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 1h12_1_A DATA FIRST_RESID 1 DATA SEQUENCE AFNNNPSSVG AYSSGTYRNL AQEMGKTNIQ QKVNSTFDNM FGYNNTQQLY DATA SEQUENCE YPYTENGVYK AHYIKAINPD EGDDIRTEGQ SWGMTAAVML NKQEEFDNLW DATA SEQUENCE RFAKAYQKNP DNHPDAKKQG VYAWKLKLNQ NGFVYKVDEG PAPDGEEYFA DATA SEQUENCE FALLNASARW GNSGEFNYYN DAITMLNTIK NKLMENQIIR FSPYIDNLTD DATA SEQUENCE PSYHIPAFYD YFANNVTNQA DKNYWRQVAT KSRTLLKNHF TKVSGSPHWN DATA SEQUENCE LPTFLSRLDG SPVIGYIFNG QANPGQWYEF DAWRVIMNVG LDAHLMGAQA DATA SEQUENCE WHKSAVNKAL GFLSYAKTNN SKNcYEQVYS YGGAQNRGcA GEGQKAANAV DATA SEQUENCE ALLASTNAGQ ANEFFNEFWS LSQPTGDYRY YNGSLYMLAM LHVSGNFKFY DATA SEQUENCE NNTF 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 1 A HA 0.000 4.320 4.320 -0.000 0.000 0.244 1 A C 0.000 177.581 177.584 -0.005 0.000 1.274 1 A CA 0.000 52.025 52.037 -0.019 0.000 0.836 1 A CB 0.000 18.991 19.000 -0.015 0.000 0.831 2 F N 2.239 122.111 119.950 -0.129 0.000 2.608 2 F HA 0.292 5.335 4.527 0.861 0.000 0.380 2 F C 0.706 176.436 175.800 -0.118 0.000 1.083 2 F CA 0.218 58.133 58.000 -0.143 0.000 1.266 2 F CB 0.459 39.383 39.000 -0.126 0.000 1.076 2 F HN 0.596 8.896 8.300 -0.000 0.000 0.574 3 N N 5.511 123.737 118.700 -0.789 0.000 2.415 3 N HA -0.009 5.241 4.740 0.851 0.000 0.250 3 N C 0.323 175.134 175.510 -1.165 0.000 1.127 3 N CA -0.204 52.408 53.050 -0.730 0.000 0.945 3 N CB -0.215 37.980 38.487 -0.486 0.000 1.196 3 N HN 0.668 9.048 8.380 -0.000 0.000 0.499 4 N N 2.170 120.426 118.700 -0.739 0.000 2.370 4 N HA -0.033 5.218 4.740 0.851 0.000 0.198 4 N C -0.513 174.842 175.510 -0.259 0.000 1.156 4 N CA 0.011 52.796 53.050 -0.442 0.000 0.839 4 N CB -0.118 38.344 38.487 -0.043 0.000 0.989 4 N HN 0.282 8.662 8.380 -0.000 0.000 0.468 5 N N 1.534 120.063 118.700 -0.284 0.000 2.813 5 N HA 0.269 5.519 4.740 0.851 0.000 0.282 5 N C -2.810 172.575 175.510 -0.209 0.000 1.748 5 N CA -1.641 51.293 53.050 -0.195 0.000 0.860 5 N CB 0.819 39.217 38.487 -0.149 0.000 1.204 5 N HN 0.088 8.468 8.380 -0.000 0.000 0.490 6 P HA 0.008 4.428 4.420 -0.000 0.000 0.266 6 P C 0.102 177.294 177.300 -0.179 0.000 1.195 6 P CA 0.041 63.008 63.100 -0.222 0.000 0.768 6 P CB 0.858 32.419 31.700 -0.232 0.000 0.838 7 S N 1.529 117.134 115.700 -0.160 0.000 2.560 7 S HA 0.041 5.022 4.470 0.851 0.000 0.284 7 S C 1.603 176.119 174.600 -0.140 0.000 1.327 7 S CA 0.056 58.176 58.200 -0.134 0.000 1.055 7 S CB -0.029 63.100 63.200 -0.118 0.000 0.868 7 S HN 0.524 8.834 8.310 -0.000 0.000 0.506 8 S N 3.055 118.688 115.700 -0.112 0.000 2.515 8 S HA 0.064 5.045 4.470 0.851 0.000 0.231 8 S C 0.369 174.917 174.600 -0.087 0.000 0.987 8 S CA -0.103 58.038 58.200 -0.099 0.000 0.936 8 S CB -0.222 62.940 63.200 -0.062 0.000 0.766 8 S HN 0.448 8.758 8.310 -0.000 0.000 0.528 9 V N 2.189 122.049 119.914 -0.091 0.000 2.370 9 V HA 0.665 5.295 4.120 0.851 0.000 0.279 9 V C 0.997 177.021 176.094 -0.117 0.000 1.029 9 V CA -0.535 61.714 62.300 -0.085 0.000 0.870 9 V CB 0.835 32.611 31.823 -0.077 0.000 0.984 9 V HN 0.429 8.619 8.190 -0.000 0.000 0.451 10 G N 2.850 111.580 108.800 -0.116 0.000 2.572 10 G HA2 0.442 4.913 3.960 0.851 0.000 0.261 10 G HA3 0.442 4.913 3.960 0.851 0.000 0.261 10 G C 1.047 175.798 174.900 -0.247 0.000 1.197 10 G CA 0.130 45.126 45.100 -0.172 0.000 0.870 10 G HN 0.988 9.278 8.290 -0.000 0.000 0.548 11 A N 0.441 122.996 122.820 -0.442 0.000 1.972 11 A HA -0.115 4.716 4.320 0.851 0.000 0.219 11 A C 2.004 179.273 177.584 -0.525 0.000 1.169 11 A CA 1.692 53.290 52.037 -0.731 0.000 0.635 11 A CB -0.622 17.451 19.000 -1.545 0.000 0.810 11 A HN 0.766 8.916 8.150 -0.000 0.000 0.446 12 Y N 0.788 120.795 120.300 -0.488 0.000 2.224 12 Y HA -0.148 4.913 4.550 0.852 0.000 0.289 12 Y C 2.855 178.700 175.900 -0.092 0.000 1.146 12 Y CA 1.268 59.239 58.100 -0.214 0.000 1.182 12 Y CB -0.637 37.756 38.460 -0.112 0.000 0.983 12 Y HN 0.357 8.637 8.280 -0.000 0.000 0.524 13 S N -1.330 114.308 115.700 -0.103 0.000 2.425 13 S HA -0.073 4.908 4.470 0.851 0.000 0.225 13 S C 2.130 176.661 174.600 -0.115 0.000 1.024 13 S CA 1.129 59.241 58.200 -0.146 0.000 0.951 13 S CB -0.590 62.549 63.200 -0.102 0.000 0.796 13 S HN 0.588 8.898 8.310 -0.000 0.000 0.498 14 S N -0.546 115.078 115.700 -0.127 0.000 2.486 14 S HA 0.373 5.354 4.470 0.851 0.000 0.220 14 S C 1.724 176.272 174.600 -0.087 0.000 1.011 14 S CA 0.912 59.050 58.200 -0.104 0.000 0.921 14 S CB -0.338 62.792 63.200 -0.117 0.000 0.785 14 S HN 1.276 9.586 8.310 -0.000 0.000 0.517 15 G N 0.758 109.493 108.800 -0.108 0.000 2.184 15 G HA2 -0.234 4.237 3.960 0.851 0.000 0.264 15 G HA3 -0.234 4.237 3.960 0.851 0.000 0.264 15 G C 0.155 175.042 174.900 -0.022 0.000 0.975 15 G CA 0.471 45.556 45.100 -0.026 0.000 0.642 15 G HN 0.643 8.933 8.290 -0.000 0.000 0.536 16 T N 1.221 115.694 114.554 -0.135 0.000 2.738 16 T HA 0.532 5.393 4.350 0.851 0.000 0.298 16 T C -0.513 174.083 174.700 -0.174 0.000 0.962 16 T CA -0.087 61.969 62.100 -0.074 0.000 0.972 16 T CB 0.591 69.415 68.868 -0.073 0.000 0.928 16 T HN 0.228 8.468 8.240 -0.000 0.000 0.474 17 Y N 2.389 122.695 120.300 0.009 0.000 2.320 17 Y HA 0.398 5.458 4.550 0.850 0.000 0.334 17 Y C 1.231 177.238 175.900 0.178 0.000 1.055 17 Y CA -0.986 57.181 58.100 0.111 0.000 1.143 17 Y CB 0.896 39.388 38.460 0.053 0.000 1.193 17 Y HN 0.398 8.678 8.280 -0.000 0.000 0.477 18 R N 1.848 122.603 120.500 0.425 0.000 2.594 18 R HA 0.088 4.939 4.340 0.851 0.000 0.272 18 R C -0.211 176.133 176.300 0.073 0.000 1.074 18 R CA -0.318 55.827 56.100 0.075 0.000 1.105 18 R CB 0.330 30.506 30.300 -0.206 0.000 1.008 18 R HN 0.505 8.775 8.270 -0.000 0.000 0.472 19 N N 3.129 121.832 118.700 0.004 0.000 2.706 19 N HA 0.018 5.268 4.740 0.851 0.000 0.240 19 N C 0.326 175.782 175.510 -0.091 0.000 1.039 19 N CA -0.209 52.840 53.050 -0.003 0.000 0.888 19 N CB 0.954 39.450 38.487 0.014 0.000 1.128 19 N HN 0.470 8.850 8.380 -0.000 0.000 0.512 20 L N 4.146 125.300 121.223 -0.116 0.000 2.042 20 L HA -0.005 4.846 4.340 0.851 0.000 0.210 20 L C 2.001 178.608 176.870 -0.438 0.000 1.076 20 L CA 2.154 56.862 54.840 -0.219 0.000 0.749 20 L CB -0.638 41.332 42.059 -0.149 0.000 0.893 20 L HN 0.549 8.779 8.230 -0.000 0.000 0.432 21 A N -1.136 121.468 122.820 -0.360 0.000 1.933 21 A HA -0.296 4.535 4.320 0.851 0.000 0.218 21 A C 2.332 179.661 177.584 -0.425 0.000 1.175 21 A CA 1.889 53.598 52.037 -0.547 0.000 0.628 21 A CB -0.690 18.066 19.000 -0.407 0.000 0.814 21 A HN 0.678 8.828 8.150 -0.000 0.000 0.444 22 Q N -0.372 119.287 119.800 -0.235 0.000 2.079 22 Q HA -0.202 4.649 4.340 0.851 0.000 0.200 22 Q C 1.878 177.775 176.000 -0.172 0.000 0.974 22 Q CA 1.621 57.329 55.803 -0.157 0.000 0.840 22 Q CB -0.168 28.521 28.738 -0.081 0.000 0.898 22 Q HN 0.776 9.046 8.270 -0.000 0.000 0.430 23 E N -0.224 119.863 120.200 -0.188 0.000 2.130 23 E HA -0.193 4.667 4.350 0.851 0.000 0.196 23 E C 1.539 178.033 176.600 -0.176 0.000 0.998 23 E CA 1.028 57.333 56.400 -0.158 0.000 0.806 23 E CB 0.019 29.636 29.700 -0.139 0.000 0.738 23 E HN 0.413 8.773 8.360 -0.000 0.000 0.459 24 M N -0.766 118.642 119.600 -0.319 0.000 2.563 24 M HA 0.124 5.115 4.480 0.851 0.000 0.231 24 M C 1.164 177.330 176.300 -0.223 0.000 1.136 24 M CA 0.634 55.731 55.300 -0.338 0.000 1.026 24 M CB 0.065 32.227 32.600 -0.730 0.000 1.597 24 M HN 0.268 8.558 8.290 -0.000 0.000 0.495 25 G N 0.921 109.611 108.800 -0.182 0.000 2.136 25 G HA2 -0.212 4.258 3.960 0.851 0.000 0.242 25 G HA3 -0.212 4.258 3.960 0.851 0.000 0.242 25 G C 0.146 174.990 174.900 -0.094 0.000 0.989 25 G CA -0.022 45.015 45.100 -0.105 0.000 0.682 25 G HN 0.317 8.607 8.290 -0.000 0.000 0.522 26 K N 0.969 121.265 120.400 -0.173 0.000 2.126 26 K HA 0.673 5.504 4.320 0.851 0.000 0.257 26 K C 0.898 177.500 176.600 0.003 0.000 1.007 26 K CA 0.443 56.657 56.287 -0.121 0.000 0.928 26 K CB 1.022 33.244 32.500 -0.464 0.000 1.013 26 K HN 0.587 8.837 8.250 -0.000 0.000 0.473 27 T N -3.968 110.659 114.554 0.122 0.000 2.926 27 T HA 0.393 5.254 4.350 0.851 0.000 0.289 27 T C 0.587 175.412 174.700 0.208 0.000 1.054 27 T CA -0.065 62.112 62.100 0.129 0.000 1.015 27 T CB 0.739 69.666 68.868 0.099 0.000 1.167 27 T HN 0.733 8.973 8.240 -0.000 0.000 0.526 28 N N -0.522 118.272 118.700 0.156 0.000 2.721 28 N HA -0.179 5.071 4.740 0.851 0.000 0.249 28 N C 0.931 176.578 175.510 0.229 0.000 1.072 28 N CA 1.171 54.317 53.050 0.160 0.000 0.710 28 N CB -2.461 36.110 38.487 0.140 0.000 0.993 28 N HN 0.759 9.139 8.380 -0.000 0.000 0.547 29 I N -0.861 119.861 120.570 0.252 0.000 2.163 29 I HA -0.283 4.398 4.170 0.851 0.000 0.240 29 I C 2.513 178.791 176.117 0.268 0.000 1.081 29 I CA 1.484 62.998 61.300 0.356 0.000 1.353 29 I CB -0.109 38.039 38.000 0.248 0.000 1.054 29 I HN 0.553 8.763 8.210 -0.000 0.000 0.407 30 Q N 0.511 120.415 119.800 0.173 0.000 2.124 30 Q HA -0.233 4.618 4.340 0.851 0.000 0.202 30 Q C 2.474 178.542 176.000 0.114 0.000 0.977 30 Q CA 2.117 57.998 55.803 0.131 0.000 0.850 30 Q CB -0.866 27.925 28.738 0.088 0.000 0.901 30 Q HN 0.726 8.996 8.270 -0.000 0.000 0.429 31 Q N 1.748 121.611 119.800 0.106 0.000 2.096 31 Q HA -0.186 4.665 4.340 0.851 0.000 0.204 31 Q C 1.923 177.972 176.000 0.082 0.000 0.982 31 Q CA 2.145 57.997 55.803 0.082 0.000 0.850 31 Q CB -0.636 28.144 28.738 0.070 0.000 0.901 31 Q HN 0.477 8.747 8.270 -0.000 0.000 0.422 32 K N -0.514 119.942 120.400 0.093 0.000 2.057 32 K HA -0.059 4.772 4.320 0.851 0.000 0.206 32 K C 2.110 178.753 176.600 0.071 0.000 1.050 32 K CA 1.236 57.543 56.287 0.032 0.000 0.935 32 K CB -0.241 32.217 32.500 -0.071 0.000 0.715 32 K HN 0.325 8.575 8.250 -0.000 0.000 0.439 33 V N 2.177 122.169 119.914 0.131 0.000 2.295 33 V HA -0.282 4.349 4.120 0.851 0.000 0.246 33 V C 1.895 178.083 176.094 0.156 0.000 1.049 33 V CA 2.012 64.405 62.300 0.154 0.000 1.024 33 V CB -0.667 31.255 31.823 0.165 0.000 0.648 33 V HN 0.416 8.606 8.190 -0.000 0.000 0.447 34 N N 0.260 119.032 118.700 0.121 0.000 2.120 34 N HA -0.122 5.128 4.740 0.851 0.000 0.188 34 N C 2.068 177.668 175.510 0.150 0.000 1.024 34 N CA 1.771 54.889 53.050 0.114 0.000 0.852 34 N CB -0.513 38.014 38.487 0.066 0.000 1.003 34 N HN 0.393 8.773 8.380 -0.000 0.000 0.424 35 S N -0.012 115.757 115.700 0.116 0.000 2.402 35 S HA -0.057 4.923 4.470 0.851 0.000 0.229 35 S C 1.958 176.640 174.600 0.136 0.000 1.021 35 S CA 1.104 59.368 58.200 0.105 0.000 0.974 35 S CB -0.363 62.872 63.200 0.060 0.000 0.800 35 S HN 0.409 8.719 8.310 -0.000 0.000 0.484 36 T N 1.696 116.352 114.554 0.170 0.000 2.652 36 T HA -0.089 4.772 4.350 0.851 0.000 0.267 36 T C 1.422 176.272 174.700 0.250 0.000 1.039 36 T CA 1.326 63.560 62.100 0.224 0.000 1.153 36 T CB -0.454 68.581 68.868 0.278 0.000 0.863 36 T HN 0.433 8.673 8.240 -0.000 0.000 0.428 37 F N 2.212 122.255 119.950 0.154 0.000 2.102 37 F HA -0.121 4.916 4.527 0.851 0.000 0.298 37 F C 1.971 177.881 175.800 0.182 0.000 1.105 37 F CA 1.361 59.466 58.000 0.175 0.000 1.239 37 F CB -0.298 38.715 39.000 0.022 0.000 0.991 37 F HN 0.048 8.348 8.300 -0.000 0.000 0.474 38 D N 0.075 120.651 120.400 0.295 0.000 2.144 38 D HA -0.174 4.977 4.640 0.851 0.000 0.199 38 D C 1.859 178.209 176.300 0.083 0.000 0.984 38 D CA 1.158 55.268 54.000 0.183 0.000 0.834 38 D CB -0.469 40.417 40.800 0.143 0.000 0.955 38 D HN 0.318 8.688 8.370 -0.000 0.000 0.465 39 N N 0.043 118.788 118.700 0.074 0.000 2.250 39 N HA -0.055 5.196 4.740 0.851 0.000 0.181 39 N C 1.788 177.299 175.510 0.002 0.000 1.017 39 N CA 0.285 53.356 53.050 0.035 0.000 0.866 39 N CB -0.264 38.242 38.487 0.031 0.000 0.985 39 N HN 0.258 8.638 8.380 -0.000 0.000 0.429 40 M N -0.771 118.826 119.600 -0.005 0.000 2.229 40 M HA -0.027 4.964 4.480 0.851 0.000 0.264 40 M C 0.351 176.472 176.300 -0.299 0.000 1.063 40 M CA 1.492 56.725 55.300 -0.110 0.000 1.114 40 M CB 0.057 32.618 32.600 -0.064 0.000 1.387 40 M HN -0.074 8.216 8.290 -0.000 0.000 0.420 41 F N 0.075 119.813 119.950 -0.353 0.000 2.664 41 F HA 0.373 5.411 4.527 0.850 0.000 0.303 41 F C 1.181 176.899 175.800 -0.136 0.000 1.092 41 F CA -0.284 57.475 58.000 -0.401 0.000 1.305 41 F CB -0.075 38.370 39.000 -0.926 0.000 1.054 41 F HN 0.052 8.352 8.300 -0.000 0.000 0.565 42 G N -1.396 107.422 108.800 0.029 0.000 2.434 42 G HA2 0.297 4.768 3.960 0.851 0.000 0.330 42 G HA3 0.297 4.768 3.960 0.851 0.000 0.330 42 G C -1.192 173.773 174.900 0.107 0.000 1.155 42 G CA -0.306 44.794 45.100 0.000 0.000 0.917 42 G HN 0.009 8.299 8.290 -0.000 0.000 0.493 43 Y N 1.380 121.673 120.300 -0.011 0.000 2.735 43 Y HA 0.130 5.191 4.550 0.851 0.000 0.354 43 Y C 1.207 177.081 175.900 -0.043 0.000 1.288 43 Y CA -1.608 56.455 58.100 -0.061 0.000 1.836 43 Y CB -0.204 38.240 38.460 -0.026 0.000 1.920 43 Y HN 0.710 8.990 8.280 -0.000 0.000 0.438 44 N N -1.329 117.426 118.700 0.093 0.000 2.227 44 N HA 0.042 5.293 4.740 0.851 0.000 0.196 44 N C 0.944 176.482 175.510 0.046 0.000 1.142 44 N CA 0.604 53.688 53.050 0.057 0.000 0.887 44 N CB -0.462 38.048 38.487 0.039 0.000 1.022 44 N HN 0.251 8.631 8.380 -0.000 0.000 0.500 45 N N -1.039 117.688 118.700 0.046 0.000 2.681 45 N HA -0.253 4.997 4.740 0.851 0.000 0.250 45 N C 0.823 176.376 175.510 0.072 0.000 1.133 45 N CA 1.924 55.027 53.050 0.088 0.000 0.732 45 N CB -2.503 36.037 38.487 0.088 0.000 1.107 45 N HN 0.554 8.934 8.380 -0.000 0.000 0.559 46 T N -1.717 112.866 114.554 0.049 0.000 3.447 46 T HA 0.136 4.997 4.350 0.851 0.000 0.218 46 T C 1.687 176.404 174.700 0.027 0.000 0.972 46 T CA 1.068 63.187 62.100 0.032 0.000 1.264 46 T CB -0.103 68.775 68.868 0.018 0.000 1.284 46 T HN 0.479 8.719 8.240 -0.000 0.000 0.361 47 Q N 1.318 121.125 119.800 0.012 0.000 2.398 47 Q HA 0.224 5.075 4.340 0.851 0.000 0.204 47 Q C 0.948 176.957 176.000 0.015 0.000 0.932 47 Q CA 0.112 55.917 55.803 0.003 0.000 0.916 47 Q CB -0.084 28.644 28.738 -0.017 0.000 1.024 47 Q HN 0.489 8.759 8.270 -0.000 0.000 0.504 48 Q N 0.655 120.460 119.800 0.009 0.000 2.283 48 Q HA -0.068 4.783 4.340 0.851 0.000 0.301 48 Q C -0.010 176.013 176.000 0.038 0.000 1.063 48 Q CA 0.519 56.293 55.803 -0.048 0.000 0.952 48 Q CB 0.423 29.083 28.738 -0.131 0.000 1.166 48 Q HN 0.385 8.655 8.270 -0.000 0.000 0.381 49 L N 3.946 125.145 121.223 -0.040 0.000 2.840 49 L HA 0.201 5.052 4.340 0.851 0.000 0.249 49 L C -0.153 176.770 176.870 0.088 0.000 1.119 49 L CA -0.291 54.616 54.840 0.113 0.000 0.930 49 L CB 0.492 42.592 42.059 0.068 0.000 1.295 49 L HN 0.662 8.892 8.230 -0.000 0.000 0.534 50 Y N 0.713 120.794 120.300 -0.365 0.000 2.367 50 Y HA 0.426 5.486 4.550 0.851 0.000 0.342 50 Y C -1.118 174.611 175.900 -0.285 0.000 0.979 50 Y CA -0.549 57.365 58.100 -0.311 0.000 1.161 50 Y CB 0.357 38.505 38.460 -0.520 0.000 1.155 50 Y HN -0.111 8.169 8.280 -0.000 0.000 0.503 51 Y N 7.388 127.407 120.300 -0.469 0.000 2.462 51 Y HA 0.448 5.508 4.550 0.850 0.000 0.346 51 Y C -2.327 173.092 175.900 -0.803 0.000 0.976 51 Y CA -2.757 54.972 58.100 -0.619 0.000 1.044 51 Y CB 1.929 39.920 38.460 -0.782 0.000 1.230 51 Y HN 0.522 8.802 8.280 -0.000 0.000 0.455 52 P HA 0.042 4.462 4.420 -0.000 0.000 0.275 52 P C -1.407 175.829 177.300 -0.107 0.000 1.228 52 P CA -0.052 62.647 63.100 -0.669 0.000 0.786 52 P CB 1.152 32.589 31.700 -0.438 0.000 0.927 53 Y N 2.301 122.563 120.300 -0.064 0.000 2.328 53 Y HA 0.479 5.540 4.550 0.852 0.000 0.336 53 Y C -0.339 175.537 175.900 -0.040 0.000 0.960 53 Y CA -0.293 57.861 58.100 0.089 0.000 1.134 53 Y CB 1.133 39.772 38.460 0.298 0.000 1.166 53 Y HN 0.433 8.713 8.280 -0.000 0.000 0.464 54 T N 2.309 116.510 114.554 -0.590 0.000 2.908 54 T HA 0.650 5.511 4.350 0.851 0.000 0.290 54 T C -1.020 173.272 174.700 -0.681 0.000 1.034 54 T CA -0.996 60.803 62.100 -0.503 0.000 1.010 54 T CB 2.044 70.789 68.868 -0.205 0.000 1.068 54 T HN 0.666 8.906 8.240 -0.000 0.000 0.481 55 E N 1.673 121.638 120.200 -0.392 0.000 2.216 55 E HA 0.337 5.198 4.350 0.851 0.000 0.260 55 E C -0.556 176.026 176.600 -0.030 0.000 0.880 55 E CA -1.030 55.264 56.400 -0.178 0.000 0.765 55 E CB 1.019 30.740 29.700 0.035 0.000 1.174 55 E HN 0.713 9.073 8.360 -0.000 0.000 0.417 56 N N 2.294 120.984 118.700 -0.016 0.000 2.721 56 N HA -0.243 5.008 4.740 0.851 0.000 0.249 56 N C 0.705 176.207 175.510 -0.013 0.000 1.072 56 N CA 1.405 54.468 53.050 0.021 0.000 0.710 56 N CB -1.099 37.444 38.487 0.094 0.000 0.993 56 N HN 1.056 9.436 8.380 -0.000 0.000 0.547 57 G N -2.721 106.047 108.800 -0.053 0.000 2.179 57 G HA2 -0.334 4.137 3.960 0.851 0.000 0.260 57 G HA3 -0.334 4.137 3.960 0.851 0.000 0.260 57 G C 0.032 174.929 174.900 -0.004 0.000 0.977 57 G CA 0.362 45.444 45.100 -0.031 0.000 0.641 57 G HN 0.482 8.772 8.290 -0.000 0.000 0.533 58 V N 1.381 121.289 119.914 -0.010 0.000 2.383 58 V HA 0.485 5.116 4.120 0.851 0.000 0.275 58 V C 0.475 176.575 176.094 0.010 0.000 1.036 58 V CA -1.072 61.243 62.300 0.025 0.000 0.889 58 V CB 1.101 32.937 31.823 0.022 0.000 0.985 58 V HN 0.359 8.549 8.190 -0.000 0.000 0.459 59 Y N 6.271 126.568 120.300 -0.006 0.000 2.620 59 Y HA 0.130 5.190 4.550 0.851 0.000 0.330 59 Y C 1.105 177.045 175.900 0.066 0.000 1.186 59 Y CA 0.502 58.610 58.100 0.014 0.000 1.467 59 Y CB 0.564 39.058 38.460 0.056 0.000 1.262 59 Y HN 0.588 8.868 8.280 -0.000 0.000 0.550 60 K N 4.515 124.385 120.400 -0.884 0.000 2.313 60 K HA 0.570 5.401 4.320 0.851 0.000 0.215 60 K C -0.209 176.044 176.600 -0.578 0.000 1.109 60 K CA 0.710 56.717 56.287 -0.467 0.000 0.895 60 K CB 0.082 32.582 32.500 0.001 0.000 1.234 60 K HN 0.649 8.899 8.250 -0.000 0.000 0.463 61 A N 0.227 122.789 122.820 -0.430 0.000 2.467 61 A HA 0.591 5.422 4.320 0.851 0.000 0.301 61 A C -1.493 176.349 177.584 0.430 0.000 1.126 61 A CA -0.698 51.483 52.037 0.240 0.000 0.632 61 A CB 0.810 20.129 19.000 0.532 0.000 1.331 61 A HN 0.269 8.419 8.150 -0.000 0.000 0.482 62 H N -1.213 118.101 119.070 0.408 0.000 2.731 62 H HA 0.655 5.722 4.556 0.851 0.000 0.368 62 H C -1.504 173.821 175.328 -0.005 0.000 1.168 62 H CA 0.052 56.175 56.048 0.125 0.000 1.181 62 H CB 2.041 31.712 29.762 -0.152 0.000 1.743 62 H HN 0.761 9.041 8.280 -0.000 0.000 0.547 63 Y N -0.891 119.294 120.300 -0.192 0.000 2.609 63 Y HA 0.444 5.505 4.550 0.850 0.000 0.342 63 Y C -1.250 174.625 175.900 -0.043 0.000 1.058 63 Y CA -1.427 56.436 58.100 -0.396 0.000 1.055 63 Y CB 0.976 38.781 38.460 -1.092 0.000 1.292 63 Y HN 0.258 8.538 8.280 -0.000 0.000 0.476 64 I N 2.919 123.588 120.570 0.166 0.000 2.337 64 I HA 0.232 4.913 4.170 0.851 0.000 0.291 64 I C -0.015 176.270 176.117 0.281 0.000 1.046 64 I CA -0.521 60.908 61.300 0.215 0.000 1.324 64 I CB 0.964 39.133 38.000 0.281 0.000 1.409 64 I HN 0.679 8.889 8.210 -0.000 0.000 0.494 65 K N 5.741 126.283 120.400 0.237 0.000 2.285 65 K HA 0.462 5.293 4.320 0.851 0.000 0.286 65 K C -0.046 176.582 176.600 0.047 0.000 1.072 65 K CA -0.433 55.947 56.287 0.155 0.000 0.913 65 K CB 0.793 33.244 32.500 -0.081 0.000 1.067 65 K HN 0.718 8.968 8.250 -0.000 0.000 0.479 66 A N 6.999 129.675 122.820 -0.240 0.000 3.004 66 A HA 0.221 5.052 4.320 0.851 0.000 0.286 66 A C 0.132 177.545 177.584 -0.285 0.000 1.632 66 A CA -0.548 51.094 52.037 -0.659 0.000 1.339 66 A CB -0.679 17.670 19.000 -1.085 0.000 1.136 66 A HN 0.825 8.975 8.150 -0.000 0.000 0.577 67 I N 2.019 122.534 120.570 -0.093 0.000 2.752 67 I HA -0.049 4.632 4.170 0.851 0.000 0.289 67 I C 0.503 176.562 176.117 -0.097 0.000 1.197 67 I CA 0.519 61.770 61.300 -0.082 0.000 1.432 67 I CB 0.287 38.273 38.000 -0.023 0.000 1.359 67 I HN 0.587 8.797 8.210 -0.000 0.000 0.571 68 N N 8.746 127.368 118.700 -0.130 0.000 2.629 68 N HA 0.248 5.499 4.740 0.851 0.000 0.277 68 N C -2.196 173.235 175.510 -0.131 0.000 1.188 68 N CA -1.498 51.475 53.050 -0.128 0.000 0.835 68 N CB 1.978 40.398 38.487 -0.111 0.000 1.420 68 N HN 0.113 8.493 8.380 -0.000 0.000 0.542 69 P HA 0.061 4.481 4.420 -0.000 0.000 0.221 69 P C 0.795 178.053 177.300 -0.071 0.000 1.150 69 P CA 1.265 64.280 63.100 -0.142 0.000 0.800 69 P CB 0.193 31.759 31.700 -0.222 0.000 0.787 70 D N -0.180 120.194 120.400 -0.044 0.000 2.271 70 D HA -0.028 5.123 4.640 0.851 0.000 0.206 70 D C 1.563 177.857 176.300 -0.009 0.000 0.967 70 D CA 0.696 54.697 54.000 0.001 0.000 0.867 70 D CB -0.284 40.542 40.800 0.043 0.000 0.960 70 D HN 0.121 8.491 8.370 -0.000 0.000 0.509 71 E N -1.807 118.376 120.200 -0.028 0.000 2.676 71 E HA 0.486 5.346 4.350 0.851 0.000 0.225 71 E C 0.607 177.176 176.600 -0.053 0.000 0.944 71 E CA 0.347 56.729 56.400 -0.030 0.000 1.156 71 E CB 0.984 30.670 29.700 -0.023 0.000 1.117 71 E HN 1.331 9.691 8.360 -0.000 0.000 0.523 72 G N 1.773 110.532 108.800 -0.068 0.000 2.788 72 G HA2 -0.122 4.349 3.960 0.851 0.000 0.686 72 G HA3 -0.122 4.349 3.960 0.851 0.000 0.686 72 G C -0.962 173.868 174.900 -0.116 0.000 1.147 72 G CA -0.569 44.482 45.100 -0.081 0.000 0.755 72 G HN 0.128 8.418 8.290 -0.000 0.000 0.634 73 D N 1.326 121.650 120.400 -0.127 0.000 2.472 73 D HA 0.448 5.599 4.640 0.851 0.000 0.237 73 D C 0.785 176.968 176.300 -0.195 0.000 1.141 73 D CA 1.347 55.251 54.000 -0.159 0.000 0.875 73 D CB 1.174 41.880 40.800 -0.156 0.000 1.192 73 D HN 0.796 9.166 8.370 -0.000 0.000 0.450 74 D N -0.618 119.637 120.400 -0.241 0.000 2.798 74 D HA 0.583 5.734 4.640 0.851 0.000 0.308 74 D C -0.857 175.256 176.300 -0.312 0.000 1.187 74 D CA -0.693 53.127 54.000 -0.301 0.000 1.033 74 D CB 0.600 41.200 40.800 -0.334 0.000 1.445 74 D HN 0.261 8.631 8.370 -0.000 0.000 0.550 75 I N -0.606 119.766 120.570 -0.330 0.000 2.534 75 I HA 0.453 5.134 4.170 0.851 0.000 0.288 75 I C -0.473 175.536 176.117 -0.181 0.000 1.077 75 I CA -0.788 60.364 61.300 -0.247 0.000 1.051 75 I CB 1.869 39.677 38.000 -0.321 0.000 1.234 75 I HN 0.122 8.332 8.210 -0.000 0.000 0.425 76 R N 2.286 122.733 120.500 -0.088 0.000 2.740 76 R HA 0.421 5.272 4.340 0.851 0.000 0.282 76 R C 1.006 177.361 176.300 0.092 0.000 0.969 76 R CA -0.599 55.511 56.100 0.016 0.000 0.918 76 R CB 2.168 32.495 30.300 0.046 0.000 1.175 76 R HN 0.756 9.026 8.270 -0.000 0.000 0.464 77 T N -1.846 112.785 114.554 0.128 0.000 2.821 77 T HA -0.125 4.736 4.350 0.851 0.000 0.267 77 T C 1.277 175.802 174.700 -0.290 0.000 1.046 77 T CA 1.091 63.234 62.100 0.071 0.000 1.139 77 T CB -0.051 68.928 68.868 0.186 0.000 0.871 77 T HN 0.575 8.815 8.240 -0.000 0.000 0.454 78 E N 1.318 121.285 120.200 -0.389 0.000 2.038 78 E HA -0.042 4.819 4.350 0.851 0.000 0.195 78 E C 2.598 178.474 176.600 -1.206 0.000 1.000 78 E CA 1.115 56.889 56.400 -1.044 0.000 0.803 78 E CB -0.699 28.359 29.700 -1.069 0.000 0.750 78 E HN 0.658 9.018 8.360 -0.000 0.000 0.448 79 G N 0.635 109.208 108.800 -0.378 0.000 2.422 79 G HA2 -0.343 4.128 3.960 0.851 0.000 0.218 79 G HA3 -0.343 4.128 3.960 0.851 0.000 0.218 79 G C 1.529 176.510 174.900 0.135 0.000 1.146 79 G CA 0.959 46.135 45.100 0.126 0.000 0.769 79 G HN 0.132 8.422 8.290 -0.000 0.000 0.547 80 Q N 1.363 121.221 119.800 0.097 0.000 2.061 80 Q HA -0.137 4.713 4.340 0.851 0.000 0.204 80 Q C 2.854 178.971 176.000 0.195 0.000 0.984 80 Q CA 2.398 58.341 55.803 0.234 0.000 0.846 80 Q CB -0.379 28.587 28.738 0.381 0.000 0.902 80 Q HN 0.547 8.817 8.270 -0.000 0.000 0.421 81 S N -1.290 114.301 115.700 -0.180 0.000 2.383 81 S HA -0.124 4.857 4.470 0.851 0.000 0.227 81 S C 1.624 176.278 174.600 0.090 0.000 1.026 81 S CA 0.849 58.896 58.200 -0.254 0.000 0.981 81 S CB -0.733 61.919 63.200 -0.913 0.000 0.818 81 S HN 0.518 8.828 8.310 -0.000 0.000 0.472 82 W N 2.247 123.525 121.300 -0.036 0.000 2.381 82 W HA 0.245 5.418 4.660 0.855 0.000 0.301 82 W C 2.783 179.422 176.519 0.200 0.000 1.205 82 W CA 0.300 57.643 57.345 -0.003 0.000 1.285 82 W CB -1.630 27.789 29.460 -0.069 0.000 1.133 82 W HN 0.497 8.677 8.180 -0.000 0.000 0.521 83 G N 0.190 109.265 108.800 0.458 0.000 2.418 83 G HA2 -0.248 4.222 3.960 0.851 0.000 0.217 83 G HA3 -0.248 4.222 3.960 0.851 0.000 0.217 83 G C 1.624 176.825 174.900 0.501 0.000 1.158 83 G CA 1.077 46.495 45.100 0.530 0.000 0.771 83 G HN 0.113 8.403 8.290 -0.000 0.000 0.545 84 M N 0.473 120.279 119.600 0.343 0.000 2.117 84 M HA -0.068 4.923 4.480 0.851 0.000 0.262 84 M C 2.789 179.293 176.300 0.340 0.000 1.065 84 M CA 1.716 57.110 55.300 0.157 0.000 1.114 84 M CB -0.495 32.012 32.600 -0.155 0.000 1.361 84 M HN 0.141 8.431 8.290 -0.000 0.000 0.408 85 T N 0.690 115.476 114.554 0.388 0.000 2.708 85 T HA -0.121 4.740 4.350 0.851 0.000 0.266 85 T C 1.903 176.785 174.700 0.304 0.000 1.037 85 T CA 1.581 63.921 62.100 0.400 0.000 1.146 85 T CB -0.397 68.850 68.868 0.632 0.000 0.865 85 T HN 0.506 8.746 8.240 -0.000 0.000 0.435 86 A N 1.528 124.576 122.820 0.380 0.000 1.908 86 A HA 0.104 4.934 4.320 0.851 0.000 0.218 86 A C 2.662 180.396 177.584 0.250 0.000 1.181 86 A CA 1.958 54.205 52.037 0.350 0.000 0.627 86 A CB -1.185 18.112 19.000 0.495 0.000 0.818 86 A HN 0.513 8.663 8.150 -0.000 0.000 0.445 87 A N -0.818 122.192 122.820 0.316 0.000 1.883 87 A HA -0.058 4.773 4.320 0.851 0.000 0.217 87 A C 2.344 180.002 177.584 0.123 0.000 1.186 87 A CA 1.871 54.006 52.037 0.162 0.000 0.624 87 A CB -1.141 18.055 19.000 0.328 0.000 0.822 87 A HN 0.800 8.950 8.150 -0.000 0.000 0.444 88 V N -0.127 119.908 119.914 0.203 0.000 2.427 88 V HA -0.215 4.416 4.120 0.851 0.000 0.248 88 V C 2.374 178.300 176.094 -0.281 0.000 1.051 88 V CA 2.188 64.392 62.300 -0.161 0.000 1.048 88 V CB -0.501 31.039 31.823 -0.471 0.000 0.666 88 V HN 0.524 8.714 8.190 -0.000 0.000 0.456 89 M N -0.704 118.789 119.600 -0.177 0.000 2.213 89 M HA -0.024 4.966 4.480 0.851 0.000 0.263 89 M C 1.777 177.986 176.300 -0.152 0.000 1.062 89 M CA 1.651 56.850 55.300 -0.168 0.000 1.105 89 M CB -0.891 31.628 32.600 -0.135 0.000 1.385 89 M HN 0.295 8.585 8.290 -0.000 0.000 0.417 90 L N -0.747 120.358 121.223 -0.196 0.000 2.700 90 L HA 0.131 4.982 4.340 0.851 0.000 0.234 90 L C 0.177 176.904 176.870 -0.239 0.000 1.156 90 L CA -0.223 54.460 54.840 -0.261 0.000 0.946 90 L CB -0.274 41.511 42.059 -0.457 0.000 1.216 90 L HN 0.315 8.545 8.230 -0.000 0.000 0.493 91 N N 1.250 119.875 118.700 -0.124 0.000 2.780 91 N HA -0.142 5.109 4.740 0.851 0.000 0.248 91 N C -0.447 175.051 175.510 -0.019 0.000 1.102 91 N CA 0.635 53.719 53.050 0.056 0.000 0.697 91 N CB -0.470 38.017 38.487 -0.000 0.000 1.028 91 N HN 0.093 8.473 8.380 -0.000 0.000 0.554 92 K N 0.998 121.352 120.400 -0.076 0.000 2.319 92 K HA 0.152 4.983 4.320 0.851 0.000 0.237 92 K C 1.098 177.626 176.600 -0.119 0.000 1.113 92 K CA -0.268 55.893 56.287 -0.209 0.000 1.072 92 K CB 0.870 33.077 32.500 -0.487 0.000 1.734 92 K HN 0.479 8.729 8.250 -0.000 0.000 0.429 93 Q N 1.769 121.330 119.800 -0.399 0.000 2.083 93 Q HA -0.195 4.656 4.340 0.851 0.000 0.198 93 Q C 1.939 177.830 176.000 -0.182 0.000 0.969 93 Q CA 2.071 57.422 55.803 -0.753 0.000 0.838 93 Q CB 0.341 28.290 28.738 -1.315 0.000 0.900 93 Q HN 0.606 8.876 8.270 -0.000 0.000 0.436 94 E N 1.091 121.238 120.200 -0.089 0.000 2.051 94 E HA -0.258 4.602 4.350 0.851 0.000 0.192 94 E C 1.601 178.324 176.600 0.206 0.000 0.991 94 E CA 1.627 58.069 56.400 0.071 0.000 0.799 94 E CB -0.728 28.994 29.700 0.036 0.000 0.748 94 E HN 0.562 8.922 8.360 -0.000 0.000 0.449 95 E N -0.529 119.764 120.200 0.156 0.000 2.058 95 E HA -0.043 4.818 4.350 0.851 0.000 0.194 95 E C 1.780 178.625 176.600 0.408 0.000 0.997 95 E CA 1.226 57.756 56.400 0.216 0.000 0.801 95 E CB -0.477 29.183 29.700 -0.067 0.000 0.746 95 E HN 0.596 8.956 8.360 -0.000 0.000 0.450 96 F N 1.813 121.915 119.950 0.252 0.000 2.065 96 F HA -0.254 4.783 4.527 0.851 0.000 0.298 96 F C 1.622 177.698 175.800 0.460 0.000 1.112 96 F CA 1.875 60.093 58.000 0.364 0.000 1.212 96 F CB -0.192 39.045 39.000 0.395 0.000 0.975 96 F HN -0.056 8.244 8.300 -0.000 0.000 0.476 97 D N -0.038 120.826 120.400 0.773 0.000 2.144 97 D HA -0.163 4.988 4.640 0.851 0.000 0.199 97 D C 1.946 178.659 176.300 0.688 0.000 0.984 97 D CA 1.140 55.646 54.000 0.842 0.000 0.834 97 D CB -0.548 40.693 40.800 0.735 0.000 0.955 97 D HN 0.299 8.669 8.370 -0.000 0.000 0.465 98 N N 0.298 119.345 118.700 0.578 0.000 2.188 98 N HA -0.065 5.186 4.740 0.851 0.000 0.184 98 N C 2.039 177.902 175.510 0.588 0.000 1.018 98 N CA 0.413 53.825 53.050 0.604 0.000 0.858 98 N CB -0.311 38.525 38.487 0.581 0.000 0.989 98 N HN 0.256 8.636 8.380 -0.000 0.000 0.426 99 L N -0.653 120.895 121.223 0.542 0.000 2.056 99 L HA -0.090 4.761 4.340 0.851 0.000 0.207 99 L C 2.414 179.543 176.870 0.432 0.000 1.078 99 L CA 0.862 55.992 54.840 0.484 0.000 0.749 99 L CB -0.335 41.983 42.059 0.431 0.000 0.901 99 L HN 0.362 8.592 8.230 -0.000 0.000 0.433 100 W N 1.439 122.790 121.300 0.085 0.000 2.388 100 W HA -0.206 4.965 4.660 0.851 0.000 0.294 100 W C 2.638 179.150 176.519 -0.012 0.000 1.212 100 W CA 1.003 58.279 57.345 -0.114 0.000 1.271 100 W CB -0.028 29.222 29.460 -0.350 0.000 1.126 100 W HN 0.125 8.305 8.180 -0.000 0.000 0.535 101 R N 0.016 120.570 120.500 0.090 0.000 2.091 101 R HA -0.254 4.597 4.340 0.851 0.000 0.238 101 R C 2.363 178.648 176.300 -0.025 0.000 1.136 101 R CA 2.035 58.204 56.100 0.115 0.000 0.959 101 R CB -1.133 29.414 30.300 0.412 0.000 0.856 101 R HN 0.211 8.481 8.270 -0.000 0.000 0.437 102 F N 0.850 120.841 119.950 0.068 0.000 2.102 102 F HA -0.149 4.889 4.527 0.852 0.000 0.298 102 F C 2.148 177.949 175.800 0.001 0.000 1.105 102 F CA 1.587 59.677 58.000 0.151 0.000 1.239 102 F CB -0.451 38.744 39.000 0.326 0.000 0.991 102 F HN 0.099 8.399 8.300 -0.000 0.000 0.474 103 A N 0.120 123.050 122.820 0.184 0.000 1.858 103 A HA -0.253 4.577 4.320 0.851 0.000 0.216 103 A C 2.299 179.738 177.584 -0.243 0.000 1.190 103 A CA 1.982 54.063 52.037 0.074 0.000 0.617 103 A CB -0.919 18.072 19.000 -0.015 0.000 0.827 103 A HN 0.451 8.601 8.150 -0.000 0.000 0.443 104 K N -0.596 119.388 120.400 -0.693 0.000 2.097 104 K HA -0.045 4.786 4.320 0.851 0.000 0.206 104 K C 2.063 178.364 176.600 -0.498 0.000 1.049 104 K CA 1.129 57.008 56.287 -0.679 0.000 0.933 104 K CB -0.250 31.619 32.500 -1.051 0.000 0.717 104 K HN 0.402 8.652 8.250 -0.000 0.000 0.442 105 A N -0.326 122.132 122.820 -0.603 0.000 1.898 105 A HA -0.057 4.773 4.320 0.851 0.000 0.214 105 A C 1.313 178.438 177.584 -0.765 0.000 1.183 105 A CA 0.981 52.549 52.037 -0.781 0.000 0.622 105 A CB -0.271 17.976 19.000 -1.255 0.000 0.824 105 A HN 0.371 8.521 8.150 -0.000 0.000 0.444 106 Y N -1.283 118.746 120.300 -0.452 0.000 2.589 106 Y HA 0.189 5.249 4.550 0.851 0.000 0.271 106 Y C 2.383 178.065 175.900 -0.364 0.000 1.107 106 Y CA 0.382 58.177 58.100 -0.508 0.000 1.273 106 Y CB -0.183 37.703 38.460 -0.956 0.000 1.266 106 Y HN 0.279 8.559 8.280 -0.000 0.000 0.504 107 Q N 0.704 120.421 119.800 -0.139 0.000 2.163 107 Q HA -0.021 4.830 4.340 0.851 0.000 0.198 107 Q C 0.806 176.653 176.000 -0.255 0.000 0.954 107 Q CA 0.405 56.193 55.803 -0.025 0.000 0.851 107 Q CB 0.280 29.198 28.738 0.300 0.000 0.928 107 Q HN 0.119 8.389 8.270 -0.000 0.000 0.459 108 K N 2.149 122.205 120.400 -0.573 0.000 2.447 108 K HA 0.011 4.841 4.320 0.851 0.000 0.281 108 K C -0.889 175.454 176.600 -0.427 0.000 1.031 108 K CA 0.074 55.796 56.287 -0.942 0.000 1.019 108 K CB 0.322 32.309 32.500 -0.854 0.000 0.918 108 K HN 0.099 8.349 8.250 -0.000 0.000 0.476 109 N N 5.385 123.891 118.700 -0.323 0.000 2.530 109 N HA 0.156 5.406 4.740 0.851 0.000 0.273 109 N C -2.454 173.004 175.510 -0.086 0.000 1.173 109 N CA -1.388 51.590 53.050 -0.120 0.000 0.967 109 N CB 0.763 39.195 38.487 -0.091 0.000 1.109 109 N HN 0.438 8.818 8.380 -0.000 0.000 0.453 110 P HA -0.038 4.382 4.420 -0.000 0.000 0.267 110 P C -0.239 177.074 177.300 0.022 0.000 1.200 110 P CA 0.065 63.160 63.100 -0.008 0.000 0.772 110 P CB 0.690 32.393 31.700 0.004 0.000 0.855 111 D N 1.182 121.584 120.400 0.003 0.000 2.310 111 D HA -0.110 5.041 4.640 0.851 0.000 0.212 111 D C 0.983 177.304 176.300 0.035 0.000 0.965 111 D CA 1.216 55.227 54.000 0.018 0.000 0.879 111 D CB -0.268 40.538 40.800 0.010 0.000 0.921 111 D HN 0.504 8.874 8.370 -0.000 0.000 0.510 112 N N -0.323 118.398 118.700 0.034 0.000 2.273 112 N HA -0.082 5.169 4.740 0.851 0.000 0.231 112 N C -0.023 175.517 175.510 0.051 0.000 1.134 112 N CA -0.365 52.704 53.050 0.032 0.000 0.856 112 N CB -0.911 37.578 38.487 0.005 0.000 1.068 112 N HN 0.140 8.520 8.380 -0.000 0.000 0.510 113 H N 1.885 120.948 119.070 -0.012 0.000 3.038 113 H HA 0.043 5.110 4.556 0.852 0.000 0.338 113 H C -1.129 174.203 175.328 0.006 0.000 1.041 113 H CA -0.523 55.523 56.048 -0.005 0.000 1.394 113 H CB 1.160 30.922 29.762 -0.000 0.000 1.357 113 H HN 0.007 8.287 8.280 -0.000 0.000 0.600 114 P HA -0.129 4.291 4.420 -0.000 0.000 0.222 114 P C -0.047 177.366 177.300 0.189 0.000 1.147 114 P CA 1.058 64.190 63.100 0.053 0.000 0.790 114 P CB 0.211 31.884 31.700 -0.044 0.000 0.780 115 D N -0.268 120.399 120.400 0.445 0.000 2.380 115 D HA 0.302 5.453 4.640 0.851 0.000 0.230 115 D C 1.202 177.589 176.300 0.145 0.000 1.154 115 D CA -0.401 53.754 54.000 0.258 0.000 0.859 115 D CB 1.080 42.025 40.800 0.242 0.000 1.045 115 D HN -0.124 8.246 8.370 -0.000 0.000 0.495 116 A N 4.927 127.802 122.820 0.092 0.000 1.978 116 A HA -0.201 4.630 4.320 0.851 0.000 0.220 116 A C 1.906 179.489 177.584 -0.001 0.000 1.170 116 A CA 1.265 53.329 52.037 0.044 0.000 0.636 116 A CB -0.254 18.764 19.000 0.029 0.000 0.810 116 A HN 0.632 8.782 8.150 -0.000 0.000 0.448 117 K N -0.579 119.810 120.400 -0.019 0.000 2.362 117 K HA -0.060 4.770 4.320 0.851 0.000 0.200 117 K C 1.485 178.018 176.600 -0.111 0.000 1.046 117 K CA 1.208 57.427 56.287 -0.113 0.000 0.952 117 K CB -0.045 32.295 32.500 -0.266 0.000 0.753 117 K HN 0.430 8.680 8.250 -0.000 0.000 0.466 118 K N 0.593 120.929 120.400 -0.107 0.000 2.361 118 K HA 0.049 4.880 4.320 0.851 0.000 0.194 118 K C 0.021 176.537 176.600 -0.139 0.000 1.032 118 K CA -0.012 56.164 56.287 -0.185 0.000 1.048 118 K CB 0.486 32.681 32.500 -0.508 0.000 0.842 118 K HN 0.141 8.391 8.250 -0.000 0.000 0.526 119 Q N 0.380 120.144 119.800 -0.059 0.000 2.244 119 Q HA 0.028 4.878 4.340 0.851 0.000 0.278 119 Q C 0.802 176.801 176.000 -0.002 0.000 1.093 119 Q CA 0.742 56.544 55.803 -0.003 0.000 0.916 119 Q CB 0.467 29.222 28.738 0.028 0.000 1.159 119 Q HN 0.480 8.750 8.270 -0.000 0.000 0.384 120 G N 1.388 110.177 108.800 -0.019 0.000 2.189 120 G HA2 -0.313 4.158 3.960 0.851 0.000 0.267 120 G HA3 -0.313 4.158 3.960 0.851 0.000 0.267 120 G C 0.338 175.265 174.900 0.045 0.000 0.975 120 G CA 0.349 45.446 45.100 -0.004 0.000 0.644 120 G HN 0.717 9.007 8.290 -0.000 0.000 0.537 121 V N -2.578 117.357 119.914 0.034 0.000 3.214 121 V HA 0.781 5.412 4.120 0.851 0.000 0.306 121 V C 0.261 176.391 176.094 0.059 0.000 1.078 121 V CA -1.528 60.866 62.300 0.157 0.000 1.077 121 V CB 1.050 32.939 31.823 0.110 0.000 1.121 121 V HN 0.301 8.491 8.190 -0.000 0.000 0.468 122 Y N 1.561 121.941 120.300 0.133 0.000 2.342 122 Y HA 0.702 5.763 4.550 0.851 0.000 0.338 122 Y C 0.816 176.814 175.900 0.163 0.000 0.965 122 Y CA -0.202 57.999 58.100 0.168 0.000 1.159 122 Y CB 1.017 39.673 38.460 0.327 0.000 1.157 122 Y HN 1.037 9.317 8.280 -0.000 0.000 0.486 123 A N 5.093 127.996 122.820 0.137 0.000 2.545 123 A HA -0.045 4.786 4.320 0.851 0.000 0.253 123 A C 1.149 178.838 177.584 0.175 0.000 1.074 123 A CA -0.302 51.806 52.037 0.119 0.000 0.760 123 A CB -0.120 18.882 19.000 0.003 0.000 1.005 123 A HN 1.103 9.253 8.150 -0.000 0.000 0.506 124 W N 2.916 124.239 121.300 0.039 0.000 2.467 124 W HA 0.102 5.273 4.660 0.851 0.000 0.275 124 W C 0.101 176.614 176.519 -0.011 0.000 1.239 124 W CA 0.768 58.128 57.345 0.024 0.000 1.266 124 W CB -0.027 29.436 29.460 0.005 0.000 1.112 124 W HN 0.565 8.745 8.180 -0.000 0.000 0.576 125 K N 1.382 121.351 120.400 -0.718 0.000 2.545 125 K HA 0.372 5.202 4.320 0.851 0.000 0.252 125 K C -1.664 174.601 176.600 -0.558 0.000 0.948 125 K CA -0.581 55.178 56.287 -0.880 0.000 0.827 125 K CB 1.346 32.928 32.500 -1.530 0.000 1.128 125 K HN -0.164 8.086 8.250 -0.000 0.000 0.429 126 L N 2.861 123.817 121.223 -0.445 0.000 2.322 126 L HA 0.599 5.450 4.340 0.851 0.000 0.269 126 L C -0.365 176.173 176.870 -0.554 0.000 1.012 126 L CA -0.437 54.118 54.840 -0.474 0.000 0.815 126 L CB 1.743 43.615 42.059 -0.312 0.000 1.295 126 L HN 0.587 8.817 8.230 -0.000 0.000 0.438 127 K N 0.728 120.689 120.400 -0.731 0.000 2.495 127 K HA 0.637 5.468 4.320 0.851 0.000 0.268 127 K C -1.575 174.781 176.600 -0.406 0.000 1.008 127 K CA -0.877 55.080 56.287 -0.551 0.000 0.882 127 K CB 2.260 34.485 32.500 -0.458 0.000 1.443 127 K HN 0.330 8.580 8.250 -0.000 0.000 0.447 128 L N 2.798 123.907 121.223 -0.190 0.000 2.326 128 L HA 0.241 5.091 4.340 0.851 0.000 0.278 128 L C 0.477 177.453 176.870 0.176 0.000 1.092 128 L CA -0.833 53.998 54.840 -0.015 0.000 0.810 128 L CB 0.450 42.475 42.059 -0.056 0.000 1.153 128 L HN 0.728 8.958 8.230 -0.000 0.000 0.439 129 N N 2.062 120.922 118.700 0.267 0.000 2.322 129 N HA 0.065 5.316 4.740 0.851 0.000 0.270 129 N C 0.790 176.330 175.510 0.048 0.000 1.286 129 N CA 0.223 53.355 53.050 0.136 0.000 0.948 129 N CB 0.225 38.676 38.487 -0.060 0.000 1.164 129 N HN 0.552 8.932 8.380 -0.000 0.000 0.551 130 Q N -1.005 118.796 119.800 0.002 0.000 2.364 130 Q HA -0.057 4.794 4.340 0.851 0.000 0.207 130 Q C 0.818 176.816 176.000 -0.003 0.000 0.970 130 Q CA 1.486 57.285 55.803 -0.007 0.000 0.888 130 Q CB -0.950 27.776 28.738 -0.020 0.000 0.951 130 Q HN 0.690 8.960 8.270 -0.000 0.000 0.469 131 N N -1.039 117.680 118.700 0.032 0.000 2.280 131 N HA 0.263 5.514 4.740 0.851 0.000 0.192 131 N C 1.065 176.486 175.510 -0.148 0.000 1.109 131 N CA 0.854 53.922 53.050 0.030 0.000 0.855 131 N CB 1.234 39.842 38.487 0.201 0.000 0.974 131 N HN 0.661 9.041 8.380 -0.000 0.000 0.482 132 G N 0.393 109.116 108.800 -0.129 0.000 2.157 132 G HA2 -0.251 4.220 3.960 0.851 0.000 0.239 132 G HA3 -0.251 4.220 3.960 0.851 0.000 0.239 132 G C -0.268 174.486 174.900 -0.244 0.000 0.982 132 G CA -0.324 44.639 45.100 -0.228 0.000 0.650 132 G HN 0.227 8.517 8.290 -0.000 0.000 0.527 133 F N -0.199 119.802 119.950 0.085 0.000 2.422 133 F HA 0.660 5.698 4.527 0.851 0.000 0.333 133 F C 0.862 176.707 175.800 0.075 0.000 1.095 133 F CA -0.886 57.189 58.000 0.125 0.000 1.038 133 F CB 1.824 40.859 39.000 0.057 0.000 1.156 133 F HN 0.019 8.319 8.300 -0.000 0.000 0.483 134 V N 4.764 124.743 119.914 0.109 0.000 2.715 134 V HA 0.301 4.932 4.120 0.851 0.000 0.299 134 V C -1.058 175.037 176.094 0.002 0.000 1.054 134 V CA -0.029 62.150 62.300 -0.202 0.000 1.077 134 V CB 0.649 31.999 31.823 -0.788 0.000 0.972 134 V HN 0.688 8.878 8.190 -0.000 0.000 0.484 135 Y N 3.184 123.377 120.300 -0.178 0.000 2.609 135 Y HA 0.627 5.689 4.550 0.852 0.000 0.336 135 Y C -0.877 174.940 175.900 -0.138 0.000 1.129 135 Y CA -1.828 56.196 58.100 -0.128 0.000 1.040 135 Y CB 1.156 39.565 38.460 -0.084 0.000 1.310 135 Y HN 0.496 8.776 8.280 -0.000 0.000 0.460 136 K N 1.995 122.320 120.400 -0.125 0.000 2.276 136 K HA 0.410 5.241 4.320 0.851 0.000 0.285 136 K C 0.103 176.598 176.600 -0.176 0.000 1.062 136 K CA -0.423 55.744 56.287 -0.201 0.000 0.918 136 K CB 2.026 34.485 32.500 -0.069 0.000 1.055 136 K HN 0.662 8.912 8.250 -0.000 0.000 0.477 137 V N 1.095 120.798 119.914 -0.352 0.000 2.379 137 V HA -0.093 4.538 4.120 0.851 0.000 0.243 137 V C 0.477 176.490 176.094 -0.134 0.000 1.035 137 V CA 1.254 63.421 62.300 -0.222 0.000 1.035 137 V CB -0.097 31.517 31.823 -0.349 0.000 0.673 137 V HN 0.797 8.987 8.190 -0.000 0.000 0.457 138 D N -0.875 119.399 120.400 -0.210 0.000 2.686 138 D HA 0.230 5.381 4.640 0.851 0.000 0.249 138 D C 0.480 176.767 176.300 -0.022 0.000 1.260 138 D CA -0.286 53.669 54.000 -0.076 0.000 0.910 138 D CB 1.972 42.745 40.800 -0.044 0.000 1.323 138 D HN 0.223 8.593 8.370 -0.000 0.000 0.561 139 E N 1.432 121.662 120.200 0.050 0.000 2.427 139 E HA 0.114 4.975 4.350 0.851 0.000 0.196 139 E C 1.140 177.810 176.600 0.117 0.000 1.028 139 E CA -0.031 56.403 56.400 0.058 0.000 0.864 139 E CB 0.344 30.071 29.700 0.045 0.000 0.813 139 E HN 0.468 8.828 8.360 -0.000 0.000 0.514 140 G N 3.073 111.996 108.800 0.205 0.000 2.544 140 G HA2 0.148 4.618 3.960 0.851 0.000 0.242 140 G HA3 0.148 4.618 3.960 0.851 0.000 0.242 140 G C -2.325 172.740 174.900 0.275 0.000 1.247 140 G CA -0.910 44.330 45.100 0.233 0.000 0.840 140 G HN -0.046 8.244 8.290 -0.000 0.000 0.578 141 P HA 0.429 4.849 4.420 -0.000 0.000 0.281 141 P C -0.893 176.399 177.300 -0.013 0.000 1.264 141 P CA -0.460 62.721 63.100 0.134 0.000 0.824 141 P CB 1.783 33.539 31.700 0.093 0.000 1.092 142 A N 2.042 124.861 122.820 -0.001 0.000 2.508 142 A HA 0.489 5.320 4.320 0.851 0.000 0.336 142 A C -1.890 175.559 177.584 -0.224 0.000 1.360 142 A CA -1.602 50.338 52.037 -0.162 0.000 0.841 142 A CB 0.232 19.154 19.000 -0.131 0.000 1.136 142 A HN 0.245 8.395 8.150 -0.000 0.000 0.489 143 P HA -0.173 4.247 4.420 -0.000 0.000 0.221 143 P C 0.964 178.105 177.300 -0.266 0.000 1.145 143 P CA 1.488 64.481 63.100 -0.178 0.000 0.795 143 P CB 0.223 31.907 31.700 -0.026 0.000 0.775 144 D N -1.057 118.937 120.400 -0.676 0.000 2.310 144 D HA -0.095 5.056 4.640 0.851 0.000 0.212 144 D C 2.027 178.314 176.300 -0.021 0.000 0.965 144 D CA 1.329 55.178 54.000 -0.253 0.000 0.879 144 D CB -1.345 39.333 40.800 -0.203 0.000 0.921 144 D HN 0.117 8.487 8.370 -0.000 0.000 0.510 145 G N 0.869 109.547 108.800 -0.203 0.000 2.433 145 G HA2 -0.304 4.167 3.960 0.851 0.000 0.216 145 G HA3 -0.304 4.167 3.960 0.851 0.000 0.216 145 G C 1.594 176.309 174.900 -0.309 0.000 1.186 145 G CA 0.796 45.677 45.100 -0.365 0.000 0.779 145 G HN 0.267 8.557 8.290 -0.000 0.000 0.543 146 E N 0.699 120.893 120.200 -0.010 0.000 2.118 146 E HA -0.063 4.798 4.350 0.851 0.000 0.195 146 E C 2.441 179.143 176.600 0.170 0.000 0.992 146 E CA 1.220 57.719 56.400 0.165 0.000 0.804 146 E CB -0.155 29.658 29.700 0.188 0.000 0.741 146 E HN 0.622 8.982 8.360 -0.000 0.000 0.458 147 E N -0.470 119.851 120.200 0.201 0.000 2.038 147 E HA -0.219 4.642 4.350 0.851 0.000 0.195 147 E C 1.902 178.712 176.600 0.349 0.000 1.000 147 E CA 1.236 57.835 56.400 0.332 0.000 0.803 147 E CB -0.272 29.645 29.700 0.362 0.000 0.750 147 E HN 0.373 8.733 8.360 -0.000 0.000 0.448 148 Y N -0.410 120.034 120.300 0.240 0.000 2.242 148 Y HA -0.189 4.871 4.550 0.850 0.000 0.291 148 Y C 2.066 178.073 175.900 0.178 0.000 1.137 148 Y CA 0.971 59.232 58.100 0.268 0.000 1.181 148 Y CB -0.159 38.465 38.460 0.274 0.000 0.989 148 Y HN 0.018 8.298 8.280 -0.000 0.000 0.527 149 F N -0.619 119.433 119.950 0.171 0.000 2.095 149 F HA -0.254 4.785 4.527 0.853 0.000 0.298 149 F C 2.480 178.186 175.800 -0.155 0.000 1.104 149 F CA 1.030 58.993 58.000 -0.062 0.000 1.232 149 F CB -1.327 37.547 39.000 -0.209 0.000 0.987 149 F HN 0.005 8.305 8.300 -0.000 0.000 0.475 150 A N -0.325 122.538 122.820 0.071 0.000 1.877 150 A HA -0.234 4.596 4.320 0.851 0.000 0.216 150 A C 2.166 179.717 177.584 -0.054 0.000 1.186 150 A CA 1.565 53.514 52.037 -0.147 0.000 0.620 150 A CB -1.477 17.280 19.000 -0.404 0.000 0.822 150 A HN 0.354 8.504 8.150 -0.000 0.000 0.443 151 F N 1.067 121.006 119.950 -0.017 0.000 2.069 151 F HA -0.146 4.893 4.527 0.853 0.000 0.298 151 F C 2.547 178.258 175.800 -0.149 0.000 1.113 151 F CA 1.511 59.434 58.000 -0.128 0.000 1.214 151 F CB -0.601 37.946 39.000 -0.755 0.000 0.978 151 F HN 0.246 8.546 8.300 -0.000 0.000 0.474 152 A N 0.465 123.244 122.820 -0.068 0.000 1.902 152 A HA -0.132 4.699 4.320 0.851 0.000 0.217 152 A C 2.301 179.823 177.584 -0.104 0.000 1.181 152 A CA 1.824 53.822 52.037 -0.065 0.000 0.623 152 A CB -1.215 17.931 19.000 0.243 0.000 0.818 152 A HN 0.515 8.665 8.150 -0.000 0.000 0.443 153 L N -0.743 120.417 121.223 -0.105 0.000 2.056 153 L HA -0.159 4.691 4.340 0.851 0.000 0.207 153 L C 2.542 179.276 176.870 -0.227 0.000 1.078 153 L CA 0.954 55.690 54.840 -0.175 0.000 0.749 153 L CB -0.476 41.395 42.059 -0.314 0.000 0.901 153 L HN 0.366 8.596 8.230 -0.000 0.000 0.433 154 L N -0.448 120.651 121.223 -0.208 0.000 2.046 154 L HA -0.226 4.625 4.340 0.851 0.000 0.208 154 L C 2.112 178.871 176.870 -0.185 0.000 1.077 154 L CA 1.518 56.281 54.840 -0.129 0.000 0.747 154 L CB -0.551 41.467 42.059 -0.068 0.000 0.896 154 L HN 0.337 8.567 8.230 -0.000 0.000 0.432 155 N N -0.242 118.234 118.700 -0.374 0.000 2.188 155 N HA -0.134 5.117 4.740 0.851 0.000 0.184 155 N C 1.899 176.924 175.510 -0.807 0.000 1.018 155 N CA 1.214 53.952 53.050 -0.520 0.000 0.858 155 N CB -0.178 37.881 38.487 -0.714 0.000 0.989 155 N HN 0.300 8.680 8.380 -0.000 0.000 0.426 156 A N 0.111 122.326 122.820 -1.008 0.000 1.902 156 A HA -0.179 4.652 4.320 0.851 0.000 0.217 156 A C 2.255 179.257 177.584 -0.970 0.000 1.181 156 A CA 1.871 52.950 52.037 -1.597 0.000 0.623 156 A CB -1.100 16.673 19.000 -2.045 0.000 0.818 156 A HN 0.306 8.456 8.150 -0.000 0.000 0.443 157 S N -0.224 115.215 115.700 -0.435 0.000 2.365 157 S HA -0.132 4.848 4.470 0.851 0.000 0.225 157 S C 2.179 176.683 174.600 -0.160 0.000 1.039 157 S CA 1.912 60.089 58.200 -0.039 0.000 1.033 157 S CB -0.539 62.746 63.200 0.141 0.000 0.887 157 S HN 0.894 9.204 8.310 -0.000 0.000 0.447 158 A N 1.495 124.162 122.820 -0.255 0.000 1.933 158 A HA -0.029 4.802 4.320 0.851 0.000 0.218 158 A C 2.313 179.716 177.584 -0.302 0.000 1.175 158 A CA 1.315 53.217 52.037 -0.225 0.000 0.628 158 A CB -0.500 18.422 19.000 -0.130 0.000 0.814 158 A HN 0.647 8.797 8.150 -0.000 0.000 0.444 159 R N -2.128 118.017 120.500 -0.591 0.000 2.100 159 R HA -0.051 4.800 4.340 0.851 0.000 0.220 159 R C 1.385 177.478 176.300 -0.346 0.000 1.091 159 R CA 1.172 56.855 56.100 -0.694 0.000 0.986 159 R CB -0.090 29.413 30.300 -1.328 0.000 0.888 159 R HN 0.732 9.002 8.270 -0.000 0.000 0.444 160 W N -0.014 121.160 121.300 -0.211 0.000 2.868 160 W HA 0.394 5.564 4.660 0.851 0.000 0.320 160 W C 0.717 177.246 176.519 0.017 0.000 1.076 160 W CA 0.388 57.673 57.345 -0.100 0.000 1.576 160 W CB -0.252 29.141 29.460 -0.112 0.000 1.030 160 W HN 0.192 8.372 8.180 -0.000 0.000 0.558 161 G N 2.021 110.940 108.800 0.198 0.000 2.828 161 G HA2 -0.273 4.198 3.960 0.851 0.000 0.463 161 G HA3 -0.273 4.198 3.960 0.851 0.000 0.463 161 G C 0.178 175.246 174.900 0.281 0.000 1.394 161 G CA -0.017 45.185 45.100 0.170 0.000 0.862 161 G HN 0.133 8.423 8.290 -0.000 0.000 0.540 162 N N 0.114 118.913 118.700 0.165 0.000 2.291 162 N HA 0.191 5.441 4.740 0.851 0.000 0.244 162 N C 1.424 176.968 175.510 0.056 0.000 1.216 162 N CA 0.689 53.816 53.050 0.129 0.000 0.879 162 N CB 0.866 39.438 38.487 0.141 0.000 1.167 162 N HN 0.888 9.268 8.380 -0.000 0.000 0.515 163 S N -1.734 113.998 115.700 0.054 0.000 2.554 163 S HA 0.304 5.285 4.470 0.851 0.000 0.226 163 S C 1.086 175.685 174.600 -0.001 0.000 0.980 163 S CA -0.519 57.694 58.200 0.022 0.000 0.939 163 S CB 0.736 63.952 63.200 0.025 0.000 0.832 163 S HN 0.175 8.485 8.310 -0.000 0.000 0.486 164 G N 1.701 110.495 108.800 -0.010 0.000 2.666 164 G HA2 0.302 4.773 3.960 0.851 0.000 0.207 164 G HA3 0.302 4.773 3.960 0.851 0.000 0.207 164 G C 0.536 175.364 174.900 -0.121 0.000 1.481 164 G CA -0.059 45.017 45.100 -0.041 0.000 1.071 164 G HN 0.334 8.624 8.290 -0.000 0.000 0.572 165 E N -1.237 118.851 120.200 -0.187 0.000 2.097 165 E HA -0.102 4.758 4.350 0.851 0.000 0.196 165 E C -0.190 176.055 176.600 -0.592 0.000 1.000 165 E CA 0.765 56.915 56.400 -0.417 0.000 0.804 165 E CB -0.088 29.284 29.700 -0.548 0.000 0.740 165 E HN 0.189 8.549 8.360 -0.000 0.000 0.454 166 F N 0.223 120.068 119.950 -0.174 0.000 2.508 166 F HA 0.289 5.328 4.527 0.852 0.000 0.325 166 F C 0.307 175.898 175.800 -0.349 0.000 1.090 166 F CA -1.191 56.669 58.000 -0.234 0.000 0.945 166 F CB 1.230 40.074 39.000 -0.259 0.000 1.156 166 F HN -0.194 8.106 8.300 -0.000 0.000 0.463 167 N N 2.610 121.365 118.700 0.090 0.000 2.807 167 N HA 0.022 5.273 4.740 0.851 0.000 0.259 167 N C 0.605 176.215 175.510 0.168 0.000 1.149 167 N CA 0.136 53.243 53.050 0.096 0.000 1.042 167 N CB -0.109 38.458 38.487 0.132 0.000 1.367 167 N HN 0.494 8.874 8.380 -0.000 0.000 0.516 168 Y N 1.531 121.980 120.300 0.249 0.000 2.151 168 Y HA -0.267 4.794 4.550 0.852 0.000 0.284 168 Y C 1.905 177.837 175.900 0.054 0.000 1.166 168 Y CA 1.437 59.608 58.100 0.119 0.000 1.163 168 Y CB -0.749 37.739 38.460 0.046 0.000 0.974 168 Y HN 0.544 8.824 8.280 -0.000 0.000 0.511 169 Y N 0.936 121.336 120.300 0.166 0.000 2.145 169 Y HA -0.281 4.780 4.550 0.851 0.000 0.286 169 Y C 2.557 178.501 175.900 0.072 0.000 1.145 169 Y CA 1.887 60.036 58.100 0.082 0.000 1.148 169 Y CB -1.078 37.429 38.460 0.079 0.000 0.981 169 Y HN 0.211 8.491 8.280 -0.000 0.000 0.507 170 N N 0.008 118.788 118.700 0.132 0.000 2.120 170 N HA -0.203 5.048 4.740 0.851 0.000 0.188 170 N C 1.534 177.053 175.510 0.015 0.000 1.024 170 N CA 1.782 54.868 53.050 0.059 0.000 0.852 170 N CB -0.965 37.602 38.487 0.134 0.000 1.003 170 N HN 0.445 8.825 8.380 -0.000 0.000 0.424 171 D N -0.026 120.423 120.400 0.082 0.000 2.144 171 D HA 0.004 5.155 4.640 0.851 0.000 0.199 171 D C 2.414 178.677 176.300 -0.063 0.000 0.984 171 D CA 1.409 55.474 54.000 0.109 0.000 0.834 171 D CB -0.458 40.493 40.800 0.251 0.000 0.955 171 D HN 0.615 8.985 8.370 -0.000 0.000 0.465 172 A N 0.944 123.656 122.820 -0.180 0.000 1.898 172 A HA -0.127 4.704 4.320 0.851 0.000 0.216 172 A C 2.143 179.543 177.584 -0.307 0.000 1.181 172 A CA 0.794 52.660 52.037 -0.284 0.000 0.620 172 A CB -0.421 18.380 19.000 -0.331 0.000 0.819 172 A HN 0.109 8.259 8.150 -0.000 0.000 0.442 173 I N 0.260 120.619 120.570 -0.351 0.000 2.315 173 I HA -0.159 4.521 4.170 0.851 0.000 0.248 173 I C 2.458 178.504 176.117 -0.118 0.000 1.117 173 I CA 1.850 62.986 61.300 -0.273 0.000 1.404 173 I CB -2.013 35.811 38.000 -0.292 0.000 1.071 173 I HN 0.232 8.442 8.210 -0.000 0.000 0.419 174 T N 0.989 115.506 114.554 -0.062 0.000 2.684 174 T HA -0.241 4.619 4.350 0.851 0.000 0.267 174 T C 1.900 176.617 174.700 0.029 0.000 1.036 174 T CA 1.718 63.826 62.100 0.014 0.000 1.148 174 T CB -0.252 68.657 68.868 0.068 0.000 0.863 174 T HN 0.166 8.406 8.240 -0.000 0.000 0.436 175 M N 0.837 120.435 119.600 -0.004 0.000 2.117 175 M HA 0.053 5.044 4.480 0.851 0.000 0.262 175 M C 1.894 178.183 176.300 -0.019 0.000 1.065 175 M CA 1.470 56.773 55.300 0.005 0.000 1.114 175 M CB -0.665 31.888 32.600 -0.078 0.000 1.361 175 M HN 0.180 8.470 8.290 -0.000 0.000 0.408 176 L N -0.450 120.702 121.223 -0.119 0.000 2.046 176 L HA -0.241 4.610 4.340 0.851 0.000 0.208 176 L C 2.247 179.213 176.870 0.160 0.000 1.077 176 L CA 1.670 56.478 54.840 -0.053 0.000 0.747 176 L CB -0.983 40.955 42.059 -0.202 0.000 0.896 176 L HN 0.417 8.647 8.230 -0.000 0.000 0.432 177 N N -0.560 118.183 118.700 0.071 0.000 2.166 177 N HA -0.160 5.091 4.740 0.851 0.000 0.186 177 N C 1.684 177.230 175.510 0.059 0.000 1.019 177 N CA 1.699 54.781 53.050 0.053 0.000 0.856 177 N CB 0.025 38.524 38.487 0.019 0.000 0.993 177 N HN 0.112 8.492 8.380 -0.000 0.000 0.426 178 T N 0.539 115.142 114.554 0.083 0.000 2.746 178 T HA -0.071 4.790 4.350 0.851 0.000 0.267 178 T C 1.859 176.630 174.700 0.118 0.000 1.039 178 T CA 1.237 63.397 62.100 0.100 0.000 1.142 178 T CB -0.259 68.696 68.868 0.145 0.000 0.866 178 T HN 0.221 8.461 8.240 -0.000 0.000 0.444 179 I N 0.842 121.513 120.570 0.167 0.000 2.127 179 I HA -0.218 4.463 4.170 0.851 0.000 0.241 179 I C 2.621 178.855 176.117 0.194 0.000 1.075 179 I CA 1.469 62.906 61.300 0.228 0.000 1.334 179 I CB -0.345 37.869 38.000 0.357 0.000 1.040 179 I HN 0.191 8.401 8.210 -0.000 0.000 0.405 180 K N 0.880 121.379 120.400 0.167 0.000 2.063 180 K HA -0.204 4.627 4.320 0.851 0.000 0.208 180 K C 1.812 178.386 176.600 -0.043 0.000 1.048 180 K CA 1.820 58.093 56.287 -0.024 0.000 0.928 180 K CB -0.006 32.317 32.500 -0.295 0.000 0.713 180 K HN 0.274 8.524 8.250 -0.000 0.000 0.442 181 N N -0.005 118.681 118.700 -0.024 0.000 2.416 181 N HA -0.036 5.215 4.740 0.851 0.000 0.177 181 N C 0.993 176.493 175.510 -0.016 0.000 1.036 181 N CA 0.791 53.821 53.050 -0.032 0.000 0.901 181 N CB 0.376 38.847 38.487 -0.026 0.000 0.976 181 N HN 0.162 8.542 8.380 -0.000 0.000 0.444 182 K N -0.145 120.259 120.400 0.006 0.000 2.435 182 K HA 0.332 5.162 4.320 0.851 0.000 0.199 182 K C 0.959 177.552 176.600 -0.012 0.000 1.153 182 K CA 0.188 56.467 56.287 -0.012 0.000 0.974 182 K CB 1.077 33.578 32.500 0.002 0.000 0.997 182 K HN 0.100 8.350 8.250 -0.000 0.000 0.547 183 L N 0.573 121.818 121.223 0.037 0.000 3.122 183 L HA 0.360 5.211 4.340 0.851 0.000 0.274 183 L C -0.182 176.735 176.870 0.077 0.000 1.222 183 L CA -0.105 54.769 54.840 0.057 0.000 1.028 183 L CB 0.373 42.492 42.059 0.100 0.000 1.386 183 L HN -0.085 8.145 8.230 -0.000 0.000 0.578 184 M N 0.666 120.300 119.600 0.056 0.000 2.530 184 M HA 0.401 5.391 4.480 0.851 0.000 0.307 184 M C -0.876 175.437 176.300 0.023 0.000 1.161 184 M CA -0.067 55.265 55.300 0.054 0.000 0.903 184 M CB 2.676 35.322 32.600 0.076 0.000 1.711 184 M HN -0.026 8.264 8.290 -0.000 0.000 0.451 185 E N 2.407 122.617 120.200 0.016 0.000 2.241 185 E HA 0.313 5.174 4.350 0.851 0.000 0.263 185 E C -0.673 175.922 176.600 -0.007 0.000 0.882 185 E CA -0.254 56.148 56.400 0.003 0.000 0.769 185 E CB 0.757 30.458 29.700 0.002 0.000 1.185 185 E HN 0.707 9.067 8.360 -0.000 0.000 0.415 186 N N 4.282 122.974 118.700 -0.012 0.000 2.727 186 N HA -0.255 4.996 4.740 0.851 0.000 0.249 186 N C -0.560 174.911 175.510 -0.065 0.000 1.048 186 N CA 1.557 54.589 53.050 -0.030 0.000 0.714 186 N CB -1.151 37.319 38.487 -0.028 0.000 0.959 186 N HN 0.847 9.227 8.380 -0.000 0.000 0.544 187 Q N -2.883 116.865 119.800 -0.086 0.000 2.489 187 Q HA -0.189 4.662 4.340 0.851 0.000 0.259 187 Q C -0.533 175.366 176.000 -0.168 0.000 0.934 187 Q CA 1.106 56.779 55.803 -0.216 0.000 1.131 187 Q CB -1.117 27.413 28.738 -0.347 0.000 1.472 187 Q HN 0.666 8.936 8.270 -0.000 0.000 0.560 188 I N 0.642 121.173 120.570 -0.065 0.000 2.465 188 I HA 0.327 5.008 4.170 0.851 0.000 0.291 188 I C 0.279 176.407 176.117 0.019 0.000 1.014 188 I CA -1.293 60.008 61.300 0.001 0.000 1.093 188 I CB 1.360 39.401 38.000 0.068 0.000 1.267 188 I HN 0.024 8.234 8.210 -0.000 0.000 0.431 189 I N 6.763 127.327 120.570 -0.010 0.000 2.752 189 I HA -0.015 4.666 4.170 0.851 0.000 0.289 189 I C 0.615 176.819 176.117 0.145 0.000 1.197 189 I CA 0.609 61.956 61.300 0.078 0.000 1.432 189 I CB 0.069 38.125 38.000 0.093 0.000 1.359 189 I HN 0.496 8.706 8.210 -0.000 0.000 0.571 190 R N 5.676 126.266 120.500 0.149 0.000 2.490 190 R HA 0.111 4.962 4.340 0.851 0.000 0.278 190 R C 0.598 177.054 176.300 0.260 0.000 1.069 190 R CA -0.244 55.943 56.100 0.146 0.000 1.080 190 R CB 0.470 30.810 30.300 0.067 0.000 1.030 190 R HN 0.710 8.980 8.270 -0.000 0.000 0.491 191 F N 0.421 120.401 119.950 0.050 0.000 2.206 191 F HA 0.016 5.054 4.527 0.851 0.000 0.298 191 F C 0.685 176.506 175.800 0.035 0.000 1.090 191 F CA 0.945 58.972 58.000 0.045 0.000 1.323 191 F CB 0.417 39.330 39.000 -0.146 0.000 1.028 191 F HN 0.356 8.656 8.300 -0.000 0.000 0.492 192 S N -1.206 114.467 115.700 -0.044 0.000 2.536 192 S HA 0.383 5.364 4.470 0.851 0.000 0.271 192 S C -2.174 172.355 174.600 -0.117 0.000 1.134 192 S CA -1.243 56.872 58.200 -0.141 0.000 0.897 192 S CB 1.543 64.673 63.200 -0.116 0.000 1.094 192 S HN -0.181 8.129 8.310 -0.000 0.000 0.473 193 P HA -0.019 4.401 4.420 -0.000 0.000 0.221 193 P C 0.028 177.045 177.300 -0.473 0.000 1.145 193 P CA 1.175 64.026 63.100 -0.416 0.000 0.795 193 P CB -0.058 31.224 31.700 -0.696 0.000 0.775 194 Y N -1.778 118.490 120.300 -0.052 0.000 2.457 194 Y HA 0.293 5.354 4.550 0.851 0.000 0.263 194 Y C 1.016 176.890 175.900 -0.042 0.000 1.164 194 Y CA -0.174 57.900 58.100 -0.043 0.000 1.274 194 Y CB 0.019 38.450 38.460 -0.048 0.000 1.097 194 Y HN -0.134 8.146 8.280 -0.000 0.000 0.523 195 I N 0.155 120.748 120.570 0.039 0.000 2.499 195 I HA 0.272 4.953 4.170 0.851 0.000 0.288 195 I C -1.022 175.101 176.117 0.010 0.000 1.048 195 I CA -0.938 60.376 61.300 0.023 0.000 1.062 195 I CB 1.884 39.876 38.000 -0.014 0.000 1.238 195 I HN -0.168 8.042 8.210 -0.000 0.000 0.426 196 D N 3.726 124.133 120.400 0.011 0.000 2.387 196 D HA 0.201 5.351 4.640 0.851 0.000 0.255 196 D C 0.407 176.707 176.300 -0.000 0.000 1.081 196 D CA -0.127 53.875 54.000 0.003 0.000 0.994 196 D CB 0.769 41.570 40.800 0.003 0.000 1.127 196 D HN 0.568 8.938 8.370 -0.000 0.000 0.513 197 N N -0.303 118.394 118.700 -0.006 0.000 2.738 197 N HA -0.215 5.036 4.740 0.851 0.000 0.249 197 N C -1.638 173.855 175.510 -0.029 0.000 1.047 197 N CA 0.281 53.322 53.050 -0.016 0.000 0.707 197 N CB -1.010 37.467 38.487 -0.016 0.000 0.937 197 N HN 0.320 8.700 8.380 -0.000 0.000 0.545 198 L N -0.026 121.185 121.223 -0.021 0.000 2.516 198 L HA 0.677 5.528 4.340 0.851 0.000 0.267 198 L C -0.319 176.543 176.870 -0.013 0.000 0.957 198 L CA -0.154 54.658 54.840 -0.047 0.000 0.860 198 L CB 1.850 43.883 42.059 -0.044 0.000 1.265 198 L HN 0.149 8.379 8.230 -0.000 0.000 0.403 199 T N 1.757 116.270 114.554 -0.067 0.000 2.864 199 T HA 0.526 5.387 4.350 0.851 0.000 0.289 199 T C -1.955 172.626 174.700 -0.199 0.000 1.082 199 T CA -0.429 61.662 62.100 -0.015 0.000 1.009 199 T CB 1.459 70.400 68.868 0.121 0.000 1.234 199 T HN 0.655 8.895 8.240 -0.000 0.000 0.526 200 D N 1.235 121.499 120.400 -0.228 0.000 2.462 200 D HA 0.400 5.551 4.640 0.851 0.000 0.245 200 D C -1.906 174.275 176.300 -0.198 0.000 1.122 200 D CA -2.170 51.566 54.000 -0.440 0.000 0.864 200 D CB 2.098 42.357 40.800 -0.902 0.000 1.098 200 D HN 0.106 8.476 8.370 -0.000 0.000 0.541 201 P HA -0.204 4.216 4.420 -0.000 0.000 0.217 201 P C 1.430 178.820 177.300 0.149 0.000 1.151 201 P CA 1.502 64.524 63.100 -0.130 0.000 0.849 201 P CB 0.168 31.599 31.700 -0.450 0.000 0.787 202 S N -2.477 113.317 115.700 0.157 0.000 2.469 202 S HA -0.187 4.793 4.470 0.851 0.000 0.238 202 S C 1.590 176.495 174.600 0.510 0.000 0.998 202 S CA 0.913 59.306 58.200 0.323 0.000 0.957 202 S CB -1.360 62.056 63.200 0.359 0.000 0.764 202 S HN 0.080 8.390 8.310 -0.000 0.000 0.514 203 Y N 1.257 121.725 120.300 0.280 0.000 2.544 203 Y HA 0.249 5.309 4.550 0.851 0.000 0.286 203 Y C 1.110 177.087 175.900 0.129 0.000 1.141 203 Y CA -0.758 57.478 58.100 0.226 0.000 1.299 203 Y CB -0.915 37.656 38.460 0.185 0.000 1.030 203 Y HN 0.435 8.715 8.280 -0.000 0.000 0.543 204 H N 1.053 120.304 119.070 0.301 0.000 2.782 204 H HA 0.311 5.377 4.556 0.851 0.000 0.285 204 H C -0.283 175.086 175.328 0.070 0.000 1.093 204 H CA 0.111 56.309 56.048 0.250 0.000 1.410 204 H CB 0.504 30.385 29.762 0.197 0.000 1.439 204 H HN 0.051 8.331 8.280 -0.000 0.000 0.469 205 I N 6.258 126.746 120.570 -0.137 0.000 2.668 205 I HA 0.152 4.833 4.170 0.851 0.000 0.276 205 I C -1.973 173.787 176.117 -0.594 0.000 1.139 205 I CA -1.848 59.150 61.300 -0.503 0.000 1.133 205 I CB 1.775 39.112 38.000 -1.106 0.000 1.327 205 I HN 0.250 8.460 8.210 -0.000 0.000 0.520 206 P HA -0.173 4.247 4.420 -0.000 0.000 0.216 206 P C 1.674 178.979 177.300 0.008 0.000 1.150 206 P CA 1.173 64.328 63.100 0.091 0.000 0.837 206 P CB 0.384 32.262 31.700 0.296 0.000 0.786 207 A N -1.242 121.584 122.820 0.009 0.000 1.972 207 A HA -0.199 4.631 4.320 0.851 0.000 0.219 207 A C 1.898 179.578 177.584 0.160 0.000 1.169 207 A CA 1.313 53.464 52.037 0.189 0.000 0.635 207 A CB -1.700 17.453 19.000 0.254 0.000 0.810 207 A HN 0.035 8.185 8.150 -0.000 0.000 0.446 208 F N -0.801 118.859 119.950 -0.483 0.000 2.126 208 F HA -0.161 4.878 4.527 0.853 0.000 0.299 208 F C 2.199 177.345 175.800 -1.091 0.000 1.096 208 F CA 0.703 58.140 58.000 -0.938 0.000 1.255 208 F CB -1.456 36.824 39.000 -1.200 0.000 0.997 208 F HN 0.369 8.669 8.300 -0.000 0.000 0.479 209 Y N 0.007 120.136 120.300 -0.286 0.000 2.242 209 Y HA -0.162 4.899 4.550 0.851 0.000 0.291 209 Y C 2.323 178.298 175.900 0.126 0.000 1.137 209 Y CA 0.628 58.681 58.100 -0.079 0.000 1.181 209 Y CB -1.288 37.334 38.460 0.271 0.000 0.989 209 Y HN 0.064 8.344 8.280 -0.000 0.000 0.527 210 D N -1.025 119.559 120.400 0.307 0.000 2.144 210 D HA -0.217 4.933 4.640 0.851 0.000 0.199 210 D C 1.968 178.515 176.300 0.412 0.000 0.984 210 D CA 1.304 55.533 54.000 0.381 0.000 0.834 210 D CB -0.518 40.538 40.800 0.427 0.000 0.955 210 D HN 0.398 8.768 8.370 -0.000 0.000 0.465 211 Y N 1.037 121.403 120.300 0.110 0.000 2.181 211 Y HA -0.241 4.820 4.550 0.852 0.000 0.288 211 Y C 2.020 178.001 175.900 0.136 0.000 1.146 211 Y CA 1.296 59.400 58.100 0.007 0.000 1.164 211 Y CB -0.420 37.677 38.460 -0.606 0.000 0.982 211 Y HN -0.194 8.086 8.280 -0.000 0.000 0.515 212 F N 0.281 120.185 119.950 -0.077 0.000 2.095 212 F HA -0.191 4.847 4.527 0.852 0.000 0.298 212 F C 2.716 178.439 175.800 -0.128 0.000 1.104 212 F CA 0.913 58.723 58.000 -0.317 0.000 1.232 212 F CB -1.720 36.857 39.000 -0.704 0.000 0.987 212 F HN 0.169 8.469 8.300 -0.000 0.000 0.475 213 A N 0.297 123.305 122.820 0.313 0.000 1.940 213 A HA -0.220 4.611 4.320 0.851 0.000 0.219 213 A C 1.966 179.684 177.584 0.223 0.000 1.176 213 A CA 1.989 54.239 52.037 0.355 0.000 0.631 213 A CB -0.822 18.408 19.000 0.383 0.000 0.814 213 A HN 0.361 8.511 8.150 -0.000 0.000 0.446 214 N N 0.109 118.928 118.700 0.198 0.000 2.521 214 N HA -0.007 5.244 4.740 0.851 0.000 0.188 214 N C 0.557 176.163 175.510 0.161 0.000 1.146 214 N CA 0.491 53.647 53.050 0.176 0.000 0.893 214 N CB -0.138 38.501 38.487 0.254 0.000 0.975 214 N HN 0.544 8.924 8.380 -0.000 0.000 0.451 215 N N 0.090 118.846 118.700 0.093 0.000 2.170 215 N HA 0.054 5.304 4.740 0.851 0.000 0.222 215 N C 0.068 175.716 175.510 0.230 0.000 1.218 215 N CA 0.022 53.197 53.050 0.209 0.000 0.889 215 N CB 1.805 40.246 38.487 -0.077 0.000 1.083 215 N HN 0.021 8.401 8.380 -0.000 0.000 0.520 216 V N -0.574 119.386 119.914 0.076 0.000 3.109 216 V HA 0.580 5.211 4.120 0.851 0.000 0.317 216 V C 1.021 177.036 176.094 -0.130 0.000 1.074 216 V CA -0.404 61.930 62.300 0.056 0.000 1.033 216 V CB 1.291 33.191 31.823 0.128 0.000 1.111 216 V HN 0.145 8.335 8.190 -0.000 0.000 0.458 217 T N -1.159 113.343 114.554 -0.087 0.000 3.380 217 T HA 0.402 5.263 4.350 0.851 0.000 0.289 217 T C -0.154 174.498 174.700 -0.080 0.000 1.012 217 T CA 0.033 62.011 62.100 -0.202 0.000 0.944 217 T CB -1.427 67.328 68.868 -0.189 0.000 1.172 217 T HN 1.135 9.375 8.240 -0.000 0.000 0.502 218 N N -0.964 117.720 118.700 -0.026 0.000 2.277 218 N HA 0.293 5.544 4.740 0.851 0.000 0.286 218 N C 0.691 176.214 175.510 0.021 0.000 1.140 218 N CA -1.082 51.966 53.050 -0.002 0.000 0.799 218 N CB 1.758 40.252 38.487 0.011 0.000 1.596 218 N HN -0.038 8.342 8.380 -0.000 0.000 0.473 219 Q N 1.249 121.060 119.800 0.019 0.000 2.084 219 Q HA -0.170 4.681 4.340 0.851 0.000 0.202 219 Q C 1.648 177.680 176.000 0.054 0.000 0.978 219 Q CA 2.034 57.858 55.803 0.034 0.000 0.844 219 Q CB -0.279 28.474 28.738 0.024 0.000 0.898 219 Q HN 0.821 9.091 8.270 -0.000 0.000 0.426 220 A N 1.050 123.896 122.820 0.043 0.000 1.877 220 A HA -0.219 4.611 4.320 0.851 0.000 0.216 220 A C 1.702 179.334 177.584 0.080 0.000 1.186 220 A CA 1.854 53.919 52.037 0.047 0.000 0.620 220 A CB -0.615 18.395 19.000 0.017 0.000 0.822 220 A HN 0.459 8.609 8.150 -0.000 0.000 0.443 221 D N -0.693 119.759 120.400 0.087 0.000 2.178 221 D HA -0.115 5.036 4.640 0.851 0.000 0.202 221 D C 1.883 178.364 176.300 0.302 0.000 0.974 221 D CA 1.366 55.462 54.000 0.159 0.000 0.841 221 D CB -0.205 40.697 40.800 0.170 0.000 0.953 221 D HN 0.615 8.985 8.370 -0.000 0.000 0.478 222 K N 0.811 121.347 120.400 0.226 0.000 2.032 222 K HA -0.168 4.663 4.320 0.851 0.000 0.209 222 K C 1.674 178.416 176.600 0.236 0.000 1.048 222 K CA 1.440 57.873 56.287 0.243 0.000 0.927 222 K CB 0.013 32.600 32.500 0.145 0.000 0.712 222 K HN -0.026 8.224 8.250 -0.000 0.000 0.441 223 N N -0.542 118.254 118.700 0.160 0.000 2.166 223 N HA -0.181 5.070 4.740 0.851 0.000 0.186 223 N C 1.546 177.115 175.510 0.098 0.000 1.019 223 N CA 1.338 54.458 53.050 0.118 0.000 0.856 223 N CB -0.272 38.262 38.487 0.079 0.000 0.993 223 N HN 0.258 8.638 8.380 -0.000 0.000 0.426 224 Y N -0.184 120.095 120.300 -0.035 0.000 2.097 224 Y HA -0.267 4.794 4.550 0.851 0.000 0.282 224 Y C 1.559 177.346 175.900 -0.189 0.000 1.152 224 Y CA 1.706 59.690 58.100 -0.194 0.000 1.136 224 Y CB -0.464 37.776 38.460 -0.367 0.000 0.975 224 Y HN 0.157 8.437 8.280 -0.000 0.000 0.498 225 W N -0.408 121.014 121.300 0.204 0.000 2.436 225 W HA -0.077 5.093 4.660 0.850 0.000 0.284 225 W C 2.794 179.381 176.519 0.113 0.000 1.225 225 W CA 1.750 59.204 57.345 0.181 0.000 1.271 225 W CB -0.558 29.128 29.460 0.377 0.000 1.114 225 W HN -0.035 8.145 8.180 -0.000 0.000 0.559 226 R N 0.709 121.386 120.500 0.295 0.000 2.096 226 R HA -0.184 4.667 4.340 0.851 0.000 0.235 226 R C 1.600 177.961 176.300 0.102 0.000 1.127 226 R CA 2.007 58.233 56.100 0.212 0.000 0.968 226 R CB -1.309 29.090 30.300 0.166 0.000 0.861 226 R HN 0.432 8.702 8.270 -0.000 0.000 0.440 227 Q N -0.071 119.719 119.800 -0.016 0.000 2.119 227 Q HA -0.034 4.817 4.340 0.851 0.000 0.201 227 Q C 2.357 178.265 176.000 -0.153 0.000 0.972 227 Q CA 1.481 57.226 55.803 -0.098 0.000 0.847 227 Q CB -0.113 28.519 28.738 -0.177 0.000 0.903 227 Q HN 0.415 8.685 8.270 -0.000 0.000 0.433 228 V N 1.030 120.781 119.914 -0.271 0.000 2.332 228 V HA -0.321 4.310 4.120 0.851 0.000 0.248 228 V C 2.260 178.303 176.094 -0.084 0.000 1.055 228 V CA 1.859 63.969 62.300 -0.317 0.000 1.038 228 V CB -1.049 30.486 31.823 -0.480 0.000 0.651 228 V HN 0.431 8.621 8.190 -0.000 0.000 0.450 229 A N -0.245 122.675 122.820 0.167 0.000 1.883 229 A HA -0.258 4.573 4.320 0.851 0.000 0.217 229 A C 2.412 180.128 177.584 0.219 0.000 1.186 229 A CA 2.699 54.950 52.037 0.355 0.000 0.624 229 A CB -1.086 18.137 19.000 0.371 0.000 0.822 229 A HN 0.504 8.654 8.150 -0.000 0.000 0.444 230 T N -0.173 114.456 114.554 0.124 0.000 2.746 230 T HA -0.116 4.745 4.350 0.851 0.000 0.267 230 T C 1.911 176.627 174.700 0.026 0.000 1.039 230 T CA 1.687 63.832 62.100 0.075 0.000 1.142 230 T CB -0.187 68.708 68.868 0.045 0.000 0.866 230 T HN 0.521 8.761 8.240 -0.000 0.000 0.444 231 K N 0.816 121.216 120.400 -0.001 0.000 2.211 231 K HA 0.009 4.839 4.320 0.851 0.000 0.203 231 K C 2.711 179.322 176.600 0.019 0.000 1.050 231 K CA 0.933 57.204 56.287 -0.026 0.000 0.945 231 K CB -0.161 32.302 32.500 -0.062 0.000 0.732 231 K HN 0.174 8.424 8.250 -0.000 0.000 0.451 232 S N 0.870 116.639 115.700 0.116 0.000 2.371 232 S HA -0.079 4.902 4.470 0.851 0.000 0.224 232 S C 1.879 176.537 174.600 0.096 0.000 1.029 232 S CA 0.868 59.241 58.200 0.288 0.000 0.978 232 S CB 0.051 63.581 63.200 0.550 0.000 0.833 232 S HN 0.225 8.535 8.310 -0.000 0.000 0.466 233 R N 0.117 120.648 120.500 0.051 0.000 2.096 233 R HA -0.053 4.798 4.340 0.851 0.000 0.235 233 R C 2.417 178.440 176.300 -0.461 0.000 1.127 233 R CA 1.849 57.834 56.100 -0.191 0.000 0.968 233 R CB -0.991 29.309 30.300 -0.001 0.000 0.861 233 R HN 0.400 8.670 8.270 -0.000 0.000 0.440 234 T N 2.288 116.685 114.554 -0.261 0.000 2.746 234 T HA -0.097 4.763 4.350 0.851 0.000 0.267 234 T C 1.719 176.259 174.700 -0.266 0.000 1.039 234 T CA 0.874 62.815 62.100 -0.265 0.000 1.142 234 T CB -0.187 68.591 68.868 -0.150 0.000 0.866 234 T HN 0.116 8.356 8.240 -0.000 0.000 0.444 235 L N 1.070 122.158 121.223 -0.225 0.000 2.012 235 L HA -0.043 4.808 4.340 0.851 0.000 0.210 235 L C 2.220 178.915 176.870 -0.291 0.000 1.073 235 L CA 1.840 56.524 54.840 -0.259 0.000 0.748 235 L CB -1.080 40.780 42.059 -0.332 0.000 0.891 235 L HN 0.331 8.561 8.230 -0.000 0.000 0.431 236 L N -0.094 120.933 121.223 -0.326 0.000 2.046 236 L HA -0.252 4.599 4.340 0.851 0.000 0.208 236 L C 2.755 179.534 176.870 -0.152 0.000 1.077 236 L CA 1.398 56.127 54.840 -0.185 0.000 0.747 236 L CB -0.478 41.544 42.059 -0.062 0.000 0.896 236 L HN 0.263 8.493 8.230 -0.000 0.000 0.432 237 K N -0.124 119.937 120.400 -0.566 0.000 2.032 237 K HA -0.174 4.657 4.320 0.851 0.000 0.209 237 K C 1.941 178.458 176.600 -0.139 0.000 1.048 237 K CA 1.562 57.594 56.287 -0.425 0.000 0.927 237 K CB -0.249 31.859 32.500 -0.654 0.000 0.712 237 K HN 0.281 8.531 8.250 -0.000 0.000 0.441 238 N N 0.438 119.039 118.700 -0.165 0.000 2.120 238 N HA -0.173 5.078 4.740 0.851 0.000 0.188 238 N C 1.768 177.232 175.510 -0.077 0.000 1.024 238 N CA 1.283 54.270 53.050 -0.105 0.000 0.852 238 N CB -0.529 37.889 38.487 -0.114 0.000 1.003 238 N HN 0.297 8.677 8.380 -0.000 0.000 0.424 239 H N -0.122 118.825 119.070 -0.206 0.000 2.321 239 H HA -0.019 5.046 4.556 0.850 0.000 0.300 239 H C 1.616 176.766 175.328 -0.296 0.000 1.087 239 H CA 1.593 57.466 56.048 -0.291 0.000 1.319 239 H CB -0.412 29.112 29.762 -0.396 0.000 1.379 239 H HN 0.106 8.386 8.280 -0.000 0.000 0.501 240 F N -0.115 119.774 119.950 -0.100 0.000 2.216 240 F HA -0.164 4.869 4.527 0.843 0.000 0.300 240 F C 2.678 178.405 175.800 -0.123 0.000 1.085 240 F CA 1.625 59.562 58.000 -0.106 0.000 1.326 240 F CB -0.671 38.348 39.000 0.032 0.000 1.027 240 F HN 0.163 8.463 8.300 -0.000 0.000 0.497 241 T N -0.148 114.429 114.554 0.038 0.000 2.708 241 T HA -0.162 4.699 4.350 0.851 0.000 0.266 241 T C 2.041 176.691 174.700 -0.084 0.000 1.037 241 T CA 1.152 63.242 62.100 -0.018 0.000 1.146 241 T CB -0.126 68.724 68.868 -0.030 0.000 0.865 241 T HN 0.101 8.341 8.240 -0.000 0.000 0.435 242 K N 1.280 121.593 120.400 -0.144 0.000 2.148 242 K HA 0.003 4.834 4.320 0.851 0.000 0.204 242 K C 2.309 178.796 176.600 -0.187 0.000 1.050 242 K CA 0.996 57.187 56.287 -0.161 0.000 0.942 242 K CB -0.438 31.955 32.500 -0.179 0.000 0.724 242 K HN 0.470 8.720 8.250 -0.000 0.000 0.446 243 V N -1.420 118.307 119.914 -0.310 0.000 3.649 243 V HA 0.102 4.733 4.120 0.851 0.000 0.275 243 V C 0.658 176.664 176.094 -0.147 0.000 1.281 243 V CA -0.215 61.930 62.300 -0.259 0.000 1.143 243 V CB -0.134 31.410 31.823 -0.466 0.000 0.892 243 V HN -0.094 8.096 8.190 -0.000 0.000 0.441 244 S N 1.482 117.110 115.700 -0.120 0.000 2.549 244 S HA 0.547 5.528 4.470 0.851 0.000 0.283 244 S C 0.995 175.449 174.600 -0.243 0.000 1.320 244 S CA 0.504 58.638 58.200 -0.111 0.000 1.058 244 S CB 0.433 63.598 63.200 -0.059 0.000 0.882 244 S HN 1.516 9.826 8.310 -0.000 0.000 0.498 245 G N 2.508 111.119 108.800 -0.314 0.000 2.601 245 G HA2 -0.249 4.222 3.960 0.851 0.000 0.261 245 G HA3 -0.249 4.222 3.960 0.851 0.000 0.261 245 G C 0.137 174.213 174.900 -1.372 0.000 1.289 245 G CA -0.136 44.536 45.100 -0.714 0.000 0.920 245 G HN 1.003 9.293 8.290 -0.000 0.000 0.571 246 S N 1.234 116.013 115.700 -1.535 0.000 2.562 246 S HA 0.494 5.474 4.470 0.851 0.000 0.281 246 S C -0.158 174.048 174.600 -0.656 0.000 1.333 246 S CA 0.064 57.508 58.200 -1.261 0.000 1.052 246 S CB 1.015 63.889 63.200 -0.542 0.000 0.884 246 S HN 0.685 8.995 8.310 -0.000 0.000 0.506 247 P HA 0.192 4.612 4.420 -0.000 0.000 0.267 247 P C 0.340 177.385 177.300 -0.424 0.000 1.289 247 P CA 0.212 63.009 63.100 -0.505 0.000 0.866 247 P CB 0.158 31.625 31.700 -0.388 0.000 1.309 248 H N -1.900 117.017 119.070 -0.256 0.000 2.551 248 H HA 0.076 5.141 4.556 0.847 0.000 0.266 248 H C 0.065 175.285 175.328 -0.180 0.000 0.964 248 H CA 0.304 56.275 56.048 -0.129 0.000 1.180 248 H CB -0.315 29.341 29.762 -0.177 0.000 1.408 248 H HN 0.133 8.413 8.280 -0.000 0.000 0.563 249 W N 1.581 122.810 121.300 -0.118 0.000 5.963 249 W HA -0.299 4.873 4.660 0.854 0.000 0.400 249 W C 0.037 176.318 176.519 -0.396 0.000 1.530 249 W CA 0.531 57.721 57.345 -0.257 0.000 1.004 249 W CB -2.374 26.898 29.460 -0.314 0.000 2.706 249 W HN 0.370 8.550 8.180 -0.000 0.000 1.495 250 N N -2.671 115.973 118.700 -0.092 0.000 2.948 250 N HA -0.200 5.050 4.740 0.851 0.000 0.239 250 N C -0.321 175.155 175.510 -0.057 0.000 0.954 250 N CA 1.608 54.641 53.050 -0.027 0.000 0.941 250 N CB -1.439 37.090 38.487 0.070 0.000 1.101 250 N HN 0.388 8.768 8.380 -0.000 0.000 0.579 251 L N 1.970 123.074 121.223 -0.199 0.000 2.317 251 L HA 0.502 5.353 4.340 0.851 0.000 0.281 251 L C -1.765 175.056 176.870 -0.083 0.000 1.024 251 L CA -1.551 53.187 54.840 -0.170 0.000 0.810 251 L CB 1.647 43.442 42.059 -0.441 0.000 1.240 251 L HN -0.188 8.042 8.230 -0.000 0.000 0.427 252 P HA 0.152 4.572 4.420 -0.000 0.000 0.274 252 P C -0.666 176.775 177.300 0.236 0.000 1.256 252 P CA -0.245 62.851 63.100 -0.007 0.000 0.795 252 P CB 1.020 32.713 31.700 -0.012 0.000 1.038 253 T N -2.759 111.975 114.554 0.300 0.000 2.940 253 T HA 0.298 5.159 4.350 0.851 0.000 0.288 253 T C 0.840 175.617 174.700 0.128 0.000 1.045 253 T CA -0.577 61.630 62.100 0.178 0.000 1.018 253 T CB 0.550 69.448 68.868 0.050 0.000 1.151 253 T HN 0.217 8.457 8.240 -0.000 0.000 0.529 254 F N 1.381 121.304 119.950 -0.046 0.000 2.043 254 F HA 0.242 5.279 4.527 0.851 0.000 0.297 254 F C 0.240 175.901 175.800 -0.231 0.000 1.121 254 F CA 0.898 58.825 58.000 -0.121 0.000 1.199 254 F CB -0.549 38.385 39.000 -0.110 0.000 0.968 254 F HN 0.459 8.759 8.300 -0.000 0.000 0.478 255 L N -0.277 120.642 121.223 -0.507 0.000 2.370 255 L HA 0.468 5.318 4.340 0.851 0.000 0.266 255 L C -0.391 176.240 176.870 -0.397 0.000 1.002 255 L CA -0.753 53.680 54.840 -0.677 0.000 0.818 255 L CB 1.864 43.372 42.059 -0.919 0.000 1.325 255 L HN -0.060 8.170 8.230 -0.000 0.000 0.418 256 S N 0.806 116.285 115.700 -0.369 0.000 2.564 256 S HA 0.627 5.607 4.470 0.851 0.000 0.274 256 S C -0.758 173.723 174.600 -0.198 0.000 1.124 256 S CA -0.890 57.151 58.200 -0.267 0.000 0.869 256 S CB 1.647 64.618 63.200 -0.383 0.000 1.105 256 S HN 0.461 8.771 8.310 -0.000 0.000 0.472 257 R N 2.046 122.465 120.500 -0.135 0.000 2.738 257 R HA 0.327 5.178 4.340 0.851 0.000 0.275 257 R C 1.282 177.526 176.300 -0.093 0.000 1.121 257 R CA -0.475 55.567 56.100 -0.097 0.000 1.207 257 R CB -0.308 29.951 30.300 -0.069 0.000 1.141 257 R HN 0.752 9.022 8.270 -0.000 0.000 0.571 258 L N 0.964 122.147 121.223 -0.066 0.000 2.465 258 L HA -0.129 4.721 4.340 0.851 0.000 0.224 258 L C 1.250 178.078 176.870 -0.070 0.000 1.145 258 L CA 0.994 55.799 54.840 -0.059 0.000 0.834 258 L CB -0.471 41.568 42.059 -0.035 0.000 0.944 258 L HN 0.608 8.838 8.230 -0.000 0.000 0.451 259 D N -0.631 119.728 120.400 -0.068 0.000 2.340 259 D HA 0.028 5.179 4.640 0.851 0.000 0.220 259 D C 1.443 177.697 176.300 -0.076 0.000 1.039 259 D CA 0.762 54.721 54.000 -0.068 0.000 0.866 259 D CB 0.339 41.107 40.800 -0.054 0.000 0.913 259 D HN 0.217 8.587 8.370 -0.000 0.000 0.523 260 G N -0.316 108.433 108.800 -0.085 0.000 2.175 260 G HA2 -0.264 4.207 3.960 0.851 0.000 0.244 260 G HA3 -0.264 4.207 3.960 0.851 0.000 0.244 260 G C 0.250 175.160 174.900 0.017 0.000 0.982 260 G CA 0.155 45.226 45.100 -0.048 0.000 0.641 260 G HN 0.387 8.677 8.290 -0.000 0.000 0.527 261 S N 2.811 118.488 115.700 -0.039 0.000 2.516 261 S HA 0.451 5.431 4.470 0.851 0.000 0.282 261 S C -1.872 172.691 174.600 -0.060 0.000 1.286 261 S CA -0.521 57.648 58.200 -0.052 0.000 1.066 261 S CB 1.235 64.409 63.200 -0.044 0.000 0.884 261 S HN 0.276 8.586 8.310 -0.000 0.000 0.491 262 P HA 0.015 4.435 4.420 -0.000 0.000 0.265 262 P C -0.638 176.601 177.300 -0.103 0.000 1.187 262 P CA -0.144 62.870 63.100 -0.143 0.000 0.766 262 P CB 0.336 31.801 31.700 -0.392 0.000 0.820 263 V N 5.229 125.061 119.914 -0.137 0.000 2.555 263 V HA 0.080 4.710 4.120 0.851 0.000 0.286 263 V C 0.598 176.632 176.094 -0.100 0.000 1.044 263 V CA 0.032 62.256 62.300 -0.128 0.000 1.026 263 V CB 0.225 31.926 31.823 -0.203 0.000 0.981 263 V HN 0.350 8.540 8.190 -0.000 0.000 0.480 264 I N 4.978 125.523 120.570 -0.041 0.000 2.315 264 I HA 0.609 5.290 4.170 0.851 0.000 0.291 264 I C 0.904 176.990 176.117 -0.052 0.000 1.006 264 I CA 0.547 61.849 61.300 0.003 0.000 1.265 264 I CB 0.145 38.204 38.000 0.097 0.000 1.387 264 I HN 0.893 9.103 8.210 -0.000 0.000 0.475 265 G N 6.499 115.224 108.800 -0.125 0.000 2.598 265 G HA2 -0.280 4.190 3.960 0.851 0.000 0.244 265 G HA3 -0.280 4.190 3.960 0.851 0.000 0.244 265 G C -0.774 173.904 174.900 -0.370 0.000 1.302 265 G CA -0.422 44.548 45.100 -0.216 0.000 0.903 265 G HN 0.462 8.752 8.290 -0.000 0.000 0.575 266 Y N 0.346 120.578 120.300 -0.114 0.000 2.299 266 Y HA 0.546 5.607 4.550 0.853 0.000 0.326 266 Y C 1.746 177.580 175.900 -0.109 0.000 1.164 266 Y CA 0.303 58.307 58.100 -0.161 0.000 1.234 266 Y CB 1.126 39.486 38.460 -0.166 0.000 1.219 266 Y HN 0.671 8.951 8.280 -0.000 0.000 0.497 267 I N -0.936 119.648 120.570 0.024 0.000 4.655 267 I HA 0.395 5.076 4.170 0.851 0.000 0.333 267 I C -0.756 175.474 176.117 0.189 0.000 1.312 267 I CA -0.205 61.147 61.300 0.087 0.000 1.270 267 I CB 0.725 38.779 38.000 0.090 0.000 1.318 267 I HN 0.299 8.509 8.210 -0.000 0.000 0.456 268 F N -0.005 119.995 119.950 0.085 0.000 2.641 268 F HA 0.528 5.566 4.527 0.851 0.000 0.308 268 F C -1.119 174.732 175.800 0.086 0.000 1.105 268 F CA -1.292 56.757 58.000 0.081 0.000 0.964 268 F CB 0.395 39.450 39.000 0.093 0.000 1.294 268 F HN -0.177 8.123 8.300 -0.000 0.000 0.442 269 N N 1.136 119.950 118.700 0.190 0.000 2.468 269 N HA 0.415 5.665 4.740 0.851 0.000 0.265 269 N C 0.822 176.448 175.510 0.194 0.000 1.199 269 N CA 1.081 54.188 53.050 0.094 0.000 0.928 269 N CB 0.818 39.362 38.487 0.095 0.000 1.059 269 N HN 1.195 9.575 8.380 -0.000 0.000 0.467 270 G N 1.349 110.177 108.800 0.047 0.000 2.195 270 G HA2 -0.297 4.174 3.960 0.851 0.000 0.224 270 G HA3 -0.297 4.174 3.960 0.851 0.000 0.224 270 G C 0.111 175.048 174.900 0.061 0.000 0.990 270 G CA -0.390 44.792 45.100 0.137 0.000 0.639 270 G HN 0.628 8.918 8.290 -0.000 0.000 0.514 271 Q N 0.583 120.149 119.800 -0.389 0.000 2.300 271 Q HA 0.568 5.419 4.340 0.851 0.000 0.280 271 Q C 1.643 177.642 176.000 -0.002 0.000 1.033 271 Q CA 0.699 56.211 55.803 -0.484 0.000 0.903 271 Q CB 0.935 29.081 28.738 -0.987 0.000 1.195 271 Q HN 0.710 8.980 8.270 -0.000 0.000 0.386 272 A N 4.847 127.741 122.820 0.123 0.000 1.970 272 A HA 0.032 4.863 4.320 0.851 0.000 0.216 272 A C 0.251 177.847 177.584 0.020 0.000 1.170 272 A CA 0.790 52.873 52.037 0.076 0.000 0.645 272 A CB 0.218 19.239 19.000 0.035 0.000 0.816 272 A HN 0.810 8.960 8.150 -0.000 0.000 0.447 273 N N -1.656 116.996 118.700 -0.081 0.000 2.494 273 N HA 0.370 5.621 4.740 0.851 0.000 0.270 273 N C -3.341 171.743 175.510 -0.710 0.000 1.285 273 N CA -1.439 51.323 53.050 -0.480 0.000 0.812 273 N CB 1.265 39.458 38.487 -0.491 0.000 1.557 273 N HN -0.220 8.160 8.380 -0.000 0.000 0.487 274 P HA 0.052 4.472 4.420 -0.000 0.000 0.267 274 P C 0.884 177.896 177.300 -0.480 0.000 1.200 274 P CA 0.163 62.595 63.100 -1.114 0.000 0.772 274 P CB 0.448 31.499 31.700 -1.081 0.000 0.855 275 G N 2.322 110.908 108.800 -0.357 0.000 2.470 275 G HA2 -0.222 4.249 3.960 0.851 0.000 0.220 275 G HA3 -0.222 4.249 3.960 0.851 0.000 0.220 275 G C 1.024 175.868 174.900 -0.093 0.000 1.121 275 G CA 0.318 45.281 45.100 -0.229 0.000 0.766 275 G HN 0.624 8.914 8.290 -0.000 0.000 0.553 276 Q N -0.673 119.083 119.800 -0.073 0.000 2.360 276 Q HA 0.020 4.870 4.340 0.851 0.000 0.202 276 Q C -0.143 175.948 176.000 0.153 0.000 0.915 276 Q CA -0.476 55.310 55.803 -0.028 0.000 0.943 276 Q CB -0.135 28.523 28.738 -0.133 0.000 1.064 276 Q HN 0.366 8.636 8.270 -0.000 0.000 0.511 277 W N 1.844 123.116 121.300 -0.047 0.000 2.216 277 W HA 0.146 5.330 4.660 0.872 0.000 0.326 277 W C -0.040 176.532 176.519 0.087 0.000 1.319 277 W CA -1.340 56.010 57.345 0.008 0.000 1.213 277 W CB -0.116 29.325 29.460 -0.032 0.000 1.171 277 W HN 0.103 8.283 8.180 -0.000 0.000 0.557 278 Y N 5.239 125.643 120.300 0.174 0.000 2.539 278 Y HA 0.241 5.304 4.550 0.856 0.000 0.352 278 Y C 0.177 176.142 175.900 0.109 0.000 1.004 278 Y CA -0.036 58.164 58.100 0.167 0.000 1.278 278 Y CB -0.190 38.383 38.460 0.189 0.000 1.136 278 Y HN 0.508 8.788 8.280 -0.000 0.000 0.528 279 E N 3.117 123.130 120.200 -0.312 0.000 2.475 279 E HA 0.315 5.176 4.350 0.851 0.000 0.221 279 E C 0.089 176.088 176.600 -1.002 0.000 0.793 279 E CA -0.418 55.610 56.400 -0.620 0.000 0.922 279 E CB -0.227 29.287 29.700 -0.309 0.000 1.778 279 E HN 0.291 8.651 8.360 -0.000 0.000 0.392 280 F N 0.801 120.318 119.950 -0.722 0.000 2.095 280 F HA -0.079 4.964 4.527 0.860 0.000 0.298 280 F C 1.701 177.149 175.800 -0.587 0.000 1.104 280 F CA 1.772 59.099 58.000 -1.121 0.000 1.232 280 F CB -0.699 37.816 39.000 -0.809 0.000 0.987 280 F HN 0.316 8.616 8.300 -0.000 0.000 0.475 281 D N 0.283 120.586 120.400 -0.163 0.000 2.097 281 D HA -0.141 5.009 4.640 0.851 0.000 0.195 281 D C 2.365 178.738 176.300 0.122 0.000 0.989 281 D CA 1.547 55.600 54.000 0.088 0.000 0.827 281 D CB -0.704 40.221 40.800 0.208 0.000 0.966 281 D HN 0.200 8.570 8.370 -0.000 0.000 0.456 282 A N 0.473 123.297 122.820 0.007 0.000 2.024 282 A HA -0.186 4.645 4.320 0.851 0.000 0.220 282 A C 1.823 179.512 177.584 0.176 0.000 1.164 282 A CA 1.030 53.115 52.037 0.080 0.000 0.643 282 A CB -1.046 17.984 19.000 0.049 0.000 0.806 282 A HN 0.274 8.424 8.150 -0.000 0.000 0.451 283 W N 0.297 121.517 121.300 -0.133 0.000 2.308 283 W HA -0.174 5.019 4.660 0.888 0.000 0.301 283 W C 2.312 178.915 176.519 0.140 0.000 1.220 283 W CA 1.315 58.672 57.345 0.020 0.000 1.240 283 W CB -0.803 28.706 29.460 0.082 0.000 1.142 283 W HN 0.384 8.564 8.180 -0.000 0.000 0.521 284 R N -0.280 120.454 120.500 0.390 0.000 2.276 284 R HA -0.006 4.845 4.340 0.851 0.000 0.203 284 R C 1.896 178.334 176.300 0.230 0.000 1.017 284 R CA 0.781 57.044 56.100 0.271 0.000 1.010 284 R CB -0.552 29.918 30.300 0.283 0.000 0.900 284 R HN 0.076 8.346 8.270 -0.000 0.000 0.469 285 V N 2.358 122.440 119.914 0.280 0.000 2.255 285 V HA -0.267 4.364 4.120 0.851 0.000 0.247 285 V C 2.346 178.607 176.094 0.277 0.000 1.051 285 V CA 2.183 64.659 62.300 0.293 0.000 1.018 285 V CB -0.511 31.509 31.823 0.328 0.000 0.641 285 V HN 0.401 8.591 8.190 -0.000 0.000 0.445 286 I N -1.949 118.781 120.570 0.266 0.000 2.676 286 I HA -0.204 4.476 4.170 0.851 0.000 0.259 286 I C 2.374 178.493 176.117 0.003 0.000 1.194 286 I CA 1.726 63.104 61.300 0.130 0.000 1.473 286 I CB -0.463 37.581 38.000 0.073 0.000 1.096 286 I HN 0.313 8.523 8.210 -0.000 0.000 0.443 287 M N 2.026 121.627 119.600 0.002 0.000 2.080 287 M HA -0.207 4.783 4.480 0.851 0.000 0.260 287 M C 1.886 178.084 176.300 -0.170 0.000 1.068 287 M CA 2.066 57.296 55.300 -0.118 0.000 1.109 287 M CB -0.328 32.211 32.600 -0.100 0.000 1.342 287 M HN 0.314 8.604 8.290 -0.000 0.000 0.405 288 N N 0.076 118.736 118.700 -0.066 0.000 2.166 288 N HA -0.123 5.128 4.740 0.851 0.000 0.186 288 N C 1.684 177.167 175.510 -0.046 0.000 1.019 288 N CA 1.508 54.506 53.050 -0.087 0.000 0.856 288 N CB -0.677 37.819 38.487 0.014 0.000 0.993 288 N HN 0.282 8.662 8.380 -0.000 0.000 0.426 289 V N 0.870 120.799 119.914 0.025 0.000 2.343 289 V HA -0.145 4.486 4.120 0.851 0.000 0.247 289 V C 2.464 178.512 176.094 -0.076 0.000 1.051 289 V CA 2.029 64.339 62.300 0.018 0.000 1.036 289 V CB -1.262 30.538 31.823 -0.038 0.000 0.654 289 V HN 0.333 8.523 8.190 -0.000 0.000 0.451 290 G N -0.328 108.386 108.800 -0.143 0.000 2.446 290 G HA2 -0.280 4.191 3.960 0.851 0.000 0.217 290 G HA3 -0.280 4.191 3.960 0.851 0.000 0.217 290 G C 1.668 176.449 174.900 -0.198 0.000 1.168 290 G CA 1.164 46.150 45.100 -0.190 0.000 0.771 290 G HN 0.467 8.757 8.290 -0.000 0.000 0.551 291 L N 0.216 121.278 121.223 -0.269 0.000 1.990 291 L HA -0.148 4.702 4.340 0.851 0.000 0.213 291 L C 2.475 179.259 176.870 -0.143 0.000 1.072 291 L CA 2.631 57.313 54.840 -0.264 0.000 0.755 291 L CB -0.404 41.408 42.059 -0.411 0.000 0.889 291 L HN 0.294 8.524 8.230 -0.000 0.000 0.432 292 D N -0.524 119.811 120.400 -0.107 0.000 2.117 292 D HA -0.190 4.961 4.640 0.851 0.000 0.197 292 D C 2.145 178.350 176.300 -0.159 0.000 0.987 292 D CA 1.458 55.440 54.000 -0.031 0.000 0.829 292 D CB 0.026 40.919 40.800 0.154 0.000 0.961 292 D HN 0.485 8.855 8.370 -0.000 0.000 0.460 293 A N -0.534 122.088 122.820 -0.330 0.000 1.883 293 A HA -0.251 4.580 4.320 0.851 0.000 0.217 293 A C 2.196 179.618 177.584 -0.269 0.000 1.186 293 A CA 1.931 53.627 52.037 -0.568 0.000 0.624 293 A CB -1.161 17.494 19.000 -0.575 0.000 0.822 293 A HN 0.566 8.716 8.150 -0.000 0.000 0.444 294 H N -1.004 117.898 119.070 -0.280 0.000 2.293 294 H HA -0.061 5.006 4.556 0.852 0.000 0.300 294 H C 1.875 177.050 175.328 -0.256 0.000 1.082 294 H CA 1.325 57.235 56.048 -0.230 0.000 1.308 294 H CB -0.010 29.660 29.762 -0.153 0.000 1.375 294 H HN 0.307 8.587 8.280 -0.000 0.000 0.495 295 L N 0.076 121.118 121.223 -0.301 0.000 2.131 295 L HA -0.084 4.767 4.340 0.851 0.000 0.206 295 L C 1.739 178.464 176.870 -0.241 0.000 1.087 295 L CA 1.070 55.634 54.840 -0.460 0.000 0.767 295 L CB -0.268 41.438 42.059 -0.589 0.000 0.917 295 L HN 0.476 8.706 8.230 -0.000 0.000 0.441 296 M N -1.386 118.139 119.600 -0.124 0.000 2.306 296 M HA 0.334 5.325 4.480 0.851 0.000 0.292 296 M C 0.466 176.729 176.300 -0.061 0.000 1.018 296 M CA 0.237 55.531 55.300 -0.011 0.000 1.007 296 M CB 0.461 33.124 32.600 0.105 0.000 1.510 296 M HN 0.169 8.459 8.290 -0.000 0.000 0.537 297 G N 1.267 109.966 108.800 -0.168 0.000 2.770 297 G HA2 0.147 4.618 3.960 0.851 0.000 0.686 297 G HA3 0.147 4.618 3.960 0.851 0.000 0.686 297 G C -0.766 173.901 174.900 -0.388 0.000 1.180 297 G CA -0.592 44.387 45.100 -0.202 0.000 0.767 297 G HN 0.541 8.831 8.290 -0.000 0.000 0.646 298 A N 1.580 124.165 122.820 -0.392 0.000 2.309 298 A HA 0.774 5.605 4.320 0.851 0.000 0.290 298 A C 0.510 177.927 177.584 -0.279 0.000 1.206 298 A CA 0.329 52.045 52.037 -0.534 0.000 0.850 298 A CB 0.807 19.585 19.000 -0.370 0.000 1.118 298 A HN 1.496 9.646 8.150 -0.000 0.000 0.523 299 Q N 0.551 120.266 119.800 -0.143 0.000 2.333 299 Q HA 0.621 5.471 4.340 0.851 0.000 0.266 299 Q C 1.501 177.480 176.000 -0.034 0.000 1.053 299 Q CA -0.165 55.651 55.803 0.021 0.000 0.890 299 Q CB 1.589 30.433 28.738 0.177 0.000 1.337 299 Q HN 1.354 9.624 8.270 -0.000 0.000 0.474 300 A N 0.915 123.748 122.820 0.022 0.000 1.940 300 A HA -0.158 4.673 4.320 0.851 0.000 0.219 300 A C 1.821 179.412 177.584 0.012 0.000 1.176 300 A CA 2.176 54.221 52.037 0.013 0.000 0.631 300 A CB -0.902 18.130 19.000 0.053 0.000 0.814 300 A HN 0.980 9.130 8.150 -0.000 0.000 0.446 301 W N -0.051 121.231 121.300 -0.028 0.000 2.388 301 W HA -0.183 4.987 4.660 0.849 0.000 0.294 301 W C 1.511 177.919 176.519 -0.185 0.000 1.212 301 W CA 1.328 58.603 57.345 -0.117 0.000 1.271 301 W CB -1.159 28.214 29.460 -0.146 0.000 1.126 301 W HN 0.536 8.716 8.180 -0.000 0.000 0.535 302 H N 1.411 119.852 119.070 -1.049 0.000 2.321 302 H HA -0.079 4.987 4.556 0.849 0.000 0.300 302 H C 2.226 177.243 175.328 -0.518 0.000 1.087 302 H CA 2.849 58.287 56.048 -1.018 0.000 1.319 302 H CB -0.324 28.872 29.762 -0.942 0.000 1.379 302 H HN 0.081 8.361 8.280 -0.000 0.000 0.501 303 K N -0.153 120.114 120.400 -0.222 0.000 2.025 303 K HA -0.115 4.716 4.320 0.851 0.000 0.207 303 K C 2.536 179.048 176.600 -0.146 0.000 1.049 303 K CA 1.309 57.500 56.287 -0.161 0.000 0.933 303 K CB -0.163 32.267 32.500 -0.117 0.000 0.714 303 K HN 0.098 8.348 8.250 -0.000 0.000 0.438 304 S N 0.692 116.320 115.700 -0.119 0.000 2.368 304 S HA -0.158 4.823 4.470 0.851 0.000 0.225 304 S C 2.106 176.614 174.600 -0.154 0.000 1.030 304 S CA 1.242 59.389 58.200 -0.088 0.000 0.999 304 S CB -0.268 62.918 63.200 -0.024 0.000 0.844 304 S HN 0.363 8.673 8.310 -0.000 0.000 0.459 305 A N 0.795 123.438 122.820 -0.295 0.000 1.865 305 A HA -0.052 4.778 4.320 0.851 0.000 0.217 305 A C 2.378 179.705 177.584 -0.428 0.000 1.191 305 A CA 2.069 53.721 52.037 -0.643 0.000 0.623 305 A CB -1.162 17.028 19.000 -1.351 0.000 0.826 305 A HN 0.468 8.618 8.150 -0.000 0.000 0.444 306 V N 0.700 120.409 119.914 -0.341 0.000 2.379 306 V HA -0.205 4.426 4.120 0.851 0.000 0.245 306 V C 2.290 178.272 176.094 -0.187 0.000 1.044 306 V CA 1.981 64.136 62.300 -0.241 0.000 1.036 306 V CB -0.975 30.715 31.823 -0.222 0.000 0.664 306 V HN 0.536 8.726 8.190 -0.000 0.000 0.453 307 N N 0.522 119.133 118.700 -0.149 0.000 2.104 307 N HA -0.166 5.084 4.740 0.851 0.000 0.190 307 N C 1.820 177.286 175.510 -0.074 0.000 1.024 307 N CA 1.427 54.415 53.050 -0.103 0.000 0.853 307 N CB -0.255 38.192 38.487 -0.068 0.000 1.008 307 N HN 0.517 8.897 8.380 -0.000 0.000 0.424 308 K N 0.525 120.892 120.400 -0.056 0.000 2.103 308 K HA 0.114 4.945 4.320 0.851 0.000 0.204 308 K C 2.093 178.705 176.600 0.021 0.000 1.052 308 K CA 0.967 57.255 56.287 0.001 0.000 0.945 308 K CB -0.041 32.474 32.500 0.026 0.000 0.722 308 K HN 0.098 8.348 8.250 -0.000 0.000 0.443 309 A N 1.511 124.323 122.820 -0.014 0.000 1.873 309 A HA -0.112 4.719 4.320 0.851 0.000 0.215 309 A C 2.121 179.647 177.584 -0.097 0.000 1.186 309 A CA 1.194 53.222 52.037 -0.014 0.000 0.616 309 A CB -0.700 18.307 19.000 0.012 0.000 0.823 309 A HN 0.134 8.284 8.150 -0.000 0.000 0.442 310 L N -0.592 120.499 121.223 -0.220 0.000 2.083 310 L HA -0.139 4.712 4.340 0.851 0.000 0.209 310 L C 2.820 179.624 176.870 -0.111 0.000 1.083 310 L CA 1.066 55.673 54.840 -0.387 0.000 0.752 310 L CB -0.908 40.758 42.059 -0.656 0.000 0.899 310 L HN 0.510 8.740 8.230 -0.000 0.000 0.433 311 G N -0.132 108.642 108.800 -0.043 0.000 2.418 311 G HA2 -0.339 4.132 3.960 0.851 0.000 0.217 311 G HA3 -0.339 4.132 3.960 0.851 0.000 0.217 311 G C 1.487 176.400 174.900 0.021 0.000 1.158 311 G CA 0.682 45.793 45.100 0.018 0.000 0.771 311 G HN 0.317 8.607 8.290 -0.000 0.000 0.545 312 F N 1.264 121.171 119.950 -0.071 0.000 2.102 312 F HA 0.016 5.096 4.527 0.922 0.000 0.298 312 F C 2.439 178.181 175.800 -0.096 0.000 1.105 312 F CA 1.216 59.169 58.000 -0.078 0.000 1.239 312 F CB -0.212 38.713 39.000 -0.126 0.000 0.991 312 F HN 0.049 8.349 8.300 -0.000 0.000 0.474 313 L N -0.595 120.479 121.223 -0.248 0.000 2.046 313 L HA -0.234 4.617 4.340 0.851 0.000 0.208 313 L C 2.527 179.257 176.870 -0.234 0.000 1.077 313 L CA 1.459 56.056 54.840 -0.405 0.000 0.747 313 L CB -0.976 40.729 42.059 -0.589 0.000 0.896 313 L HN 0.098 8.328 8.230 -0.000 0.000 0.432 314 S N -1.002 114.671 115.700 -0.045 0.000 2.368 314 S HA -0.237 4.743 4.470 0.851 0.000 0.225 314 S C 1.868 176.422 174.600 -0.076 0.000 1.030 314 S CA 1.288 59.483 58.200 -0.007 0.000 0.999 314 S CB -0.446 62.794 63.200 0.067 0.000 0.844 314 S HN 0.458 8.768 8.310 -0.000 0.000 0.459 315 Y N 2.462 122.602 120.300 -0.266 0.000 2.224 315 Y HA -0.126 4.932 4.550 0.846 0.000 0.289 315 Y C 2.331 178.004 175.900 -0.378 0.000 1.146 315 Y CA 1.020 58.937 58.100 -0.306 0.000 1.182 315 Y CB -0.685 37.566 38.460 -0.349 0.000 0.983 315 Y HN 0.203 8.483 8.280 -0.000 0.000 0.524 316 A N 0.644 123.108 122.820 -0.593 0.000 1.933 316 A HA -0.204 4.627 4.320 0.851 0.000 0.218 316 A C 2.306 179.737 177.584 -0.255 0.000 1.175 316 A CA 1.807 53.505 52.037 -0.564 0.000 0.628 316 A CB -0.779 17.793 19.000 -0.714 0.000 0.814 316 A HN 0.561 8.711 8.150 -0.000 0.000 0.444 317 K N -0.094 120.226 120.400 -0.134 0.000 2.097 317 K HA -0.167 4.664 4.320 0.851 0.000 0.206 317 K C 2.064 178.586 176.600 -0.130 0.000 1.049 317 K CA 2.020 58.279 56.287 -0.047 0.000 0.933 317 K CB -0.381 32.138 32.500 0.032 0.000 0.717 317 K HN 0.603 8.853 8.250 -0.000 0.000 0.442 318 T N -1.200 113.232 114.554 -0.203 0.000 2.962 318 T HA -0.042 4.819 4.350 0.851 0.000 0.270 318 T C 1.139 175.694 174.700 -0.241 0.000 1.088 318 T CA 0.905 62.883 62.100 -0.203 0.000 1.127 318 T CB -0.144 68.604 68.868 -0.200 0.000 0.883 318 T HN 0.123 8.363 8.240 -0.000 0.000 0.493 319 N N 2.250 120.749 118.700 -0.335 0.000 2.380 319 N HA 0.189 5.440 4.740 0.851 0.000 0.255 319 N C -0.758 174.657 175.510 -0.158 0.000 1.158 319 N CA -0.065 52.812 53.050 -0.289 0.000 0.878 319 N CB 0.159 38.379 38.487 -0.446 0.000 1.138 319 N HN 0.455 8.835 8.380 -0.000 0.000 0.509 320 N N 0.272 118.904 118.700 -0.114 0.000 2.296 320 N HA 0.055 5.305 4.740 0.851 0.000 0.294 320 N C 0.926 176.401 175.510 -0.057 0.000 1.033 320 N CA -0.094 52.920 53.050 -0.059 0.000 0.839 320 N CB 1.551 40.021 38.487 -0.027 0.000 1.395 320 N HN -0.014 8.366 8.380 -0.000 0.000 0.479 321 S N 2.884 118.557 115.700 -0.045 0.000 2.474 321 S HA -0.051 4.930 4.470 0.851 0.000 0.235 321 S C 0.950 175.526 174.600 -0.040 0.000 0.997 321 S CA 0.930 59.105 58.200 -0.041 0.000 0.949 321 S CB -0.028 63.153 63.200 -0.031 0.000 0.766 321 S HN 0.605 8.915 8.310 -0.000 0.000 0.517 322 K N 0.884 121.259 120.400 -0.042 0.000 2.374 322 K HA 0.229 5.059 4.320 0.851 0.000 0.196 322 K C 0.279 176.845 176.600 -0.056 0.000 1.023 322 K CA 0.179 56.439 56.287 -0.045 0.000 1.103 322 K CB -0.118 32.355 32.500 -0.044 0.000 0.848 322 K HN 0.349 8.600 8.250 -0.000 0.000 0.528 323 N N 0.935 119.599 118.700 -0.059 0.000 2.740 323 N HA -0.173 5.078 4.740 0.851 0.000 0.248 323 N C -1.189 174.271 175.510 -0.083 0.000 1.062 323 N CA 0.828 53.837 53.050 -0.068 0.000 0.704 323 N CB -1.647 36.801 38.487 -0.066 0.000 0.968 323 N HN 0.484 8.864 8.380 -0.000 0.000 0.547 324 c N -0.867 117.685 118.600 -0.081 0.000 2.994 324 c HA 0.834 5.915 4.570 0.851 0.000 0.304 324 c C 0.243 174.310 174.090 -0.037 0.000 1.273 324 c CA -1.523 54.726 56.329 -0.133 0.000 1.537 324 c CB 0.501 42.907 42.510 -0.174 0.000 2.001 324 c HN 0.348 8.578 8.230 -0.000 0.000 0.471 325 Y N 0.199 120.508 120.300 0.013 0.000 2.301 325 Y HA 0.745 5.274 4.550 -0.034 0.000 0.325 325 Y C 0.204 176.206 175.900 0.169 0.000 1.203 325 Y CA -0.566 57.606 58.100 0.122 0.000 1.255 325 Y CB 0.388 38.908 38.460 0.101 0.000 1.232 325 Y HN 0.765 9.045 8.280 -0.000 0.000 0.501 326 E N 1.291 121.756 120.200 0.440 0.000 2.292 326 E HA 0.142 5.003 4.350 0.851 0.000 0.258 326 E C 0.285 177.085 176.600 0.333 0.000 1.115 326 E CA -0.751 55.758 56.400 0.181 0.000 0.929 326 E CB 1.017 30.656 29.700 -0.103 0.000 1.161 326 E HN 0.803 9.163 8.360 -0.000 0.000 0.453 327 Q N -0.358 119.562 119.800 0.200 0.000 2.245 327 Q HA 0.037 4.888 4.340 0.851 0.000 0.201 327 Q C -0.145 176.028 176.000 0.289 0.000 0.955 327 Q CA 0.630 56.653 55.803 0.367 0.000 0.870 327 Q CB 0.541 29.545 28.738 0.442 0.000 0.945 327 Q HN 0.140 8.410 8.270 -0.000 0.000 0.461 328 V N 0.651 120.559 119.914 -0.010 0.000 2.569 328 V HA 0.330 4.960 4.120 0.851 0.000 0.301 328 V C -1.391 174.466 176.094 -0.395 0.000 1.044 328 V CA -0.830 61.351 62.300 -0.198 0.000 0.874 328 V CB 1.125 32.660 31.823 -0.480 0.000 1.002 328 V HN 0.052 8.242 8.190 -0.000 0.000 0.424 329 Y N 1.675 121.994 120.300 0.031 0.000 2.524 329 Y HA 0.741 5.773 4.550 0.804 0.000 0.344 329 Y C 0.361 176.169 175.900 -0.153 0.000 1.012 329 Y CA -0.622 57.469 58.100 -0.015 0.000 1.068 329 Y CB 2.469 41.002 38.460 0.121 0.000 1.249 329 Y HN 0.550 8.830 8.280 -0.000 0.000 0.468 330 S N 1.530 117.232 115.700 0.003 0.000 2.677 330 S HA 0.419 5.400 4.470 0.851 0.000 0.283 330 S C -1.506 173.203 174.600 0.183 0.000 1.159 330 S CA -0.547 57.654 58.200 0.002 0.000 1.001 330 S CB 0.024 63.203 63.200 -0.035 0.000 1.032 330 S HN 0.626 8.936 8.310 -0.000 0.000 0.487 331 Y N 2.207 122.620 120.300 0.189 0.000 3.491 331 Y HA -0.270 4.790 4.550 0.849 0.000 0.215 331 Y C 1.518 177.569 175.900 0.252 0.000 1.219 331 Y CA 1.414 59.602 58.100 0.146 0.000 1.485 331 Y CB -1.807 36.711 38.460 0.097 0.000 1.450 331 Y HN 1.454 9.734 8.280 -0.000 0.000 0.603 332 G N -1.867 107.107 108.800 0.289 0.000 2.184 332 G HA2 -0.123 4.348 3.960 0.851 0.000 0.264 332 G HA3 -0.123 4.348 3.960 0.851 0.000 0.264 332 G C 0.537 175.721 174.900 0.474 0.000 0.975 332 G CA 0.202 45.444 45.100 0.237 0.000 0.642 332 G HN 1.415 9.705 8.290 -0.000 0.000 0.536 333 G N -0.110 108.941 108.800 0.417 0.000 2.372 333 G HA2 0.780 5.251 3.960 0.851 0.000 0.323 333 G HA3 0.780 5.251 3.960 0.851 0.000 0.323 333 G C 0.256 175.288 174.900 0.221 0.000 1.152 333 G CA 0.554 45.852 45.100 0.329 0.000 0.906 333 G HN 1.469 9.759 8.290 -0.000 0.000 0.460 334 A N 2.287 125.171 122.820 0.106 0.000 2.511 334 A HA 0.375 5.206 4.320 0.851 0.000 0.242 334 A C 0.956 178.386 177.584 -0.257 0.000 1.069 334 A CA -0.094 51.741 52.037 -0.337 0.000 0.763 334 A CB 0.461 19.346 19.000 -0.192 0.000 1.001 334 A HN 0.588 8.738 8.150 -0.000 0.000 0.498 335 Q N 1.154 120.717 119.800 -0.394 0.000 2.280 335 Q HA 0.031 4.881 4.340 0.851 0.000 0.201 335 Q C 0.066 175.951 176.000 -0.192 0.000 0.890 335 Q CA -0.017 55.598 55.803 -0.314 0.000 0.947 335 Q CB -0.035 28.344 28.738 -0.597 0.000 1.081 335 Q HN 0.910 9.180 8.270 -0.000 0.000 0.502 336 N N 1.448 120.049 118.700 -0.166 0.000 2.758 336 N HA -0.162 5.089 4.740 0.851 0.000 0.248 336 N C -0.541 174.940 175.510 -0.047 0.000 1.076 336 N CA 0.330 53.331 53.050 -0.082 0.000 0.696 336 N CB -0.340 38.125 38.487 -0.037 0.000 0.979 336 N HN 0.096 8.476 8.380 -0.000 0.000 0.550 337 R N 0.243 120.704 120.500 -0.066 0.000 2.552 337 R HA 0.493 5.344 4.340 0.851 0.000 0.314 337 R C 1.021 177.352 176.300 0.051 0.000 1.041 337 R CA 0.428 56.540 56.100 0.020 0.000 1.076 337 R CB -0.257 30.068 30.300 0.041 0.000 1.290 337 R HN 0.498 8.768 8.270 -0.000 0.000 0.563 338 G N 0.361 109.165 108.800 0.007 0.000 2.650 338 G HA2 -0.206 4.264 3.960 0.851 0.000 0.686 338 G HA3 -0.206 4.264 3.960 0.851 0.000 0.686 338 G C -0.145 174.756 174.900 0.002 0.000 1.205 338 G CA -0.960 44.146 45.100 0.009 0.000 0.781 338 G HN 0.206 8.496 8.290 -0.000 0.000 0.648 339 c N 1.325 119.908 118.600 -0.029 0.000 2.665 339 c HA 0.530 5.611 4.570 0.851 0.000 0.416 339 c C 1.887 175.931 174.090 -0.078 0.000 1.305 339 c CA 0.661 56.948 56.329 -0.071 0.000 1.903 339 c CB -0.209 42.240 42.510 -0.102 0.000 2.704 339 c HN 2.063 10.293 8.230 -0.000 0.000 0.629 340 A N 3.156 125.864 122.820 -0.187 0.000 2.584 340 A HA 0.450 5.281 4.320 0.851 0.000 0.239 340 A C 0.885 178.369 177.584 -0.165 0.000 1.043 340 A CA 0.743 52.643 52.037 -0.228 0.000 0.756 340 A CB -0.232 18.460 19.000 -0.513 0.000 0.963 340 A HN 1.184 9.334 8.150 -0.000 0.000 0.511 341 G N 1.118 109.858 108.800 -0.100 0.000 2.583 341 G HA2 0.452 4.923 3.960 0.851 0.000 0.280 341 G HA3 0.452 4.923 3.960 0.851 0.000 0.280 341 G C 0.365 175.243 174.900 -0.037 0.000 1.376 341 G CA -0.084 45.001 45.100 -0.026 0.000 1.043 341 G HN 0.686 8.976 8.290 -0.000 0.000 0.538 342 E N -0.442 119.781 120.200 0.039 0.000 2.106 342 E HA -0.008 4.853 4.350 0.851 0.000 0.192 342 E C 2.492 179.177 176.600 0.141 0.000 0.984 342 E CA 1.279 57.739 56.400 0.101 0.000 0.806 342 E CB -0.271 29.480 29.700 0.086 0.000 0.750 342 E HN 0.468 8.828 8.360 -0.000 0.000 0.458 343 G N 0.497 109.352 108.800 0.091 0.000 2.408 343 G HA2 -0.324 4.147 3.960 0.851 0.000 0.217 343 G HA3 -0.324 4.147 3.960 0.851 0.000 0.217 343 G C 1.513 176.365 174.900 -0.079 0.000 1.150 343 G CA 0.641 45.772 45.100 0.051 0.000 0.776 343 G HN 0.225 8.515 8.290 -0.000 0.000 0.542 344 Q N 0.147 119.676 119.800 -0.452 0.000 2.079 344 Q HA -0.057 4.794 4.340 0.851 0.000 0.200 344 Q C 2.457 178.353 176.000 -0.174 0.000 0.974 344 Q CA 1.234 56.607 55.803 -0.716 0.000 0.840 344 Q CB -0.097 27.787 28.738 -1.424 0.000 0.898 344 Q HN 0.413 8.683 8.270 -0.000 0.000 0.430 345 K N -0.097 120.284 120.400 -0.032 0.000 2.097 345 K HA -0.124 4.707 4.320 0.851 0.000 0.206 345 K C 2.032 178.690 176.600 0.097 0.000 1.049 345 K CA 1.043 57.418 56.287 0.146 0.000 0.933 345 K CB -0.128 32.475 32.500 0.172 0.000 0.717 345 K HN 0.220 8.470 8.250 -0.000 0.000 0.442 346 A N 1.630 124.485 122.820 0.059 0.000 1.877 346 A HA -0.112 4.719 4.320 0.851 0.000 0.216 346 A C 2.410 179.820 177.584 -0.290 0.000 1.186 346 A CA 1.792 53.679 52.037 -0.250 0.000 0.620 346 A CB -0.748 18.252 19.000 -0.001 0.000 0.822 346 A HN 0.318 8.468 8.150 -0.000 0.000 0.443 347 A N 0.382 123.125 122.820 -0.129 0.000 1.908 347 A HA -0.229 4.601 4.320 0.851 0.000 0.218 347 A C 1.894 179.413 177.584 -0.109 0.000 1.181 347 A CA 1.950 53.933 52.037 -0.091 0.000 0.627 347 A CB -0.669 18.353 19.000 0.036 0.000 0.818 347 A HN 0.552 8.702 8.150 -0.000 0.000 0.445 348 N N 0.255 118.911 118.700 -0.074 0.000 2.244 348 N HA -0.034 5.217 4.740 0.851 0.000 0.183 348 N C 1.799 177.234 175.510 -0.124 0.000 1.016 348 N CA 1.351 54.338 53.050 -0.104 0.000 0.866 348 N CB -0.544 37.934 38.487 -0.015 0.000 0.980 348 N HN 0.486 8.866 8.380 -0.000 0.000 0.430 349 A N 0.654 123.398 122.820 -0.127 0.000 1.898 349 A HA -0.059 4.772 4.320 0.851 0.000 0.216 349 A C 2.404 179.912 177.584 -0.128 0.000 1.181 349 A CA 1.141 53.105 52.037 -0.122 0.000 0.620 349 A CB -0.656 18.114 19.000 -0.384 0.000 0.819 349 A HN 0.096 8.246 8.150 -0.000 0.000 0.442 350 V N -0.026 119.756 119.914 -0.221 0.000 2.407 350 V HA -0.228 4.402 4.120 0.851 0.000 0.248 350 V C 2.983 178.961 176.094 -0.194 0.000 1.055 350 V CA 1.671 63.841 62.300 -0.216 0.000 1.049 350 V CB -1.272 30.353 31.823 -0.329 0.000 0.662 350 V HN 0.597 8.787 8.190 -0.000 0.000 0.455 351 A N 0.072 122.784 122.820 -0.180 0.000 2.024 351 A HA -0.173 4.658 4.320 0.851 0.000 0.220 351 A C 2.145 179.638 177.584 -0.151 0.000 1.164 351 A CA 1.604 53.538 52.037 -0.171 0.000 0.643 351 A CB -0.619 18.271 19.000 -0.184 0.000 0.806 351 A HN 0.559 8.709 8.150 -0.000 0.000 0.451 352 L N -0.762 120.392 121.223 -0.115 0.000 2.349 352 L HA -0.161 4.690 4.340 0.851 0.000 0.220 352 L C 2.031 178.930 176.870 0.048 0.000 1.130 352 L CA 0.567 55.384 54.840 -0.038 0.000 0.791 352 L CB -0.551 41.489 42.059 -0.032 0.000 0.918 352 L HN 0.385 8.615 8.230 -0.000 0.000 0.444 353 L N -0.313 120.875 121.223 -0.059 0.000 2.450 353 L HA -0.134 4.716 4.340 0.851 0.000 0.224 353 L C 2.225 179.006 176.870 -0.147 0.000 1.149 353 L CA 0.763 55.528 54.840 -0.126 0.000 0.816 353 L CB -0.437 41.497 42.059 -0.209 0.000 0.932 353 L HN 0.254 8.484 8.230 -0.000 0.000 0.449 354 A N -1.861 120.877 122.820 -0.136 0.000 2.431 354 A HA 0.154 4.985 4.320 0.851 0.000 0.239 354 A C 1.030 178.549 177.584 -0.108 0.000 1.230 354 A CA -0.098 51.836 52.037 -0.172 0.000 0.928 354 A CB 0.200 19.072 19.000 -0.214 0.000 1.006 354 A HN 0.188 8.338 8.150 -0.000 0.000 0.520 355 S N 0.268 115.962 115.700 -0.011 0.000 2.584 355 S HA 0.346 5.327 4.470 0.851 0.000 0.273 355 S C 1.145 175.827 174.600 0.137 0.000 1.311 355 S CA 0.556 58.783 58.200 0.046 0.000 1.034 355 S CB 0.711 63.947 63.200 0.059 0.000 0.939 355 S HN 0.624 8.934 8.310 -0.000 0.000 0.513 356 T N 0.715 115.320 114.554 0.084 0.000 3.132 356 T HA 0.294 5.154 4.350 0.851 0.000 0.274 356 T C -0.013 174.770 174.700 0.138 0.000 1.011 356 T CA -0.561 61.592 62.100 0.087 0.000 0.899 356 T CB -0.331 68.534 68.868 -0.004 0.000 1.089 356 T HN 0.451 8.691 8.240 -0.000 0.000 0.543 357 N N 1.092 119.888 118.700 0.159 0.000 2.564 357 N HA 0.547 5.798 4.740 0.851 0.000 0.248 357 N C 1.055 176.599 175.510 0.058 0.000 0.986 357 N CA -0.060 53.043 53.050 0.087 0.000 0.921 357 N CB 1.635 40.138 38.487 0.025 0.000 1.136 357 N HN 0.213 8.593 8.380 -0.000 0.000 0.509 358 A N 3.030 125.923 122.820 0.121 0.000 1.933 358 A HA -0.005 4.826 4.320 0.851 0.000 0.218 358 A C 1.880 179.424 177.584 -0.067 0.000 1.175 358 A CA 1.835 53.909 52.037 0.061 0.000 0.628 358 A CB -0.779 18.329 19.000 0.181 0.000 0.814 358 A HN 0.662 8.812 8.150 -0.000 0.000 0.444 359 G N -0.963 107.826 108.800 -0.018 0.000 2.421 359 G HA2 -0.247 4.223 3.960 0.851 0.000 0.216 359 G HA3 -0.247 4.223 3.960 0.851 0.000 0.216 359 G C 1.622 176.512 174.900 -0.015 0.000 1.171 359 G CA 1.021 46.110 45.100 -0.017 0.000 0.775 359 G HN 0.603 8.893 8.290 -0.000 0.000 0.543 360 Q N -0.006 119.797 119.800 0.005 0.000 2.050 360 Q HA -0.046 4.805 4.340 0.851 0.000 0.202 360 Q C 3.048 179.092 176.000 0.073 0.000 0.980 360 Q CA 1.358 57.225 55.803 0.107 0.000 0.840 360 Q CB -0.274 28.510 28.738 0.078 0.000 0.898 360 Q HN 0.474 8.744 8.270 -0.000 0.000 0.424 361 A N 1.136 123.826 122.820 -0.216 0.000 1.883 361 A HA -0.310 4.521 4.320 0.851 0.000 0.217 361 A C 1.985 179.468 177.584 -0.168 0.000 1.186 361 A CA 2.092 53.873 52.037 -0.426 0.000 0.624 361 A CB -1.748 16.384 19.000 -1.446 0.000 0.822 361 A HN 0.604 8.754 8.150 -0.000 0.000 0.444 362 N N -0.693 117.922 118.700 -0.141 0.000 2.069 362 N HA -0.123 5.127 4.740 0.851 0.000 0.191 362 N C 2.020 177.554 175.510 0.039 0.000 1.031 362 N CA 3.264 56.297 53.050 -0.028 0.000 0.852 362 N CB -1.079 37.390 38.487 -0.030 0.000 1.018 362 N HN 0.845 9.225 8.380 -0.000 0.000 0.423 363 E N -0.290 119.914 120.200 0.007 0.000 2.028 363 E HA 0.021 4.882 4.350 0.851 0.000 0.191 363 E C 1.841 178.400 176.600 -0.068 0.000 0.988 363 E CA 1.230 57.593 56.400 -0.062 0.000 0.799 363 E CB -0.918 28.682 29.700 -0.165 0.000 0.755 363 E HN 0.763 9.123 8.360 -0.000 0.000 0.447 364 F N -0.690 119.277 119.950 0.030 0.000 2.186 364 F HA 0.068 5.077 4.527 0.804 0.000 0.299 364 F C 2.208 178.066 175.800 0.097 0.000 1.090 364 F CA 1.423 59.456 58.000 0.055 0.000 1.307 364 F CB -0.317 38.687 39.000 0.007 0.000 1.019 364 F HN 0.293 8.593 8.300 -0.000 0.000 0.489 365 F N 1.134 121.178 119.950 0.156 0.000 2.113 365 F HA -0.180 4.858 4.527 0.852 0.000 0.297 365 F C 2.279 178.221 175.800 0.235 0.000 1.103 365 F CA 1.531 59.630 58.000 0.166 0.000 1.248 365 F CB -0.524 38.492 39.000 0.027 0.000 0.999 365 F HN -0.137 8.163 8.300 -0.000 0.000 0.475 366 N N 0.589 119.419 118.700 0.217 0.000 2.244 366 N HA -0.163 5.088 4.740 0.851 0.000 0.183 366 N C 1.680 177.234 175.510 0.072 0.000 1.016 366 N CA 1.420 54.563 53.050 0.155 0.000 0.866 366 N CB -0.367 38.207 38.487 0.144 0.000 0.980 366 N HN 0.521 8.901 8.380 -0.000 0.000 0.430 367 E N -0.183 120.044 120.200 0.045 0.000 2.153 367 E HA -0.157 4.704 4.350 0.851 0.000 0.194 367 E C 1.521 178.159 176.600 0.064 0.000 0.988 367 E CA 0.643 57.055 56.400 0.020 0.000 0.811 367 E CB -0.120 29.568 29.700 -0.021 0.000 0.746 367 E HN 0.307 8.667 8.360 -0.000 0.000 0.466 368 F N 0.250 120.161 119.950 -0.066 0.000 2.149 368 F HA -0.102 4.931 4.527 0.843 0.000 0.294 368 F C 1.951 177.719 175.800 -0.053 0.000 1.095 368 F CA 1.058 59.014 58.000 -0.073 0.000 1.276 368 F CB -0.283 38.624 39.000 -0.156 0.000 1.023 368 F HN 0.077 8.377 8.300 -0.000 0.000 0.480 369 W N 1.339 122.304 121.300 -0.559 0.000 2.465 369 W HA -0.114 5.052 4.660 0.844 0.000 0.268 369 W C 2.219 178.565 176.519 -0.287 0.000 1.242 369 W CA 1.534 58.553 57.345 -0.544 0.000 1.248 369 W CB -0.207 29.047 29.460 -0.344 0.000 1.118 369 W HN 0.306 8.486 8.180 -0.000 0.000 0.587 370 S N 0.166 115.811 115.700 -0.091 0.000 2.562 370 S HA 0.046 5.026 4.470 0.851 0.000 0.221 370 S C 0.799 175.307 174.600 -0.154 0.000 0.975 370 S CA -0.026 58.118 58.200 -0.094 0.000 0.918 370 S CB -0.607 62.582 63.200 -0.019 0.000 0.772 370 S HN 0.051 8.361 8.310 -0.000 0.000 0.531 371 L N 3.140 124.243 121.223 -0.199 0.000 2.439 371 L HA 0.283 5.134 4.340 0.851 0.000 0.269 371 L C 0.836 177.579 176.870 -0.211 0.000 1.179 371 L CA -0.552 54.187 54.840 -0.168 0.000 0.828 371 L CB 0.654 42.641 42.059 -0.120 0.000 1.106 371 L HN 0.320 8.550 8.230 -0.000 0.000 0.467 372 S N 1.366 116.949 115.700 -0.195 0.000 2.632 372 S HA 0.202 5.183 4.470 0.851 0.000 0.271 372 S C -0.350 174.013 174.600 -0.394 0.000 1.260 372 S CA -0.880 57.181 58.200 -0.232 0.000 1.010 372 S CB 1.308 64.410 63.200 -0.163 0.000 0.965 372 S HN 0.636 8.946 8.310 -0.000 0.000 0.534 373 Q N 0.998 120.527 119.800 -0.451 0.000 2.330 373 Q HA 0.187 5.038 4.340 0.851 0.000 0.279 373 Q C -2.407 173.320 176.000 -0.456 0.000 1.024 373 Q CA -1.454 53.911 55.803 -0.731 0.000 0.900 373 Q CB -0.024 28.490 28.738 -0.374 0.000 1.221 373 Q HN 0.386 8.656 8.270 -0.000 0.000 0.396 374 P HA -0.028 4.392 4.420 -0.000 0.000 0.265 374 P C -1.117 176.132 177.300 -0.085 0.000 1.193 374 P CA 0.324 63.315 63.100 -0.183 0.000 0.765 374 P CB 0.812 32.454 31.700 -0.096 0.000 0.823 375 T N -0.608 113.927 114.554 -0.031 0.000 2.831 375 T HA 0.782 5.642 4.350 0.851 0.000 0.287 375 T C 0.228 174.953 174.700 0.042 0.000 1.070 375 T CA -0.171 61.931 62.100 0.004 0.000 1.010 375 T CB 1.408 70.270 68.868 -0.010 0.000 1.264 375 T HN 0.699 8.939 8.240 -0.000 0.000 0.532 376 G N 0.631 109.455 108.800 0.040 0.000 2.693 376 G HA2 -0.163 4.308 3.960 0.851 0.000 0.226 376 G HA3 -0.163 4.308 3.960 0.851 0.000 0.226 376 G C -0.038 174.877 174.900 0.025 0.000 1.354 376 G CA 0.295 45.420 45.100 0.041 0.000 0.873 376 G HN 0.783 9.073 8.290 -0.000 0.000 0.562 377 D N -0.679 119.699 120.400 -0.037 0.000 2.312 377 D HA 0.051 5.202 4.640 0.851 0.000 0.211 377 D C 1.516 177.625 176.300 -0.319 0.000 0.964 377 D CA 1.284 55.156 54.000 -0.213 0.000 0.877 377 D CB -0.016 40.553 40.800 -0.385 0.000 0.924 377 D HN 0.413 8.783 8.370 -0.000 0.000 0.515 378 Y N 0.205 120.564 120.300 0.099 0.000 2.607 378 Y HA 0.165 5.230 4.550 0.860 0.000 0.266 378 Y C 1.812 177.814 175.900 0.171 0.000 1.178 378 Y CA -0.366 57.818 58.100 0.139 0.000 1.226 378 Y CB 0.047 38.590 38.460 0.138 0.000 1.144 378 Y HN -0.056 8.224 8.280 -0.000 0.000 0.528 379 R N -1.157 119.477 120.500 0.222 0.000 2.235 379 R HA -0.183 4.667 4.340 0.851 0.000 0.213 379 R C 1.605 178.045 176.300 0.234 0.000 1.059 379 R CA 1.082 57.296 56.100 0.191 0.000 0.997 379 R CB -0.917 29.454 30.300 0.118 0.000 0.884 379 R HN 0.416 8.686 8.270 -0.000 0.000 0.462 380 Y N 0.934 121.348 120.300 0.189 0.000 2.070 380 Y HA -0.323 4.738 4.550 0.852 0.000 0.280 380 Y C 2.025 178.134 175.900 0.349 0.000 1.148 380 Y CA 1.827 60.066 58.100 0.232 0.000 1.125 380 Y CB -0.585 37.991 38.460 0.194 0.000 0.975 380 Y HN 0.093 8.373 8.280 -0.000 0.000 0.492 381 Y N 1.032 121.345 120.300 0.021 0.000 2.243 381 Y HA -0.047 5.013 4.550 0.850 0.000 0.293 381 Y C 2.054 178.021 175.900 0.111 0.000 1.124 381 Y CA 1.733 59.792 58.100 -0.069 0.000 1.159 381 Y CB -0.898 37.651 38.460 0.148 0.000 1.008 381 Y HN 0.304 8.584 8.280 -0.000 0.000 0.527 382 N N -0.526 118.278 118.700 0.173 0.000 2.069 382 N HA -0.160 5.091 4.740 0.851 0.000 0.191 382 N C 2.024 177.592 175.510 0.096 0.000 1.031 382 N CA 1.416 54.540 53.050 0.124 0.000 0.852 382 N CB -0.600 37.996 38.487 0.181 0.000 1.018 382 N HN 0.448 8.828 8.380 -0.000 0.000 0.423 383 G N -0.326 108.531 108.800 0.095 0.000 2.403 383 G HA2 -0.149 4.321 3.960 0.851 0.000 0.216 383 G HA3 -0.149 4.321 3.960 0.851 0.000 0.216 383 G C 1.584 176.564 174.900 0.134 0.000 1.154 383 G CA 0.491 45.656 45.100 0.109 0.000 0.784 383 G HN 0.183 8.473 8.290 -0.000 0.000 0.538 384 S N 0.424 116.154 115.700 0.048 0.000 2.368 384 S HA 0.011 4.992 4.470 0.851 0.000 0.224 384 S C 2.280 176.872 174.600 -0.013 0.000 1.029 384 S CA 0.687 58.926 58.200 0.066 0.000 0.988 384 S CB -0.227 63.026 63.200 0.088 0.000 0.838 384 S HN 0.293 8.603 8.310 -0.000 0.000 0.462 385 L N -0.318 120.826 121.223 -0.132 0.000 2.093 385 L HA -0.099 4.752 4.340 0.851 0.000 0.208 385 L C 2.295 179.187 176.870 0.037 0.000 1.085 385 L CA 1.331 56.072 54.840 -0.164 0.000 0.755 385 L CB -0.540 41.369 42.059 -0.249 0.000 0.904 385 L HN 0.340 8.570 8.230 -0.000 0.000 0.435 386 Y N 0.429 120.755 120.300 0.043 0.000 2.165 386 Y HA -0.376 4.682 4.550 0.846 0.000 0.286 386 Y C 2.697 178.723 175.900 0.210 0.000 1.155 386 Y CA 2.091 60.302 58.100 0.186 0.000 1.164 386 Y CB -0.056 38.492 38.460 0.147 0.000 0.978 386 Y HN 0.111 8.391 8.280 -0.000 0.000 0.513 387 M N 0.022 119.798 119.600 0.293 0.000 2.086 387 M HA -0.199 4.792 4.480 0.851 0.000 0.261 387 M C 1.918 178.341 176.300 0.204 0.000 1.067 387 M CA 1.855 57.312 55.300 0.261 0.000 1.116 387 M CB -0.708 32.076 32.600 0.307 0.000 1.348 387 M HN 0.355 8.645 8.290 -0.000 0.000 0.407 388 L N -0.401 120.920 121.223 0.163 0.000 2.042 388 L HA -0.180 4.671 4.340 0.851 0.000 0.210 388 L C 2.576 179.555 176.870 0.182 0.000 1.076 388 L CA 1.269 56.217 54.840 0.179 0.000 0.749 388 L CB -1.204 40.909 42.059 0.089 0.000 0.893 388 L HN 0.467 8.697 8.230 -0.000 0.000 0.432 389 A N -0.587 122.282 122.820 0.080 0.000 1.902 389 A HA -0.213 4.618 4.320 0.851 0.000 0.217 389 A C 2.317 179.952 177.584 0.084 0.000 1.181 389 A CA 1.438 53.462 52.037 -0.020 0.000 0.623 389 A CB -0.383 18.387 19.000 -0.384 0.000 0.818 389 A HN 0.263 8.413 8.150 -0.000 0.000 0.443 390 M N -0.348 119.335 119.600 0.139 0.000 2.149 390 M HA -0.122 4.869 4.480 0.851 0.000 0.261 390 M C 2.118 178.564 176.300 0.243 0.000 1.064 390 M CA 1.358 56.796 55.300 0.230 0.000 1.102 390 M CB -1.349 31.318 32.600 0.111 0.000 1.369 390 M HN 0.432 8.722 8.290 -0.000 0.000 0.408 391 L N -1.647 119.699 121.223 0.206 0.000 2.027 391 L HA -0.235 4.616 4.340 0.851 0.000 0.206 391 L C 2.596 179.590 176.870 0.206 0.000 1.074 391 L CA 1.060 56.018 54.840 0.196 0.000 0.745 391 L CB -1.068 41.118 42.059 0.212 0.000 0.898 391 L HN 0.340 8.570 8.230 -0.000 0.000 0.433 392 H N -0.314 118.890 119.070 0.223 0.000 2.421 392 H HA -0.083 4.984 4.556 0.853 0.000 0.298 392 H C 2.084 177.490 175.328 0.130 0.000 1.087 392 H CA 1.984 58.120 56.048 0.147 0.000 1.330 392 H CB 0.061 29.801 29.762 -0.038 0.000 1.388 392 H HN 0.351 8.631 8.280 -0.000 0.000 0.526 393 V N -0.381 119.696 119.914 0.273 0.000 3.649 393 V HA 0.117 4.748 4.120 0.851 0.000 0.275 393 V C 1.426 177.655 176.094 0.226 0.000 1.281 393 V CA 0.938 63.387 62.300 0.249 0.000 1.143 393 V CB 0.018 32.087 31.823 0.411 0.000 0.892 393 V HN 0.311 8.501 8.190 -0.000 0.000 0.441 394 S N -0.915 114.924 115.700 0.232 0.000 2.629 394 S HA 0.500 5.481 4.470 0.851 0.000 0.236 394 S C 1.529 176.221 174.600 0.154 0.000 1.010 394 S CA 0.519 58.835 58.200 0.193 0.000 0.981 394 S CB 0.379 63.721 63.200 0.237 0.000 0.919 394 S HN 1.755 10.066 8.310 -0.000 0.000 0.514 395 G N 1.740 110.651 108.800 0.186 0.000 2.153 395 G HA2 -0.312 4.159 3.960 0.851 0.000 0.252 395 G HA3 -0.312 4.159 3.960 0.851 0.000 0.252 395 G C 0.354 175.304 174.900 0.084 0.000 0.994 395 G CA 0.442 45.660 45.100 0.197 0.000 0.698 395 G HN 0.615 8.905 8.290 -0.000 0.000 0.521 396 N N -1.129 117.633 118.700 0.103 0.000 2.254 396 N HA 0.280 5.530 4.740 0.851 0.000 0.190 396 N C 0.218 175.739 175.510 0.019 0.000 1.107 396 N CA -0.287 52.782 53.050 0.032 0.000 0.869 396 N CB 0.263 38.788 38.487 0.064 0.000 0.983 396 N HN 0.343 8.723 8.380 -0.000 0.000 0.487 397 F N 2.567 122.485 119.950 -0.054 0.000 2.377 397 F HA 0.337 5.377 4.527 0.855 0.000 0.360 397 F C -0.201 175.563 175.800 -0.060 0.000 1.147 397 F CA -0.480 57.490 58.000 -0.049 0.000 1.170 397 F CB -0.024 38.835 39.000 -0.234 0.000 1.339 397 F HN -0.293 8.007 8.300 -0.000 0.000 0.552 398 K N 4.630 124.923 120.400 -0.179 0.000 2.340 398 K HA 0.469 5.300 4.320 0.851 0.000 0.244 398 K C -1.429 175.122 176.600 -0.082 0.000 0.973 398 K CA -0.983 55.066 56.287 -0.397 0.000 0.828 398 K CB 2.020 33.948 32.500 -0.952 0.000 1.226 398 K HN 0.145 8.395 8.250 -0.000 0.000 0.437 399 F N 1.842 121.609 119.950 -0.305 0.000 2.405 399 F HA 0.287 5.324 4.527 0.850 0.000 0.355 399 F C -0.371 175.234 175.800 -0.325 0.000 1.121 399 F CA -1.098 56.657 58.000 -0.408 0.000 1.112 399 F CB 0.305 39.008 39.000 -0.495 0.000 1.126 399 F HN 0.334 8.634 8.300 -0.000 0.000 0.481 400 Y N 2.677 122.973 120.300 -0.006 0.000 2.491 400 Y HA 0.282 5.342 4.550 0.851 0.000 0.334 400 Y C 0.584 176.590 175.900 0.176 0.000 0.969 400 Y CA -0.806 57.310 58.100 0.025 0.000 1.241 400 Y CB 0.374 38.719 38.460 -0.192 0.000 1.105 400 Y HN 0.406 8.686 8.280 -0.000 0.000 0.503 401 N N 2.434 121.337 118.700 0.337 0.000 2.508 401 N HA 0.052 5.303 4.740 0.851 0.000 0.264 401 N C -0.397 175.136 175.510 0.038 0.000 1.216 401 N CA -0.177 53.020 53.050 0.244 0.000 0.943 401 N CB 0.483 39.117 38.487 0.244 0.000 1.113 401 N HN 0.653 9.033 8.380 -0.000 0.000 0.447 402 N N -0.779 117.861 118.700 -0.100 0.000 2.467 402 N HA 0.189 5.440 4.740 0.851 0.000 0.262 402 N C -0.284 174.868 175.510 -0.597 0.000 1.234 402 N CA 0.003 52.819 53.050 -0.389 0.000 0.952 402 N CB 0.627 38.784 38.487 -0.551 0.000 1.158 402 N HN 0.444 8.824 8.380 -0.000 0.000 0.463 403 T N -1.064 113.097 114.554 -0.653 0.000 2.797 403 T HA 0.610 5.471 4.350 0.851 0.000 0.279 403 T C -0.594 173.702 174.700 -0.673 0.000 0.991 403 T CA -0.660 61.148 62.100 -0.487 0.000 0.979 403 T CB 0.205 68.934 68.868 -0.231 0.000 0.943 403 T HN 0.191 8.431 8.240 -0.000 0.000 0.444 404 F N 0.000 119.917 119.950 -0.054 0.000 2.286 404 F HA 0.000 5.037 4.527 0.851 0.000 0.279 404 F CA 0.000 57.963 58.000 -0.062 0.000 1.383 404 F CB 0.000 38.971 39.000 -0.048 0.000 1.145 404 F HN 0.000 8.300 8.300 -0.000 0.000 0.574