0.000 0.000 0.438 259 K N 0.588 121.026 120.400 0.064 0.000 2.442 259 K HA -0.092 4.228 4.320 0.001 0.000 0.198 259 K C 1.473 178.104 176.600 0.052 0.000 1.042 259 K CA 0.864 57.186 56.287 0.059 0.000 0.958 259 K CB -0.151 32.389 32.500 0.067 0.000 0.766 259 K HN 0.473 8.723 8.250 -0.000 0.000 0.474 260 E N 0.920 121.154 120.200 0.056 0.000 2.489 260 E HA -0.003 4.348 4.350 0.001 0.000 0.193 260 E C -0.462 176.169 176.600 0.051 0.000 1.057 260 E CA -0.154 56.278 56.400 0.053 0.000 0.866 260 E CB 0.177 29.913 29.700 0.060 0.000 0.916 260 E HN 0.069 8.429 8.360 -0.000 0.000 0.500 261 Q N -0.609 119.221 119.800 0.050 0.000 2.460 261 Q HA -0.221 4.120 4.340 0.001 0.000 0.311 261 Q C 1.151 177.185 176.000 0.058 0.000 1.396 261 Q CA 0.977 56.807 55.803 0.047 0.000 0.838 261 Q CB -2.997 25.763 28.738 0.037 0.000 1.140 261 Q HN 0.667 8.937 8.270 -0.000 0.000 0.415 262 C N -2.782 116.561 119.300 0.071 0.000 2.432 262 C HA 0.362 4.822 4.460 0.001 0.000 0.282 262 C C 1.747 176.785 174.990 0.079 0.000 1.388 262 C CA 0.742 59.809 59.018 0.083 0.000 1.777 262 C CB -1.078 26.727 27.740 0.109 0.000 1.882 262 C HN 1.147 9.377 8.230 -0.000 0.000 0.520 263 G N -0.412 108.439 108.800 0.085 0.000 2.528 263 G HA2 -0.325 3.635 3.960 0.001 0.000 0.262 263 G HA3 -0.325 3.635 3.960 0.001 0.000 0.262 263 G C -0.066 174.885 174.900 0.085 0.000 1.200 263 G CA 0.158 45.313 45.100 0.092 0.000 0.951 263 G HN 1.241 9.531 8.290 -0.000 0.000 0.566 264 C N 3.387 122.717 119.300 0.051 0.000 2.349 264 C HA 0.772 5.232 4.460 0.001 0.000 0.348 264 C C 0.420 175.395 174.990 -0.024 0.000 1.223 264 C CA -0.575 58.452 59.018 0.016 0.000 1.746 264 C CB -1.154 26.576 27.740 -0.016 0.000 2.360 264 C HN 0.629 8.859 8.230 -0.000 0.000 0.533 265 R N 5.475 125.946 120.500 -0.047 0.000 2.750 265 R HA 0.695 5.035 4.340 0.001 0.000 0.281 265 R C -1.266 174.842 176.300 -0.319 0.000 0.972 265 R CA -0.626 55.355 56.100 -0.198 0.000 0.912 265 R CB 1.670 31.916 30.300 -0.090 0.000 1.187 265 R HN 0.695 8.965 8.270 -0.000 0.000 0.464 266 I N 2.631 122.845 120.570 -0.594 0.000 2.534 266 I HA 0.411 4.581 4.170 0.001 0.000 0.288 266 I C -1.272 174.473 176.117 -0.620 0.000 1.077 266 I CA -0.748 60.295 61.300 -0.427 0.000 1.051 266 I CB 1.644 39.526 38.000 -0.196 0.000 1.234 266 I HN 0.452 8.662 8.210 -0.000 0.000 0.425 267 Y N 3.720 124.040 120.300 0.034 0.000 2.492 267 Y HA 0.403 4.952 4.550 -0.001 0.000 0.346 267 Y C -0.017 175.936 175.900 0.089 0.000 0.997 267 Y CA -1.134 57.002 58.100 0.059 0.000 1.025 267 Y CB 1.524 39.990 38.460 0.011 0.000 1.263 267 Y HN 0.425 8.705 8.280 -0.000 0.000 0.454 268 N N 2.521 121.429 118.700 0.348 0.000 2.530 268 N HA 0.347 5.087 4.740 0.001 0.000 0.273 268 N C -1.105 174.586 175.510 0.302 0.000 1.173 268 N CA -0.060 53.238 53.050 0.413 0.000 0.967 268 N CB 0.946 39.687 38.487 0.422 0.000 1.109 268 N HN 0.582 8.962 8.380 -0.000 0.000 0.453 269 L N 1.807 123.228 121.223 0.329 0.000 2.384 269 L HA 0.546 4.887 4.340 0.001 0.000 0.261 269 L C 0.550 177.677 176.870 0.428 0.000 1.024 269 L CA -0.542 54.379 54.840 0.135 0.000 0.899 269 L CB 1.051 43.026 42.059 -0.139 0.000 1.243 269 L HN 0.527 8.757 8.230 -0.000 0.000 0.449 270 G N -0.332 108.707 108.800 0.399 0.000 2.708 270 G HA2 0.407 4.367 3.960 0.001 0.000 0.289 270 G HA3 0.407 4.367 3.960 0.001 0.000 0.289 270 G C 0.478 175.475 174.900 0.162 0.000 1.416 270 G CA 0.285 45.484 45.100 0.164 0.000 0.829 270 G HN 0.359 8.649 8.290 -0.000 0.000 0.480 271 T N -3.784 110.803 114.554 0.056 0.000 3.031 271 T HA 0.371 4.722 4.350 0.001 0.000 0.254 271 T C 1.874 176.549 174.700 -0.043 0.000 1.060 271 T CA 1.388 63.498 62.100 0.018 0.000 1.135 271 T CB 0.062 68.963 68.868 0.055 0.000 0.896 271 T HN 2.410 10.650 8.240 -0.000 0.000 0.472 272 G N 0.618 109.367 108.800 -0.086 0.000 2.194 272 G HA2 -0.177 3.783 3.960 0.001 0.000 0.236 272 G HA3 -0.177 3.783 3.960 0.001 0.000 0.236 272 G C 0.205 175.032 174.900 -0.122 0.000 0.987 272 G CA 0.119 45.177 45.100 -0.069 0.000 0.635 272 G HN 0.779 9.069 8.290 -0.000 0.000 0.520 273 T N 1.354 115.803 114.554 -0.175 0.000 2.756 273 T HA 0.622 4.972 4.350 0.001 0.000 0.290 273 T C 0.580 175.028 174.700 -0.420 0.000 0.985 273 T CA 0.288 62.176 62.100 -0.354 0.000 0.955 273 T CB 1.707 70.394 68.868 -0.301 0.000 0.930 273 T HN 0.977 9.217 8.240 -0.000 0.000 0.451 274 G N 1.967 110.379 108.800 -0.646 0.000 2.400 274 G HA2 0.602 4.562 3.960 0.001 0.000 0.301 274 G HA3 0.602 4.562 3.960 0.001 0.000 0.301 274 G C -1.562 173.058 174.900 -0.467 0.000 1.154 274 G CA -0.349 44.516 45.100 -0.391 0.000 0.852 274 G HN 0.582 8.872 8.290 -0.000 0.000 0.511 275 Y N -0.134 120.236 120.300 0.117 0.000 2.477 275 Y HA 0.495 5.047 4.550 0.004 0.000 0.347 275 Y C 0.650 176.647 175.900 0.161 0.000 0.981 275 Y CA -0.924 57.251 58.100 0.126 0.000 1.033 275 Y CB 2.374 40.918 38.460 0.141 0.000 1.245 275 Y HN 0.720 9.000 8.280 -0.000 0.000 0.455 276 S N 0.307 116.161 115.700 0.258 0.000 2.617 276 S HA 0.266 4.737 4.470 0.001 0.000 0.269 276 S C 0.832 175.491 174.600 0.098 0.000 1.292 276 S CA -0.576 57.713 58.200 0.148 0.000 1.010 276 S CB 1.097 64.348 63.200 0.084 0.000 0.944 276 S HN 0.491 8.801 8.310 -0.000 0.000 0.536 277 V N 2.530 122.471 119.914 0.045 0.000 2.332 277 V HA -0.194 3.926 4.120 0.001 0.000 0.248 277 V C 2.367 178.381 176.094 -0.133 0.000 1.055 277 V CA 2.135 64.410 62.300 -0.040 0.000 1.038 277 V CB -1.183 30.594 31.823 -0.078 0.000 0.651 277 V HN 0.829 9.019 8.190 -0.000 0.000 0.450 278 L N -0.679 120.462 121.223 -0.136 0.000 2.093 278 L HA -0.213 4.128 4.340 0.001 0.000 0.208 278 L C 2.659 179.458 176.870 -0.119 0.000 1.085 278 L CA 1.538 56.267 54.840 -0.186 0.000 0.755 278 L CB -0.704 41.264 42.059 -0.152 0.000 0.904 278 L HN 0.361 8.591 8.230 -0.000 0.000 0.435 279 Q N -0.701 119.067 119.800 -0.054 0.000 2.170 279 Q HA -0.176 4.165 4.340 0.001 0.000 0.203 279 Q C 2.329 178.235 176.000 -0.156 0.000 0.976 279 Q CA 1.171 56.943 55.803 -0.052 0.000 0.858 279 Q CB -0.065 28.718 28.738 0.076 0.000 0.907 279 Q HN 0.439 8.709 8.270 -0.000 0.000 0.433 280 M N -0.155 119.336 119.600 -0.180 0.000 2.132 280 M HA -0.117 4.363 4.480 0.001 0.000 0.263 280 M C 2.282 178.449 176.300 -0.221 0.000 1.065 280 M CA 1.098 56.231 55.300 -0.278 0.000 1.122 280 M CB -0.880 31.500 32.600 -0.367 0.000 1.365 280 M HN 0.071 8.361 8.290 -0.000 0.000 0.411 281 V N 0.125 119.930 119.914 -0.181 0.000 2.295 281 V HA -0.279 3.841 4.120 0.001 0.000 0.246 281 V C 2.507 178.526 176.094 -0.125 0.000 1.049 281 V CA 1.881 64.095 62.300 -0.144 0.000 1.024 281 V CB -0.875 30.853 31.823 -0.158 0.000 0.648 281 V HN 0.394 8.584 8.190 -0.000 0.000 0.447 282 Q N 0.369 120.096 119.800 -0.121 0.000 2.030 282 Q HA -0.194 4.146 4.340 0.001 0.000 0.204 282 Q C 2.215 178.138 176.000 -0.129 0.000 0.986 282 Q CA 2.387 58.129 55.803 -0.102 0.000 0.843 282 Q CB -0.694 27.993 28.738 -0.086 0.000 0.904 282 Q HN 0.616 8.886 8.270 -0.000 0.000 0.420 283 A N -0.410 122.310 122.820 -0.166 0.000 1.933 283 A HA -0.185 4.135 4.320 0.001 0.000 0.218 283 A C 1.983 179.464 177.584 -0.171 0.000 1.175 283 A CA 1.732 53.660 52.037 -0.183 0.000 0.628 283 A CB -0.478 18.368 19.000 -0.255 0.000 0.814 283 A HN 0.405 8.555 8.150 -0.000 0.000 0.444 284 M N -0.848 118.649 119.600 -0.172 0.000 2.254 284 M HA -0.049 4.432 4.480 0.001 0.000 0.265 284 M C 1.884 178.043 176.300 -0.234 0.000 1.066 284 M CA 1.218 56.413 55.300 -0.174 0.000 1.123 284 M CB -1.187 31.332 32.600 -0.134 0.000 1.388 284 M HN 0.548 8.838 8.290 -0.000 0.000 0.425 285 E N 0.044 120.131 120.200 -0.187 0.000 2.077 285 E HA -0.206 4.145 4.350 0.001 0.000 0.193 285 E C 2.105 178.576 176.600 -0.215 0.000 0.989 285 E CA 1.083 57.367 56.400 -0.192 0.000 0.800 285 E CB 0.026 29.653 29.700 -0.121 0.000 0.746 285 E HN 0.315 8.675 8.360 -0.000 0.000 0.452 286 K N 0.326 120.621 120.400 -0.174 0.000 2.057 286 K HA -0.140 4.181 4.320 0.001 0.000 0.207 286 K C 2.036 178.519 176.600 -0.196 0.000 1.049 286 K CA 1.218 57.411 56.287 -0.157 0.000 0.931 286 K CB -0.083 32.345 32.500 -0.120 0.000 0.714 286 K HN 0.088 8.338 8.250 -0.000 0.000 0.440 287 A N 0.789 123.475 122.820 -0.224 0.000 1.929 287 A HA -0.107 4.213 4.320 0.001 0.000 0.216 287 A C 2.027 179.285 177.584 -0.542 0.000 1.176 287 A CA 2.012 53.905 52.037 -0.241 0.000 0.628 287 A CB -0.388 18.536 19.000 -0.126 0.000 0.816 287 A HN 0.525 8.675 8.150 -0.000 0.000 0.444 288 S N -2.248 112.942 115.700 -0.849 0.000 2.503 288 S HA 0.365 4.836 4.470 0.001 0.000 0.217 288 S C 1.542 175.655 174.600 -0.813 0.000 0.999 288 S CA 1.038 58.267 58.200 -1.620 0.000 0.914 288 S CB -0.243 61.766 63.200 -1.985 0.000 0.782 288 S HN 1.831 10.140 8.310 -0.000 0.000 0.520 289 G N 1.610 110.129 108.800 -0.468 0.000 2.166 289 G HA2 -0.266 3.694 3.960 0.001 0.000 0.260 289 G HA3 -0.266 3.694 3.960 0.001 0.000 0.260 289 G C 0.093 174.851 174.900 -0.235 0.000 0.986 289 G CA 0.675 45.616 45.100 -0.265 0.000 0.683 289 G HN 0.522 8.812 8.290 -0.000 0.000 0.527 290 K N -0.367 119.840 120.400 -0.321 0.000 2.177 290 K HA 0.520 4.840 4.320 0.001 0.000 0.238 290 K C 0.036 176.542 176.600 -0.156 0.000 1.015 290 K CA -0.757 55.400 56.287 -0.216 0.000 0.922 290 K CB 0.750 33.119 32.500 -0.218 0.000 1.127 290 K HN 0.117 8.367 8.250 -0.000 0.000 0.469 291 K N 1.279 121.620 120.400 -0.098 0.000 2.248 291 K HA 0.375 4.696 4.320 0.001 0.000 0.281 291 K C -0.171 176.402 176.600 -0.046 0.000 1.054 291 K CA 0.109 56.358 56.287 -0.062 0.000 0.903 291 K CB 0.241 32.714 32.500 -0.044 0.000 1.077 291 K HN 0.380 8.630 8.250 -0.000 0.000 0.474 292 I N 5.116 125.670 120.570 -0.027 0.000 2.555 292 I HA 0.228 4.399 4.170 0.001 0.000 0.275 292 I C -2.192 173.969 176.117 0.073 0.000 1.082 292 I CA -2.132 59.176 61.300 0.013 0.000 1.167 292 I CB 1.171 39.169 38.000 -0.002 0.000 1.312 292 I HN 0.390 8.600 8.210 -0.000 0.000 0.493 293 P HA 0.195 4.615 4.420 -0.000 0.000 0.281 293 P C -1.383 175.982 177.300 0.108 0.000 1.252 293 P CA -0.013 63.106 63.100 0.031 0.000 0.778 293 P CB 0.456 32.151 31.700 -0.008 0.000 0.895 294 Y N -0.449 119.843 120.300 -0.013 0.000 2.477 294 Y HA 0.625 5.175 4.550 0.001 0.000 0.347 294 Y C -0.753 175.133 175.900 -0.024 0.000 0.981 294 Y CA -1.328 56.758 58.100 -0.023 0.000 1.033 294 Y CB 2.015 40.450 38.460 -0.042 0.000 1.245 294 Y HN 0.091 8.371 8.280 -0.000 0.000 0.455 295 K N 3.951 124.422 120.400 0.117 0.000 2.265 295 K HA 0.524 4.845 4.320 0.001 0.000 0.267 295 K C -1.122 175.558 176.600 0.133 0.000 0.994 295 K CA -1.012 55.306 56.287 0.051 0.000 0.860 295 K CB 2.417 34.934 32.500 0.028 0.000 1.099 295 K HN 0.631 8.881 8.250 -0.000 0.000 0.448 296 V N 4.364 124.365 119.914 0.144 0.000 2.555 296 V HA 0.115 4.235 4.120 0.001 0.000 0.286 296 V C 0.574 176.728 176.094 0.100 0.000 1.044 296 V CA -0.286 62.100 62.300 0.142 0.000 1.026 296 V CB 0.845 32.760 31.823 0.153 0.000 0.981 296 V HN 0.614 8.804 8.190 -0.000 0.000 0.480 297 V N 2.152 122.139 119.914 0.122 0.000 3.165 297 V HA 1.005 5.125 4.120 0.001 0.000 0.307 297 V C 0.268 176.452 176.094 0.151 0.000 1.281 297 V CA -0.746 61.639 62.300 0.141 0.000 1.056 297 V CB 1.328 33.266 31.823 0.192 0.000 1.178 297 V HN 0.954 9.144 8.190 -0.000 0.000 0.475 298 A N 0.059 122.958 122.820 0.133 0.000 2.346 298 A HA 0.561 4.881 4.320 0.001 0.000 0.252 298 A C 0.547 178.210 177.584 0.131 0.000 1.089 298 A CA -0.453 51.636 52.037 0.088 0.000 0.797 298 A CB -0.109 18.911 19.000 0.034 0.000 1.047 298 A HN 0.828 8.978 8.150 -0.000 0.000 0.494 299 R N -0.083 120.464 120.500 0.077 0.000 2.679 299 R HA 0.140 4.480 4.340 0.001 0.000 0.268 299 R C 0.377 176.697 176.300 0.034 0.000 1.044 299 R CA 0.129 56.305 56.100 0.127 0.000 1.105 299 R CB 0.369 30.696 30.300 0.046 0.000 0.989 299 R HN 0.707 8.977 8.270 -0.000 0.000 0.447 300 R N 2.128 122.632 120.500 0.007 0.000 2.312 300 R HA 0.050 4.390 4.340 0.001 0.000 0.311 300 R C -0.498 175.746 176.300 -0.093 0.000 1.004 300 R CA -0.401 55.566 56.100 -0.222 0.000 0.902 300 R CB 0.861 30.850 30.300 -0.519 0.000 1.073 300 R HN 0.556 8.826 8.270 -0.000 0.000 0.457 301 E N 2.200 122.333 120.200 -0.112 0.000 2.480 301 E HA -0.015 4.336 4.350 0.001 0.000 0.258 301 E C 0.595 177.156 176.600 -0.065 0.000 0.984 301 E CA 1.458 57.818 56.400 -0.066 0.000 0.930 301 E CB 0.692 30.347 29.700 -0.074 0.000 0.936 301 E HN 0.999 9.359 8.360 -0.000 0.000 0.466 302 G N 3.919 112.700 108.800 -0.032 0.000 2.254 302 G HA2 -0.196 3.765 3.960 0.001 0.000 0.225 302 G HA3 -0.196 3.765 3.960 0.001 0.000 0.225 302 G C -0.099 174.794 174.900 -0.012 0.000 1.003 302 G CA -0.214 44.867 45.100 -0.032 0.000 0.622 302 G HN 0.547 8.837 8.290 -0.000 0.000 0.507 303 D N 1.141 121.545 120.400 0.008 0.000 2.350 303 D HA 0.492 5.132 4.640 0.001 0.000 0.249 303 D C 1.080 177.377 176.300 -0.005 0.000 1.119 303 D CA 0.473 54.476 54.000 0.005 0.000 0.886 303 D CB 1.992 42.812 40.800 0.033 0.000 1.195 303 D HN 0.904 9.274 8.370 -0.000 0.000 0.437 304 V N -0.527 119.346 119.914 -0.070 0.000 2.997 304 V HA 0.666 4.786 4.120 0.001 0.000 0.311 304 V C 1.111 177.039 176.094 -0.276 0.000 1.066 304 V CA -0.220 62.026 62.300 -0.090 0.000 1.039 304 V CB 1.321 33.103 31.823 -0.069 0.000 1.081 304 V HN 0.546 8.736 8.190 -0.000 0.000 0.467 305 A N 2.397 125.071 122.820 -0.243 0.000 1.841 305 A HA 0.628 4.948 4.320 0.001 0.000 0.214 305 A C 1.297 178.727 177.584 -0.256 0.000 1.195 305 A CA 1.415 53.198 52.037 -0.423 0.000 0.611 305 A CB -0.638 18.361 19.000 -0.002 0.000 0.835 305 A HN 2.170 10.320 8.150 -0.000 0.000 0.443 306 A N -2.150 120.609 122.820 -0.101 0.000 2.549 306 A HA 0.574 4.894 4.320 0.001 0.000 0.297 306 A C -0.669 176.888 177.584 -0.046 0.000 1.061 306 A CA 0.018 52.043 52.037 -0.019 0.000 0.690 306 A CB 0.867 19.912 19.000 0.075 0.000 1.287 306 A HN 1.782 9.932 8.150 -0.000 0.000 0.402 307 C N 0.205 119.516 119.300 0.019 0.000 3.046 307 C HA 0.902 5.363 4.460 0.001 0.000 0.388 307 C C -1.414 173.666 174.990 0.149 0.000 1.041 307 C CA -1.002 57.981 59.018 -0.059 0.000 1.241 307 C CB -0.209 27.497 27.740 -0.056 0.000 1.638 307 C HN 1.738 9.968 8.230 -0.000 0.000 0.539 308 Y N 0.699 121.036 120.300 0.062 0.000 2.581 308 Y HA 0.872 5.420 4.550 -0.003 0.000 0.337 308 Y C -0.204 175.507 175.900 -0.316 0.000 1.108 308 Y CA -0.601 57.448 58.100 -0.085 0.000 1.033 308 Y CB 0.685 39.064 38.460 -0.136 0.000 1.318 308 Y HN 1.193 9.473 8.280 -0.000 0.000 0.459 309 A N 1.802 124.193 122.820 -0.714 0.000 2.286 309 A HA 0.451 4.771 4.320 0.001 0.000 0.286 309 A C -0.546 176.890 177.584 -0.247 0.000 1.097 309 A CA -0.705 50.864 52.037 -0.781 0.000 0.821 309 A CB 0.480 18.700 19.000 -1.300 0.000 1.076 309 A HN 0.743 8.893 8.150 -0.000 0.000 0.490 310 N N 1.318 119.932 118.700 -0.143 0.000 2.609 310 N HA 0.325 5.065 4.740 0.001 0.000 0.234 310 N C -2.443 173.083 175.510 0.026 0.000 1.001 310 N CA -1.950 51.091 53.050 -0.016 0.000 0.926 310 N CB 1.364 39.871 38.487 0.034 0.000 1.130 310 N HN 0.230 8.610 8.380 -0.000 0.000 0.510 311 P HA 0.185 4.605 4.420 -0.000 0.000 0.258 311 P C 0.609 177.990 177.300 0.136 0.000 1.416 311 P CA 0.018 63.188 63.100 0.117 0.000 0.927 311 P CB 0.344 32.112 31.700 0.113 0.000 1.444 312 S N 0.802 116.565 115.700 0.105 0.000 2.351 312 S HA -0.176 4.295 4.470 0.001 0.000 0.220 312 S C 1.749 176.429 174.600 0.134 0.000 1.035 312 S CA 1.124 59.383 58.200 0.099 0.000 1.031 312 S CB -1.245 62.004 63.200 0.080 0.000 0.928 312 S HN 0.154 8.464 8.310 -0.000 0.000 0.433 313 L N 1.973 123.301 121.223 0.174 0.000 2.021 313 L HA -0.194 4.146 4.340 0.001 0.000 0.215 313 L C 2.457 179.472 176.870 0.242 0.000 1.074 313 L CA 2.082 57.064 54.840 0.237 0.000 0.760 313 L CB -0.938 41.297 42.059 0.293 0.000 0.889 313 L HN 0.298 8.528 8.230 -0.000 0.000 0.433 314 A N -1.475 121.491 122.820 0.244 0.000 1.933 314 A HA -0.257 4.063 4.320 0.001 0.000 0.218 314 A C 2.267 179.922 177.584 0.118 0.000 1.175 314 A CA 1.715 53.812 52.037 0.101 0.000 0.628 314 A CB -0.684 18.487 19.000 0.285 0.000 0.814 314 A HN 0.625 8.775 8.150 -0.000 0.000 0.444 315 Q N -0.233 119.665 119.800 0.163 0.000 1.993 315 Q HA -0.193 4.148 4.340 0.001 0.000 0.202 315 Q C 1.924 177.964 176.000 0.066 0.000 0.984 315 Q CA 1.951 57.817 55.803 0.104 0.000 0.837 315 Q CB -0.307 28.472 28.738 0.070 0.000 0.902 315 Q HN 0.653 8.923 8.270 -0.000 0.000 0.423 316 E N 0.533 120.776 120.200 0.071 0.000 2.028 316 E HA -0.146 4.204 4.350 0.001 0.000 0.191 316 E C 1.970 178.602 176.600 0.052 0.000 0.988 316 E CA 1.152 57.591 56.400 0.064 0.000 0.799 316 E CB -0.082 29.668 29.700 0.083 0.000 0.755 316 E HN 0.497 8.857 8.360 -0.000 0.000 0.447 317 E N -0.074 120.153 120.200 0.044 0.000 2.140 317 E HA 0.066 4.417 4.350 0.001 0.000 0.191 317 E C 2.117 178.648 176.600 -0.115 0.000 0.973 317 E CA 0.191 56.598 56.400 0.011 0.000 0.829 317 E CB 0.221 30.023 29.700 0.170 0.000 0.781 317 E HN 0.132 8.492 8.360 -0.000 0.000 0.466 318 L N -0.417 120.666 121.223 -0.234 0.000 2.477 318 L HA 0.188 4.528 4.340 0.001 0.000 0.220 318 L C 1.027 177.895 176.870 -0.004 0.000 1.106 318 L CA 0.248 54.968 54.840 -0.200 0.000 0.851 318 L CB 0.251 42.124 42.059 -0.309 0.000 0.994 318 L HN 0.212 8.442 8.230 -0.000 0.000 0.462 319 G N 0.348 109.167 108.800 0.031 0.000 2.314 319 G HA2 -0.305 3.655 3.960 0.001 0.000 0.292 319 G HA3 -0.305 3.655 3.960 0.001 0.000 0.292 319 G C -0.595 174.386 174.900 0.135 0.000 1.059 319 G CA 0.243 45.381 45.100 0.064 0.000 0.982 319 G HN 0.451 8.741 8.290 -0.000 0.000 0.505 320 W N 0.813 122.076 121.300 -0.061 0.000 2.883 320 W HA 0.681 5.341 4.660 0.000 0.000 0.335 320 W C 0.099 176.604 176.519 -0.024 0.000 1.083 320 W CA -0.205 57.115 57.345 -0.042 0.000 1.233 320 W CB 1.879 31.306 29.460 -0.056 0.000 1.412 320 W HN 0.730 8.910 8.180 -0.000 0.000 0.490 321 T N 2.421 116.395 114.554 -0.966 0.000 2.933 321 T HA 0.737 5.088 4.350 0.001 0.000 0.305 321 T C -0.708 173.134 174.700 -1.430 0.000 1.092 321 T CA -0.856 60.612 62.100 -1.054 0.000 1.008 321 T CB 1.332 69.934 68.868 -0.443 0.000 1.102 321 T HN 0.922 9.162 8.240 -0.000 0.000 0.469 322 A N 1.537 123.660 122.820 -1.162 0.000 2.409 322 A HA 0.737 5.057 4.320 0.001 0.000 0.267 322 A C 1.362 178.747 177.584 -0.332 0.000 1.127 322 A CA -0.132 51.533 52.037 -0.620 0.000 0.795 322 A CB -0.050 18.812 19.000 -0.230 0.000 1.061 322 A HN 1.430 9.580 8.150 -0.000 0.000 0.502 323 A N 3.289 125.964 122.820 -0.242 0.000 1.871 323 A HA 0.283 4.604 4.320 0.001 0.000 0.211 323 A C 0.902 178.433 177.584 -0.088 0.000 1.207 323 A CA 0.275 52.216 52.037 -0.160 0.000 0.620 323 A CB -0.698 18.213 19.000 -0.147 0.000 0.860 323 A HN 0.780 8.930 8.150 -0.000 0.000 0.450 324 L N 1.393 122.577 121.223 -0.066 0.000 2.584 324 L HA 0.308 4.649 4.340 0.001 0.000 0.272 324 L C 0.962 177.874 176.870 0.071 0.000 1.195 324 L CA -0.241 54.592 54.840 -0.012 0.000 0.920 324 L CB -0.410 41.596 42.059 -0.089 0.000 1.173 324 L HN 0.329 8.559 8.230 -0.000 0.000 0.489 325 G N 1.939 110.778 108.800 0.065 0.000 2.522 325 G HA2 0.344 4.304 3.960 0.001 0.000 0.304 325 G HA3 0.344 4.304 3.960 0.001 0.000 0.304 325 G C 0.608 175.563 174.900 0.091 0.000 1.210 325 G CA -0.783 44.370 45.100 0.088 0.000 0.960 325 G HN 0.588 8.878 8.290 -0.000 0.000 0.497 326 L N -0.269 120.994 121.223 0.067 0.000 1.997 326 L HA -0.142 4.199 4.340 0.001 0.000 0.216 326 L C 2.165 178.993 176.870 -0.070 0.000 1.074 326 L CA 2.508 57.306 54.840 -0.069 0.000 0.763 326 L CB -0.497 41.371 42.059 -0.319 0.000 0.890 326 L HN 0.516 8.746 8.230 -0.000 0.000 0.434 327 D N -0.842 119.531 120.400 -0.044 0.000 2.104 327 D HA -0.223 4.417 4.640 0.001 0.000 0.194 327 D C 2.303 178.612 176.300 0.015 0.000 0.994 327 D CA 1.389 55.370 54.000 -0.032 0.000 0.830 327 D CB -0.149 40.636 40.800 -0.025 0.000 0.959 327 D HN 0.241 8.611 8.370 -0.000 0.000 0.452 328 R N 0.517 121.044 120.500 0.046 0.000 2.083 328 R HA -0.072 4.268 4.340 0.001 0.000 0.237 328 R C 2.315 178.716 176.300 0.169 0.000 1.137 328 R CA 1.290 57.446 56.100 0.094 0.000 0.951 328 R CB -0.494 29.855 30.300 0.082 0.000 0.851 328 R HN 0.160 8.430 8.270 -0.000 0.000 0.434 329 M N -0.890 118.814 119.600 0.173 0.000 2.080 329 M HA -0.249 4.232 4.480 0.001 0.000 0.260 329 M C 2.462 178.779 176.300 0.029 0.000 1.068 329 M CA 1.963 57.318 55.300 0.091 0.000 1.109 329 M CB -0.380 32.240 32.600 0.034 0.000 1.342 329 M HN 0.262 8.552 8.290 -0.000 0.000 0.405 330 C N 0.043 119.349 119.300 0.010 0.000 2.446 330 C HA -0.127 4.334 4.460 0.001 0.000 0.277 330 C C 2.640 177.692 174.990 0.105 0.000 1.275 330 C CA 1.082 60.109 59.018 0.016 0.000 1.727 330 C CB -1.153 26.553 27.740 -0.056 0.000 2.010 330 C HN 0.610 8.840 8.230 -0.000 0.000 0.486 331 E N 1.233 121.494 120.200 0.102 0.000 2.077 331 E HA -0.243 4.107 4.350 0.001 0.000 0.193 331 E C 1.337 178.055 176.600 0.196 0.000 0.989 331 E CA 1.652 58.147 56.400 0.158 0.000 0.800 331 E CB -0.168 29.595 29.700 0.106 0.000 0.746 331 E HN 0.521 8.881 8.360 -0.000 0.000 0.452 332 D N 0.688 121.191 120.400 0.171 0.000 2.117 332 D HA -0.146 4.494 4.640 0.001 0.000 0.198 332 D C 2.093 178.501 176.300 0.181 0.000 0.982 332 D CA 0.626 54.736 54.000 0.183 0.000 0.828 332 D CB -0.278 40.682 40.800 0.268 0.000 0.967 332 D HN 0.214 8.584 8.370 -0.000 0.000 0.464 333 L N 0.106 121.422 121.223 0.154 0.000 2.017 333 L HA -0.132 4.208 4.340 0.001 0.000 0.208 333 L C 2.372 179.381 176.870 0.232 0.000 1.073 333 L CA 1.392 56.342 54.840 0.185 0.000 0.745 333 L CB -0.131 41.999 42.059 0.120 0.000 0.894 333 L HN 0.231 8.461 8.230 -0.000 0.000 0.432 334 W N 0.769 122.091 121.300 0.037 0.000 2.335 334 W HA -0.295 4.365 4.660 0.001 0.000 0.311 334 W C 2.664 179.188 176.519 0.008 0.000 1.213 334 W CA 1.860 59.206 57.345 0.001 0.000 1.274 334 W CB -0.190 29.259 29.460 -0.018 0.000 1.148 334 W HN 0.200 8.380 8.180 -0.000 0.000 0.498 335 R N 0.469 120.933 120.500 -0.061 0.000 2.083 335 R HA -0.270 4.071 4.340 0.001 0.000 0.237 335 R C 2.451 178.656 176.300 -0.159 0.000 1.137 335 R CA 2.413 58.422 56.100 -0.152 0.000 0.951 335 R CB -1.506 28.813 30.300 0.033 0.000 0.851 335 R HN 0.458 8.728 8.270 -0.000 0.000 0.434 336 W N 1.532 122.725 121.300 -0.179 0.000 2.355 336 W HA -0.253 4.407 4.660 0.000 0.000 0.309 336 W C 1.723 178.066 176.519 -0.292 0.000 1.206 336 W CA 1.588 58.824 57.345 -0.182 0.000 1.284 336 W CB -0.386 29.017 29.460 -0.095 0.000 1.145 336 W HN 0.230 8.410 8.180 -0.000 0.000 0.502 337 Q N 1.491 120.943 119.800 -0.581 0.000 2.061 337 Q HA -0.268 4.072 4.340 0.001 0.000 0.204 337 Q C 2.418 177.935 176.000 -0.804 0.000 0.984 337 Q CA 2.924 58.277 55.803 -0.749 0.000 0.846 337 Q CB -0.739 27.746 28.738 -0.422 0.000 0.902 337 Q HN 0.356 8.626 8.270 -0.000 0.000 0.421 338 K N -0.507 119.313 120.400 -0.967 0.000 2.026 338 K HA -0.191 4.130 4.320 0.001 0.000 0.208 338 K C 2.079 178.360 176.600 -0.532 0.000 1.048 338 K CA 1.713 57.476 56.287 -0.873 0.000 0.929 338 K CB -0.070 31.755 32.500 -1.124 0.000 0.713 338 K HN 0.341 8.591 8.250 -0.000 0.000 0.439 339 Q N -0.262 119.262 119.800 -0.460 0.000 2.297 339 Q HA 0.011 4.351 4.340 0.001 0.000 0.204 339 Q C -0.059 175.715 176.000 -0.376 0.000 0.962 339 Q CA 0.626 56.238 55.803 -0.318 0.000 0.879 339 Q CB 0.308 28.931 28.738 -0.192 0.000 0.947 339 Q HN 0.291 8.561 8.270 -0.000 0.000 0.462 340 N N 0.360 118.701 118.700 -0.599 0.000 2.765 340 N HA 0.131 4.871 4.740 0.001 0.000 0.277 340 N C -2.363 172.705 175.510 -0.737 0.000 1.750 340 N CA -0.882 51.732 53.050 -0.727 0.000 0.827 340 N CB 1.378 39.136 38.487 -1.214 0.000 1.200 340 N HN 0.037 8.417 8.380 -0.000 0.000 0.494 341 P HA -0.042 4.378 4.420 -0.000 0.000 0.219 341 P C 0.873 177.958 177.300 -0.358 0.000 1.146 341 P CA 1.211 64.067 63.100 -0.407 0.000 0.808 341 P CB 0.451 31.980 31.700 -0.284 0.000 0.779 342 S N -1.513 113.978 115.700 -0.348 0.000 2.602 342 S HA 0.487 4.957 4.470 0.001 0.000 0.240 342 S C 0.960 175.362 174.600 -0.330 0.000 0.992 342 S CA 0.215 58.250 58.200 -0.275 0.000 0.971 342 S CB -0.174 62.909 63.200 -0.195 0.000 0.855 342 S HN 0.460 8.770 8.310 -0.000 0.000 0.481 343 G N 1.679 110.170 108.800 -0.516 0.000 2.553 343 G HA2 -0.273 3.687 3.960 0.001 0.000 0.242 343 G HA3 -0.273 3.687 3.960 0.001 0.000 0.242 343 G C 0.043 174.598 174.900 -0.574 0.000 1.277 343 G CA -0.196 44.551 45.100 -0.589 0.000 0.910 343 G HN 0.315 8.605 8.290 -0.000 0.000 0.576 344 F N 3.357 123.126 119.950 -0.301 0.000 2.802 344 F HA 0.440 4.967 4.527 0.000 0.000 0.302 344 F C 1.842 177.042 175.800 -1.000 0.000 1.211 344 F CA 1.730 59.422 58.000 -0.513 0.000 1.431 344 F CB -0.273 38.425 39.000 -0.503 0.000 1.114 344 F HN 1.419 9.719 8.300 -0.000 0.000 0.567 345 G N -1.422 106.990 108.800 -0.647 0.000 2.357 345 G HA2 0.435 4.395 3.960 0.001 0.000 0.289 345 G HA3 0.435 4.395 3.960 0.001 0.000 0.289 345 G C -0.864 173.945 174.900 -0.152 0.000 1.302 345 G CA -0.392 44.459 45.100 -0.416 0.000 0.936 345 G HN 0.324 8.614 8.290 -0.000 0.000 0.513 346 T N 0.000 114.627 114.554 0.121 0.000 3.816 346 T HA 0.000 4.350 4.350 0.001 0.000 0.228 346 T CA 0.000 62.193 62.100 0.154 0.000 1.349 346 T CB 0.000 68.894 68.868 0.044 0.000 0.612 346 T HN 0.000 8.240 8.240 -0.000 0.000 0.658