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 3olz_1_B DATA FIRST_RESID 3 DATA SEQUENCE HVIRIGGIFE YADGPNAQVM NAEEHAFRFS ANIINRNRTL LPNTTLTYDI DATA SEQUENCE QRIHFHDSFE ATKKAcDQLA LGVVAIFGPS QGSCTNAVQS ICNALEVPHI DATA SEQUENCE QLRWKHHPLD NKDTFYVNLY PDYASLSHAI LDLVQSLKWR SATVVYDDST DATA SEQUENCE GLIRLQELIM APSRYNIRLK IRQLPIDSDD SRPLLKEMKR GREFRIIFDC DATA SEQUENCE SHTMAAQILK QAMAMGMMTE YYHFIFTTLD LYALDLEPYR YSGVNLTGFR DATA SEQUENCE ILNVDNPHVS AIVEKWSMER XXXXXXXXXX XXDGVMMTDA ALLYDAVHIV DATA SEQUENCE SVCYQRAPQM TVNSLQcHRH KAWRFGGRFM NFIKEAQWEG LTGRIVFNKT DATA SEQUENCE SGLRTDFDLD IISLKEDGLE KVGVWSPADG LNI 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 3 H HA 0.000 4.538 4.556 -0.030 0.000 0.296 3 H C 0.000 175.296 175.328 -0.054 0.000 0.993 3 H CA 0.000 56.029 56.048 -0.031 0.000 1.023 3 H CB 0.000 29.754 29.762 -0.013 0.000 1.292 4 V N 3.639 123.190 119.914 -0.606 0.000 2.668 4 V HA 0.428 4.565 4.120 -0.258 -0.172 0.304 4 V C -1.833 173.994 176.094 -0.444 0.000 1.071 4 V CA -1.065 61.003 62.300 -0.387 0.000 0.894 4 V CB 2.729 34.390 31.823 -0.271 0.000 1.008 4 V HN 0.269 7.769 8.190 -1.150 0.000 0.425 5 I N 1.527 121.902 120.570 -0.324 0.000 2.562 5 I HA 0.472 4.456 4.170 -0.310 0.000 0.301 5 I C -2.852 173.128 176.117 -0.229 0.000 1.003 5 I CA -1.374 59.729 61.300 -0.329 0.000 1.127 5 I CB 3.434 41.109 38.000 -0.542 0.000 1.304 5 I HN 0.023 8.067 8.210 -0.277 0.000 0.446 6 R N 5.480 125.879 120.500 -0.168 0.000 2.476 6 R HA 0.691 5.186 4.340 -0.088 -0.208 0.305 6 R C -1.113 175.192 176.300 0.008 0.000 0.965 6 R CA -1.384 54.664 56.100 -0.087 0.000 0.867 6 R CB 2.610 32.856 30.300 -0.090 0.000 1.176 6 R HN 0.312 8.479 8.270 -0.171 0.000 0.447 7 I N 2.007 122.635 120.570 0.097 0.000 2.437 7 I HA 0.743 5.176 4.170 0.259 -0.108 0.298 7 I C -1.498 174.819 176.117 0.334 0.000 0.984 7 I CA -2.411 59.042 61.300 0.256 0.000 1.214 7 I CB 1.985 40.171 38.000 0.310 0.000 1.365 7 I HN 0.319 8.575 8.210 0.077 0.000 0.469 8 G N 1.739 110.748 108.800 0.348 0.000 2.348 8 G HA2 0.489 4.736 3.960 0.262 0.000 0.312 8 G HA3 0.489 4.686 3.960 0.189 -0.124 0.312 8 G C -1.935 173.130 174.900 0.276 0.000 1.126 8 G CA -1.477 43.788 45.100 0.275 0.000 0.865 8 G HN 0.087 8.589 8.290 0.353 0.000 0.474 9 G N 1.392 110.252 108.800 0.100 0.000 2.590 9 G HA2 0.899 4.575 3.960 -0.473 0.000 0.310 9 G HA3 0.899 4.491 3.960 -0.613 0.000 0.310 9 G C -2.655 172.032 174.900 -0.355 0.000 1.347 9 G CA -1.201 43.677 45.100 -0.369 0.000 0.963 9 G HN 0.079 8.473 8.290 0.173 0.000 0.494 10 I N 3.828 123.987 120.570 -0.685 0.000 2.410 10 I HA 0.620 4.838 4.170 -0.212 -0.175 0.286 10 I C -1.788 173.873 176.117 -0.760 0.000 1.009 10 I CA -1.023 60.002 61.300 -0.458 0.000 1.111 10 I CB 2.194 40.047 38.000 -0.246 0.000 1.262 10 I HN -0.028 7.699 8.210 -0.805 0.000 0.443 11 F N 5.973 125.861 119.950 -0.104 0.000 2.546 11 F HA 0.426 4.841 4.527 -0.187 0.000 0.320 11 F C -1.378 174.290 175.800 -0.220 0.000 1.076 11 F CA -1.607 56.299 58.000 -0.156 0.000 0.928 11 F CB 3.937 42.872 39.000 -0.109 0.000 1.189 11 F HN 0.382 8.766 8.300 0.139 0.000 0.465 12 E N 0.046 120.065 120.200 -0.302 0.000 2.191 12 E HA 0.508 4.775 4.350 -0.440 -0.181 0.278 12 E C -1.134 174.824 176.600 -1.071 0.000 0.972 12 E CA -0.981 55.016 56.400 -0.673 0.000 0.804 12 E CB 2.382 31.528 29.700 -0.924 0.000 1.110 12 E HN 0.130 8.316 8.360 -0.290 0.000 0.394 13 Y N 1.506 121.389 120.300 -0.697 0.000 2.553 13 Y HA 0.126 4.576 4.550 -0.166 0.000 0.347 13 Y C -0.472 175.395 175.900 -0.055 0.000 1.019 13 Y CA -1.041 56.879 58.100 -0.301 0.000 1.032 13 Y CB 3.059 41.428 38.460 -0.152 0.000 1.284 13 Y HN 0.571 8.585 8.280 -0.442 0.000 0.466 14 A N 1.379 124.486 122.820 0.478 0.000 1.930 14 A HA -0.195 4.518 4.320 0.654 0.000 0.217 14 A C 0.157 177.979 177.584 0.398 0.000 1.175 14 A CA 2.706 55.044 52.037 0.501 0.000 0.627 14 A CB -0.475 18.750 19.000 0.376 0.000 0.815 14 A HN 0.501 8.956 8.150 0.509 0.000 0.443 15 D N -3.609 116.938 120.400 0.244 0.000 2.339 15 D HA 0.005 4.819 4.640 0.289 0.000 0.217 15 D C 0.610 176.826 176.300 -0.141 0.000 1.050 15 D CA -0.079 54.020 54.000 0.164 0.000 0.856 15 D CB 0.307 41.155 40.800 0.079 0.000 0.922 15 D HN -0.067 8.444 8.370 0.234 0.000 0.518 16 G N 0.123 108.625 108.800 -0.497 0.000 2.556 16 G HA2 -0.354 3.309 3.960 -0.732 0.000 0.283 16 G HA3 -0.354 2.549 3.960 -1.761 0.000 0.283 16 G C -1.602 173.065 174.900 -0.388 0.000 1.177 16 G CA 0.520 45.061 45.100 -0.931 0.000 0.978 16 G HN -0.716 7.266 8.290 -0.197 0.190 0.554 17 P HA -0.219 4.092 4.420 -0.181 0.000 0.217 17 P C 0.137 177.329 177.300 -0.179 0.000 1.150 17 P CA 2.347 65.335 63.100 -0.187 0.000 0.832 17 P CB 0.114 31.747 31.700 -0.112 0.000 0.787 18 N N -3.937 114.680 118.700 -0.138 0.000 2.364 18 N HA -0.256 4.437 4.740 -0.077 0.000 0.183 18 N C -0.141 175.294 175.510 -0.124 0.000 1.022 18 N CA 0.735 53.731 53.050 -0.089 0.000 0.883 18 N CB -0.421 38.053 38.487 -0.021 0.000 0.965 18 N HN -0.495 7.787 8.380 -0.133 0.018 0.438 19 A N -1.259 121.440 122.820 -0.201 0.000 2.603 19 A HA -0.290 3.954 4.320 -0.126 0.000 0.235 19 A C -0.371 177.071 177.584 -0.236 0.000 1.035 19 A CA 1.055 52.944 52.037 -0.247 0.000 0.755 19 A CB 0.526 19.191 19.000 -0.557 0.000 0.954 19 A HN -0.812 7.157 8.150 -0.233 0.042 0.511 20 Q N 2.385 122.103 119.800 -0.137 0.000 2.226 20 Q HA -0.133 4.143 4.340 -0.106 0.000 0.199 20 Q C 0.057 175.999 176.000 -0.096 0.000 0.945 20 Q CA 1.502 57.246 55.803 -0.098 0.000 0.861 20 Q CB 0.929 29.640 28.738 -0.045 0.000 0.953 20 Q HN 0.364 8.579 8.270 -0.091 0.000 0.490 21 V N -1.048 118.827 119.914 -0.065 0.000 2.427 21 V HA 0.023 4.135 4.120 -0.013 0.000 0.286 21 V C -0.762 175.350 176.094 0.030 0.000 1.034 21 V CA -1.042 61.255 62.300 -0.005 0.000 0.893 21 V CB 0.770 32.622 31.823 0.049 0.000 0.982 21 V HN -0.368 7.792 8.190 -0.050 0.000 0.452 22 M N 5.717 125.346 119.600 0.047 0.000 2.250 22 M HA -0.248 4.328 4.480 0.161 0.000 0.337 22 M C -0.229 176.219 176.300 0.246 0.000 1.161 22 M CA 0.745 56.127 55.300 0.138 0.000 1.088 22 M CB 0.652 33.294 32.600 0.071 0.000 1.639 22 M HN 0.171 8.473 8.290 0.020 0.000 0.447 23 N N 2.208 121.094 118.700 0.310 0.000 2.447 23 N HA 0.162 5.012 4.740 0.184 0.000 0.271 23 N C 0.183 175.790 175.510 0.160 0.000 1.226 23 N CA -0.690 52.464 53.050 0.174 0.000 0.980 23 N CB 0.720 39.211 38.487 0.007 0.000 1.206 23 N HN -0.114 8.506 8.380 0.401 0.000 0.558 24 A N -1.884 121.036 122.820 0.167 0.000 1.917 24 A HA -0.303 4.211 4.320 0.323 0.000 0.219 24 A C 2.132 179.865 177.584 0.249 0.000 1.182 24 A CA 3.311 55.503 52.037 0.259 0.000 0.633 24 A CB -0.276 18.867 19.000 0.239 0.000 0.819 24 A HN 0.463 8.699 8.150 0.143 0.000 0.448 25 E N -1.392 118.885 120.200 0.128 0.000 2.015 25 E HA -0.396 4.039 4.350 0.143 0.000 0.191 25 E C 2.097 178.673 176.600 -0.040 0.000 0.991 25 E CA 3.053 59.523 56.400 0.116 0.000 0.802 25 E CB -0.180 29.646 29.700 0.209 0.000 0.759 25 E HN -0.435 8.096 8.360 0.100 -0.111 0.447 26 E N -0.697 119.225 120.200 -0.463 0.000 2.118 26 E HA -0.425 2.928 4.350 -1.661 0.000 0.195 26 E C 1.999 178.491 176.600 -0.181 0.000 0.992 26 E CA 2.936 58.781 56.400 -0.924 0.000 0.804 26 E CB -0.080 29.080 29.700 -0.901 0.000 0.741 26 E HN -0.365 8.060 8.360 -0.400 -0.306 0.458 27 H N 1.025 120.088 119.070 -0.012 0.000 2.293 27 H HA -0.270 4.362 4.556 0.126 0.000 0.300 27 H C 1.786 177.314 175.328 0.333 0.000 1.082 27 H CA 3.131 59.288 56.048 0.183 0.000 1.308 27 H CB 0.378 30.302 29.762 0.270 0.000 1.375 27 H HN -0.546 7.840 8.280 0.188 0.006 0.495 28 A N -1.469 121.642 122.820 0.484 0.000 2.024 28 A HA -0.347 4.156 4.320 0.305 0.000 0.220 28 A C 1.933 179.709 177.584 0.321 0.000 1.164 28 A CA 2.833 55.013 52.037 0.237 0.000 0.643 28 A CB -1.041 17.851 19.000 -0.180 0.000 0.806 28 A HN -0.046 8.346 8.150 0.404 0.000 0.451 29 F N 0.462 120.439 119.950 0.045 0.000 2.060 29 F HA -0.283 4.191 4.527 -0.087 0.000 0.295 29 F C 1.563 177.244 175.800 -0.199 0.000 1.120 29 F CA 3.123 61.065 58.000 -0.097 0.000 1.205 29 F CB 0.137 39.065 39.000 -0.120 0.000 0.986 29 F HN -0.207 8.171 8.300 0.311 0.108 0.470 30 R N -1.640 118.766 120.500 -0.155 0.000 2.081 30 R HA -0.449 3.463 4.340 -0.714 0.000 0.235 30 R C 2.586 178.898 176.300 0.019 0.000 1.131 30 R CA 3.403 59.327 56.100 -0.294 0.000 0.960 30 R CB -0.248 29.954 30.300 -0.162 0.000 0.856 30 R HN -0.445 7.816 8.270 -0.014 0.000 0.436 31 F N 0.748 120.761 119.950 0.105 0.000 2.126 31 F HA -0.351 4.318 4.527 0.237 0.000 0.299 31 F C 1.148 177.032 175.800 0.139 0.000 1.096 31 F CA 3.236 61.383 58.000 0.246 0.000 1.255 31 F CB 0.265 39.594 39.000 0.547 0.000 0.997 31 F HN 0.441 9.033 8.300 0.487 0.000 0.479 32 S N -0.193 115.478 115.700 -0.048 0.000 2.377 32 S HA -0.314 3.900 4.470 -0.426 0.000 0.223 32 S C 1.998 176.387 174.600 -0.352 0.000 1.030 32 S CA 2.794 60.820 58.200 -0.290 0.000 0.970 32 S CB -0.729 62.319 63.200 -0.253 0.000 0.830 32 S HN -0.406 7.965 8.310 0.102 0.000 0.473 33 A N 2.551 125.167 122.820 -0.340 0.000 1.948 33 A HA -0.408 3.726 4.320 -0.310 0.000 0.220 33 A C 1.786 179.274 177.584 -0.159 0.000 1.177 33 A CA 3.114 54.995 52.037 -0.260 0.000 0.636 33 A CB -0.641 18.276 19.000 -0.139 0.000 0.815 33 A HN -0.387 7.528 8.150 -0.391 0.000 0.449 34 N N -2.345 116.285 118.700 -0.117 0.000 2.142 34 N HA -0.252 4.458 4.740 -0.049 0.000 0.186 34 N C 2.298 177.729 175.510 -0.132 0.000 1.023 34 N CA 2.840 55.840 53.050 -0.083 0.000 0.852 34 N CB -0.156 38.316 38.487 -0.024 0.000 0.998 34 N HN -0.653 7.648 8.380 -0.115 0.010 0.424 35 I N -4.487 115.948 120.570 -0.224 0.000 2.394 35 I HA -0.349 3.753 4.170 -0.113 0.000 0.251 35 I C 1.596 177.646 176.117 -0.113 0.000 1.136 35 I CA 3.102 64.302 61.300 -0.165 0.000 1.425 35 I CB -0.460 37.427 38.000 -0.188 0.000 1.079 35 I HN -0.817 7.209 8.210 -0.308 0.000 0.425 36 I N -3.987 116.460 120.570 -0.204 0.000 2.500 36 I HA -0.338 3.751 4.170 -0.136 0.000 0.252 36 I C 0.551 176.600 176.117 -0.113 0.000 1.142 36 I CA 2.930 64.113 61.300 -0.195 0.000 1.451 36 I CB 0.012 37.802 38.000 -0.350 0.000 1.093 36 I HN -0.751 7.299 8.210 -0.267 0.000 0.430 37 N N -1.749 116.885 118.700 -0.111 0.000 2.453 37 N HA -0.201 4.496 4.740 -0.072 0.000 0.183 37 N C 0.655 176.139 175.510 -0.043 0.000 1.041 37 N CA 1.909 54.914 53.050 -0.075 0.000 0.900 37 N CB 0.044 38.484 38.487 -0.078 0.000 0.961 37 N HN -0.682 7.619 8.380 -0.131 0.000 0.443 38 R N -4.216 116.264 120.500 -0.034 0.000 2.308 38 R HA 0.049 4.386 4.340 -0.004 0.000 0.202 38 R C -0.864 175.444 176.300 0.014 0.000 0.898 38 R CA 0.072 56.168 56.100 -0.006 0.000 1.046 38 R CB 0.595 30.897 30.300 0.003 0.000 1.026 38 R HN -0.835 7.250 8.270 -0.048 0.156 0.512 39 N N -0.599 118.109 118.700 0.013 0.000 2.401 39 N HA -0.106 4.669 4.740 0.058 0.000 0.255 39 N C 0.558 176.087 175.510 0.032 0.000 1.110 39 N CA -0.298 52.777 53.050 0.043 0.000 0.949 39 N CB -0.384 38.143 38.487 0.067 0.000 1.110 39 N HN -0.871 7.379 8.380 -0.007 0.127 0.490 40 R N 6.034 126.555 120.500 0.036 0.000 2.299 40 R HA 0.049 4.401 4.340 0.021 0.000 0.197 40 R C 0.882 177.204 176.300 0.036 0.000 0.971 40 R CA 0.875 56.992 56.100 0.028 0.000 1.030 40 R CB -0.323 29.992 30.300 0.024 0.000 0.932 40 R HN 0.588 8.882 8.270 0.040 0.000 0.477 41 T N -1.608 112.978 114.554 0.052 0.000 3.107 41 T HA -0.103 4.279 4.350 0.053 0.000 0.249 41 T C -0.869 173.878 174.700 0.079 0.000 1.096 41 T CA 1.329 63.467 62.100 0.064 0.000 1.012 41 T CB 0.424 69.338 68.868 0.076 0.000 0.977 41 T HN -0.251 8.246 8.240 0.060 -0.222 0.527 42 L N 1.298 122.561 121.223 0.067 0.000 2.438 42 L HA 0.283 4.810 4.340 0.075 -0.142 0.270 42 L C -1.322 175.561 176.870 0.021 0.000 0.972 42 L CA -0.876 54.000 54.840 0.061 0.000 0.831 42 L CB 3.011 45.117 42.059 0.079 0.000 1.273 42 L HN -0.807 7.347 8.230 0.054 0.108 0.405 43 L N 3.068 124.308 121.223 0.028 0.000 3.995 43 L HA -0.296 4.072 4.340 0.046 0.000 0.513 43 L C -1.568 175.310 176.870 0.013 0.000 1.147 43 L CA -0.000 54.855 54.840 0.025 0.000 0.703 43 L CB -1.824 40.234 42.059 -0.002 0.000 1.306 43 L HN -0.033 8.410 8.230 0.043 -0.187 0.779 44 P HA -0.105 4.322 4.420 0.012 0.000 0.214 44 P C 0.550 177.856 177.300 0.010 0.000 1.162 44 P CA 2.349 65.457 63.100 0.014 0.000 0.879 44 P CB 0.385 32.096 31.700 0.017 0.000 0.786 45 N N -3.029 115.679 118.700 0.014 0.000 2.275 45 N HA 0.141 4.887 4.740 0.011 0.000 0.236 45 N C -1.266 174.265 175.510 0.035 0.000 1.154 45 N CA 0.172 53.231 53.050 0.015 0.000 0.866 45 N CB 1.039 39.530 38.487 0.007 0.000 1.093 45 N HN 0.073 8.463 8.380 0.016 0.000 0.515 46 T N 0.425 115.003 114.554 0.041 0.000 2.893 46 T HA 0.178 4.590 4.350 0.104 0.000 0.291 46 T C -1.470 173.230 174.700 0.000 0.000 1.028 46 T CA -0.649 61.494 62.100 0.072 0.000 0.995 46 T CB 2.523 71.477 68.868 0.143 0.000 1.051 46 T HN -0.681 7.520 8.240 0.030 0.057 0.470 47 T N 6.151 120.683 114.554 -0.036 0.000 2.791 47 T HA 0.244 4.675 4.350 -0.080 -0.129 0.288 47 T C -1.408 173.208 174.700 -0.139 0.000 0.999 47 T CA -0.281 61.767 62.100 -0.087 0.000 0.952 47 T CB 1.553 70.367 68.868 -0.090 0.000 0.938 47 T HN 0.078 8.299 8.240 -0.031 0.000 0.444 48 L N 9.855 130.990 121.223 -0.148 0.000 2.360 48 L HA 0.109 4.461 4.340 -0.192 -0.128 0.276 48 L C -1.368 175.393 176.870 -0.182 0.000 1.121 48 L CA -0.238 54.499 54.840 -0.172 0.000 0.845 48 L CB 0.491 42.447 42.059 -0.172 0.000 1.143 48 L HN 0.026 8.429 8.230 -0.132 -0.253 0.452 49 T N 3.974 118.410 114.554 -0.198 0.000 2.888 49 T HA 0.307 4.391 4.350 -0.442 0.000 0.288 49 T C -2.324 172.268 174.700 -0.179 0.000 1.063 49 T CA -2.078 59.837 62.100 -0.308 0.000 1.010 49 T CB 2.441 71.130 68.868 -0.299 0.000 1.214 49 T HN 0.539 8.671 8.240 -0.181 0.000 0.533 50 Y N -4.684 115.572 120.300 -0.072 0.000 2.571 50 Y HA 0.887 5.657 4.550 0.028 -0.204 0.341 50 Y C -1.783 174.156 175.900 0.065 0.000 1.076 50 Y CA -2.139 55.969 58.100 0.014 0.000 1.029 50 Y CB 2.741 41.217 38.460 0.027 0.000 1.308 50 Y HN -0.100 7.726 8.280 -0.757 0.000 0.461 51 D N 0.430 121.014 120.400 0.307 0.000 2.163 51 D HA 0.271 5.028 4.640 0.194 0.000 0.248 51 D C -1.230 175.263 176.300 0.321 0.000 1.035 51 D CA -1.157 52.983 54.000 0.233 0.000 0.872 51 D CB 3.239 44.111 40.800 0.120 0.000 1.183 51 D HN 0.141 8.692 8.370 0.302 0.000 0.445 52 I N 2.114 122.844 120.570 0.267 0.000 2.499 52 I HA 0.303 4.822 4.170 0.294 -0.173 0.288 52 I C -1.145 175.074 176.117 0.169 0.000 1.048 52 I CA -1.017 60.444 61.300 0.268 0.000 1.062 52 I CB 2.906 41.078 38.000 0.287 0.000 1.238 52 I HN -0.037 8.302 8.210 0.215 0.000 0.426 53 Q N 6.338 126.231 119.800 0.155 0.000 2.333 53 Q HA 0.418 4.795 4.340 0.061 0.000 0.267 53 Q C -1.776 174.299 176.000 0.126 0.000 1.012 53 Q CA -2.379 53.475 55.803 0.085 0.000 0.824 53 Q CB 3.129 31.881 28.738 0.024 0.000 1.290 53 Q HN 0.453 8.825 8.270 0.170 0.000 0.449 54 R N 2.324 122.866 120.500 0.071 0.000 2.532 54 R HA 0.849 5.510 4.340 0.230 -0.183 0.295 54 R C -0.522 175.773 176.300 -0.007 0.000 0.968 54 R CA -0.723 55.435 56.100 0.097 0.000 0.916 54 R CB 1.947 32.220 30.300 -0.045 0.000 1.124 54 R HN 0.402 8.685 8.270 0.022 0.000 0.463 55 I N -4.906 115.654 120.570 -0.017 0.000 3.279 55 I HA 0.605 4.695 4.170 -0.133 0.000 0.315 55 I C -2.114 173.897 176.117 -0.177 0.000 1.187 55 I CA -2.364 58.874 61.300 -0.105 0.000 0.953 55 I CB 4.060 42.022 38.000 -0.063 0.000 1.279 55 I HN 0.192 8.428 8.210 0.043 0.000 0.465 56 H N -0.450 118.606 119.070 -0.023 0.000 2.551 56 H HA 0.492 5.272 4.556 -0.012 -0.231 0.358 56 H C 0.742 176.037 175.328 -0.056 0.000 1.151 56 H CA -0.143 55.902 56.048 -0.005 0.000 1.374 56 H CB 1.412 31.224 29.762 0.083 0.000 1.473 56 H HN -0.335 8.261 8.280 0.048 -0.288 0.574 57 F N -1.113 118.947 119.950 0.183 0.000 2.595 57 F HA -0.382 4.266 4.527 -0.059 -0.157 0.359 57 F C 0.590 176.447 175.800 0.096 0.000 1.147 57 F CA 2.081 60.099 58.000 0.030 0.000 1.341 57 F CB 0.298 39.307 39.000 0.015 0.000 1.104 57 F HN -0.144 8.364 8.300 0.346 0.000 0.603 58 H N -1.980 117.245 119.070 0.258 0.000 2.713 58 H HA -0.349 4.284 4.556 0.128 0.000 0.311 58 H C -1.270 174.134 175.328 0.127 0.000 1.175 58 H CA 1.622 57.766 56.048 0.159 0.000 1.143 58 H CB -2.243 27.605 29.762 0.143 0.000 1.434 58 H HN 0.165 8.540 8.280 -0.100 -0.155 0.418 59 D N -0.526 119.983 120.400 0.182 0.000 2.412 59 D HA 0.243 4.990 4.640 0.178 0.000 0.276 59 D C -0.343 176.031 176.300 0.124 0.000 1.196 59 D CA -1.054 53.044 54.000 0.163 0.000 0.905 59 D CB 0.303 41.208 40.800 0.174 0.000 1.081 59 D HN -0.587 7.860 8.370 0.129 0.000 0.502 60 S N 5.064 120.842 115.700 0.131 0.000 2.399 60 S HA -0.288 4.220 4.470 0.064 0.000 0.231 60 S C 1.269 175.964 174.600 0.157 0.000 1.022 60 S CA 3.210 61.472 58.200 0.105 0.000 0.983 60 S CB -0.071 63.184 63.200 0.091 0.000 0.803 60 S HN 0.393 8.786 8.310 0.140 0.000 0.480 61 F N 3.471 123.431 119.950 0.017 0.000 2.075 61 F HA -0.315 4.214 4.527 0.003 0.000 0.297 61 F C 1.123 176.929 175.800 0.009 0.000 1.113 61 F CA 1.627 59.633 58.000 0.011 0.000 1.218 61 F CB -0.350 38.660 39.000 0.017 0.000 0.984 61 F HN -0.502 8.035 8.300 0.319 -0.046 0.472 62 E N -1.299 118.863 120.200 -0.063 0.000 2.038 62 E HA -0.539 3.635 4.350 -0.294 0.000 0.195 62 E C 2.242 178.769 176.600 -0.122 0.000 1.000 62 E CA 3.116 59.422 56.400 -0.156 0.000 0.803 62 E CB -0.205 29.477 29.700 -0.030 0.000 0.750 62 E HN -0.307 8.430 8.360 0.082 -0.327 0.448 63 A N -1.192 121.595 122.820 -0.055 0.000 1.892 63 A HA -0.362 3.912 4.320 -0.077 0.000 0.218 63 A C 1.997 179.534 177.584 -0.079 0.000 1.188 63 A CA 3.257 55.254 52.037 -0.066 0.000 0.631 63 A CB -0.913 18.057 19.000 -0.050 0.000 0.822 63 A HN -0.301 7.839 8.150 -0.017 0.000 0.447 64 T N 0.553 115.074 114.554 -0.056 0.000 2.635 64 T HA -0.527 3.794 4.350 -0.047 0.000 0.267 64 T C 2.180 176.828 174.700 -0.086 0.000 1.040 64 T CA 5.291 67.363 62.100 -0.046 0.000 1.156 64 T CB -0.196 68.694 68.868 0.037 0.000 0.863 64 T HN -0.173 8.053 8.240 -0.023 0.000 0.430 65 K N 0.505 120.808 120.400 -0.161 0.000 2.063 65 K HA -0.383 3.855 4.320 -0.136 0.000 0.208 65 K C 2.597 179.129 176.600 -0.113 0.000 1.048 65 K CA 3.467 59.651 56.287 -0.171 0.000 0.928 65 K CB -0.198 32.129 32.500 -0.288 0.000 0.713 65 K HN -0.644 7.472 8.250 -0.224 0.000 0.442 66 K N -1.654 118.682 120.400 -0.106 0.000 2.062 66 K HA -0.115 4.165 4.320 -0.067 0.000 0.205 66 K C 2.465 179.029 176.600 -0.061 0.000 1.051 66 K CA 1.680 57.923 56.287 -0.074 0.000 0.941 66 K CB -0.597 31.863 32.500 -0.068 0.000 0.719 66 K HN -0.458 7.722 8.250 -0.116 0.000 0.440 67 A N 0.433 123.209 122.820 -0.073 0.000 1.892 67 A HA -0.244 4.039 4.320 -0.062 0.000 0.218 67 A C 2.096 179.644 177.584 -0.060 0.000 1.188 67 A CA 3.238 55.232 52.037 -0.071 0.000 0.631 67 A CB -0.896 18.046 19.000 -0.096 0.000 0.822 67 A HN -0.024 8.077 8.150 -0.082 0.000 0.447 68 c N -2.365 116.201 118.600 -0.057 0.000 2.440 68 c HA -0.186 4.356 4.570 -0.048 0.000 0.278 68 c C 2.386 176.454 174.090 -0.037 0.000 1.295 68 c CA 3.353 59.655 56.329 -0.044 0.000 1.738 68 c CB -2.410 40.083 42.510 -0.029 0.000 1.987 68 c HN -0.264 7.928 8.230 -0.062 0.000 0.492 69 D N 0.687 121.063 120.400 -0.040 0.000 2.104 69 D HA -0.323 4.301 4.640 -0.027 0.000 0.194 69 D C 2.549 178.830 176.300 -0.031 0.000 0.994 69 D CA 3.573 57.553 54.000 -0.033 0.000 0.830 69 D CB -0.530 40.248 40.800 -0.035 0.000 0.959 69 D HN -0.074 8.191 8.370 -0.048 0.076 0.452 70 Q N -0.957 118.825 119.800 -0.031 0.000 2.119 70 Q HA -0.319 4.011 4.340 -0.017 0.000 0.201 70 Q C 2.649 178.621 176.000 -0.047 0.000 0.972 70 Q CA 2.969 58.757 55.803 -0.024 0.000 0.847 70 Q CB 0.158 28.894 28.738 -0.003 0.000 0.903 70 Q HN -0.402 7.766 8.270 -0.033 0.082 0.433 71 L N -1.106 120.081 121.223 -0.059 0.000 2.083 71 L HA -0.368 3.907 4.340 -0.109 0.000 0.209 71 L C 2.405 179.221 176.870 -0.090 0.000 1.083 71 L CA 2.971 57.759 54.840 -0.088 0.000 0.752 71 L CB -0.365 41.644 42.059 -0.083 0.000 0.899 71 L HN -0.029 8.169 8.230 -0.054 0.000 0.433 72 A N -2.139 120.643 122.820 -0.063 0.000 2.066 72 A HA -0.126 4.384 4.320 -0.058 -0.225 0.218 72 A C 1.100 178.653 177.584 -0.052 0.000 1.157 72 A CA 2.135 54.142 52.037 -0.051 0.000 0.670 72 A CB -0.343 18.643 19.000 -0.023 0.000 0.804 72 A HN -0.359 7.753 8.150 -0.052 0.007 0.453 73 L N -2.718 118.472 121.223 -0.055 0.000 2.209 73 L HA -0.048 4.264 4.340 -0.048 0.000 0.207 73 L C -0.342 176.481 176.870 -0.079 0.000 1.094 73 L CA 0.441 55.248 54.840 -0.055 0.000 0.790 73 L CB 1.225 43.260 42.059 -0.041 0.000 0.932 73 L HN -0.862 7.173 8.230 -0.054 0.163 0.447 74 G N -2.652 106.082 108.800 -0.110 0.000 3.017 74 G HA2 -0.235 3.791 3.960 -0.211 0.000 0.680 74 G HA3 -0.235 3.637 3.960 -0.146 0.000 0.680 74 G C -2.496 172.297 174.900 -0.177 0.000 1.179 74 G CA -0.380 44.621 45.100 -0.164 0.000 1.142 74 G HN -0.662 7.465 8.290 -0.109 0.098 0.489 75 V N -1.152 118.621 119.914 -0.234 0.000 2.962 75 V HA 0.925 5.128 4.120 -0.139 -0.166 0.313 75 V C -1.062 174.839 176.094 -0.320 0.000 1.099 75 V CA -3.068 59.126 62.300 -0.177 0.000 0.971 75 V CB 3.804 35.604 31.823 -0.039 0.000 1.028 75 V HN -0.187 7.832 8.190 -0.285 0.000 0.430 76 V N -5.468 114.367 119.914 -0.131 0.000 3.650 76 V HA 0.229 4.084 4.120 -0.442 0.000 0.271 76 V C -0.779 175.560 176.094 0.407 0.000 1.281 76 V CA -0.302 62.017 62.300 0.030 0.000 1.120 76 V CB 0.514 32.495 31.823 0.262 0.000 0.856 76 V HN -0.122 8.052 8.190 -0.028 0.000 0.443 77 A N -2.268 120.712 122.820 0.266 0.000 2.590 77 A HA 0.283 4.889 4.320 0.217 -0.155 0.294 77 A C -2.698 175.029 177.584 0.239 0.000 1.046 77 A CA -0.232 51.952 52.037 0.246 0.000 0.684 77 A CB 2.723 21.858 19.000 0.225 0.000 1.279 77 A HN -0.833 7.392 8.150 0.194 0.042 0.415 78 I N -1.537 119.115 120.570 0.137 0.000 2.509 78 I HA 0.490 5.026 4.170 0.325 -0.171 0.293 78 I C -1.626 174.561 176.117 0.116 0.000 1.020 78 I CA -1.515 59.907 61.300 0.202 0.000 1.088 78 I CB 3.888 41.949 38.000 0.101 0.000 1.267 78 I HN 0.032 8.287 8.210 0.075 0.000 0.430 79 F N 4.827 124.782 119.950 0.008 0.000 2.308 79 F HA 0.511 5.191 4.527 -0.023 -0.168 0.370 79 F C 0.517 176.185 175.800 -0.220 0.000 1.100 79 F CA -1.727 56.215 58.000 -0.097 0.000 1.108 79 F CB 0.829 39.727 39.000 -0.170 0.000 1.293 79 F HN 0.500 9.102 8.300 0.504 0.000 0.478 80 G N 3.273 112.120 108.800 0.078 0.000 2.653 80 G HA2 0.139 4.128 3.960 0.048 0.000 0.265 80 G HA3 0.139 4.385 3.960 0.477 0.000 0.265 80 G C -2.260 172.576 174.900 -0.107 0.000 1.237 80 G CA -1.246 43.933 45.100 0.132 0.000 0.946 80 G HN -0.275 8.040 8.290 0.042 0.000 0.522 81 P HA 0.150 4.573 4.420 -0.233 -0.143 0.275 81 P C 0.011 177.261 177.300 -0.083 0.000 1.266 81 P CA -0.785 62.224 63.100 -0.151 0.000 0.793 81 P CB 1.204 32.830 31.700 -0.124 0.000 1.074 82 S N 0.483 116.147 115.700 -0.059 0.000 2.341 82 S HA -0.165 4.310 4.470 0.008 0.000 0.216 82 S C 0.509 175.112 174.600 0.004 0.000 1.034 82 S CA 2.173 60.376 58.200 0.005 0.000 0.964 82 S CB -0.016 63.224 63.200 0.066 0.000 0.882 82 S HN -0.135 8.277 8.310 -0.078 -0.148 0.469 83 Q N 1.091 120.891 119.800 -0.001 0.000 2.469 83 Q HA -0.069 4.274 4.340 0.004 0.000 0.279 83 Q C 2.039 178.028 176.000 -0.017 0.000 1.097 83 Q CA 0.829 56.614 55.803 -0.030 0.000 0.951 83 Q CB 0.350 28.956 28.738 -0.219 0.000 1.297 83 Q HN -0.443 8.120 8.270 0.007 -0.289 0.465 84 G N -0.663 108.149 108.800 0.020 0.000 2.920 84 G HA2 -0.035 3.873 3.960 -0.087 0.000 0.208 84 G HA3 -0.035 3.909 3.960 -0.027 0.000 0.208 84 G C 0.338 175.230 174.900 -0.013 0.000 1.159 84 G CA 1.048 46.130 45.100 -0.030 0.000 0.784 84 G HN 0.396 8.726 8.290 0.066 0.000 0.535 85 S N -0.158 115.581 115.700 0.065 0.000 2.421 85 S HA 0.089 4.592 4.470 0.055 0.000 0.224 85 S C 0.980 175.603 174.600 0.039 0.000 1.035 85 S CA 2.187 60.439 58.200 0.086 0.000 0.953 85 S CB 0.471 63.805 63.200 0.224 0.000 0.810 85 S HN -0.187 8.127 8.310 0.096 0.053 0.497 86 C N -1.150 118.164 119.300 0.025 0.000 2.475 86 C HA -0.026 4.446 4.460 0.019 0.000 0.279 86 C C 1.640 176.609 174.990 -0.033 0.000 1.322 86 C CA 1.587 60.606 59.018 0.001 0.000 1.734 86 C CB 1.008 28.738 27.740 -0.015 0.000 2.005 86 C HN -0.120 8.122 8.230 0.020 0.000 0.495 87 T N -0.441 114.091 114.554 -0.037 0.000 2.962 87 T HA -0.352 3.984 4.350 -0.024 0.000 0.270 87 T C 1.535 176.197 174.700 -0.065 0.000 1.088 87 T CA 3.801 65.890 62.100 -0.019 0.000 1.127 87 T CB -0.389 68.498 68.868 0.033 0.000 0.883 87 T HN -0.046 8.172 8.240 -0.037 0.000 0.493 88 N N 1.255 119.904 118.700 -0.085 0.000 2.223 88 N HA -0.320 4.347 4.740 -0.122 0.000 0.185 88 N C 1.588 177.054 175.510 -0.074 0.000 1.016 88 N CA 3.606 56.599 53.050 -0.095 0.000 0.863 88 N CB -0.565 37.875 38.487 -0.079 0.000 0.983 88 N HN -0.273 8.037 8.380 -0.076 0.024 0.429 89 A N 0.045 122.827 122.820 -0.062 0.000 1.874 89 A HA -0.088 4.210 4.320 -0.037 0.000 0.214 89 A C 1.890 179.414 177.584 -0.100 0.000 1.189 89 A CA 2.704 54.710 52.037 -0.052 0.000 0.615 89 A CB -0.255 18.734 19.000 -0.017 0.000 0.830 89 A HN -0.528 7.471 8.150 -0.055 0.118 0.443 90 V N -0.630 119.183 119.914 -0.168 0.000 2.427 90 V HA -0.624 3.365 4.120 -0.219 0.000 0.248 90 V C 1.268 177.115 176.094 -0.411 0.000 1.051 90 V CA 4.306 66.429 62.300 -0.296 0.000 1.048 90 V CB -0.180 31.409 31.823 -0.390 0.000 0.666 90 V HN -0.684 7.414 8.190 -0.154 0.000 0.456 91 Q N 0.194 119.768 119.800 -0.377 0.000 2.061 91 Q HA -0.421 3.821 4.340 -0.163 0.000 0.204 91 Q C 2.077 178.048 176.000 -0.047 0.000 0.984 91 Q CA 3.449 59.158 55.803 -0.156 0.000 0.846 91 Q CB -0.286 28.434 28.738 -0.030 0.000 0.902 91 Q HN -0.083 8.006 8.270 -0.302 0.000 0.421 92 S N -1.045 114.623 115.700 -0.054 0.000 2.382 92 S HA -0.254 4.365 4.470 0.023 -0.134 0.228 92 S C 2.258 176.844 174.600 -0.023 0.000 1.027 92 S CA 2.690 60.883 58.200 -0.012 0.000 0.991 92 S CB -0.323 62.868 63.200 -0.015 0.000 0.823 92 S HN -0.814 7.449 8.310 -0.077 0.000 0.469 93 I N 2.275 122.808 120.570 -0.061 0.000 2.163 93 I HA -0.456 3.686 4.170 -0.048 0.000 0.240 93 I C 1.491 177.565 176.117 -0.073 0.000 1.081 93 I CA 3.889 65.150 61.300 -0.065 0.000 1.353 93 I CB -0.047 37.903 38.000 -0.084 0.000 1.054 93 I HN -0.644 7.514 8.210 -0.087 0.000 0.407 94 C N -1.935 117.314 119.300 -0.085 0.000 2.403 94 C HA -0.469 3.956 4.460 -0.059 0.000 0.282 94 C C 2.209 177.153 174.990 -0.077 0.000 1.297 94 C CA 4.800 63.788 59.018 -0.049 0.000 1.785 94 C CB -1.451 26.296 27.740 0.013 0.000 1.963 94 C HN 0.100 8.256 8.230 -0.124 0.000 0.507 95 N N -0.473 118.219 118.700 -0.013 0.000 2.290 95 N HA -0.198 4.530 4.740 -0.020 0.000 0.179 95 N C 1.259 176.699 175.510 -0.116 0.000 1.016 95 N CA 2.539 55.591 53.050 0.004 0.000 0.871 95 N CB 0.168 38.757 38.487 0.170 0.000 0.987 95 N HN -0.586 7.666 8.380 0.012 0.136 0.431 96 A N -1.405 121.374 122.820 -0.069 0.000 1.898 96 A HA -0.193 4.107 4.320 -0.033 0.000 0.216 96 A C 1.197 178.718 177.584 -0.104 0.000 1.181 96 A CA 2.491 54.494 52.037 -0.058 0.000 0.620 96 A CB 0.112 19.098 19.000 -0.024 0.000 0.819 96 A HN -0.618 7.505 8.150 -0.045 0.000 0.442 97 L N -5.206 115.937 121.223 -0.132 0.000 2.585 97 L HA 0.101 4.394 4.340 -0.078 0.000 0.226 97 L C -0.674 176.091 176.870 -0.175 0.000 1.113 97 L CA -0.118 54.655 54.840 -0.111 0.000 0.876 97 L CB 0.417 42.432 42.059 -0.074 0.000 1.072 97 L HN -0.529 7.624 8.230 -0.128 0.000 0.468 98 E N -4.292 115.618 120.200 -0.484 0.000 2.340 98 E HA -0.449 2.520 4.350 -2.367 -0.038 0.240 98 E C -1.793 174.627 176.600 -0.300 0.000 1.154 98 E CA 0.868 56.597 56.400 -1.118 0.000 0.717 98 E CB -3.013 26.207 29.700 -0.799 0.000 1.250 98 E HN -0.348 7.568 8.360 -0.497 0.146 0.386 99 V N -0.950 118.947 119.914 -0.028 0.000 2.459 99 V HA 0.187 4.709 4.120 0.670 0.000 0.295 99 V C -2.472 173.829 176.094 0.345 0.000 1.029 99 V CA -3.501 58.998 62.300 0.331 0.000 0.874 99 V CB 1.058 32.966 31.823 0.142 0.000 0.985 99 V HN -0.653 7.464 8.190 -0.121 0.000 0.438 100 P HA -0.116 4.520 4.420 0.360 0.000 0.264 100 P C -1.830 175.576 177.300 0.176 0.000 1.193 100 P CA 0.378 63.646 63.100 0.281 0.000 0.763 100 P CB 0.406 32.146 31.700 0.067 0.000 0.810 101 H N 6.660 125.762 119.070 0.052 0.000 2.597 101 H HA 0.371 5.020 4.556 -0.093 -0.149 0.303 101 H C -0.781 174.466 175.328 -0.136 0.000 1.057 101 H CA -2.049 53.975 56.048 -0.041 0.000 1.261 101 H CB 1.742 31.524 29.762 0.033 0.000 1.397 101 H HN -0.291 8.172 8.280 0.305 0.000 0.461 102 I N 7.740 128.014 120.570 -0.493 0.000 2.371 102 I HA 0.061 3.957 4.170 -0.457 0.000 0.290 102 I C -1.275 174.491 176.117 -0.585 0.000 1.028 102 I CA -2.030 58.904 61.300 -0.610 0.000 1.345 102 I CB -1.037 36.335 38.000 -1.046 0.000 1.407 102 I HN 0.281 8.199 8.210 -0.486 0.000 0.501 103 Q N 5.261 124.833 119.800 -0.379 0.000 2.342 103 Q HA 0.381 4.534 4.340 -0.312 0.000 0.267 103 Q C -0.652 175.340 176.000 -0.013 0.000 1.038 103 Q CA -0.762 54.886 55.803 -0.257 0.000 0.832 103 Q CB 3.077 31.679 28.738 -0.227 0.000 1.323 103 Q HN -0.119 7.987 8.270 -0.274 0.000 0.448 104 L N -0.536 120.719 121.223 0.054 0.000 2.840 104 L HA 0.184 4.650 4.340 0.210 0.000 0.249 104 L C -0.763 176.247 176.870 0.234 0.000 1.119 104 L CA 0.514 55.458 54.840 0.173 0.000 0.930 104 L CB 1.015 43.183 42.059 0.181 0.000 1.295 104 L HN 0.490 8.730 8.230 0.017 0.000 0.534 105 R N -3.240 117.338 120.500 0.129 0.000 2.854 105 R HA 0.119 4.466 4.340 0.012 0.000 0.271 105 R C -1.993 174.337 176.300 0.050 0.000 0.996 105 R CA -1.813 54.315 56.100 0.047 0.000 0.961 105 R CB 2.856 33.162 30.300 0.010 0.000 1.182 105 R HN -0.860 7.453 8.270 0.072 0.000 0.479 106 W N 1.783 122.951 121.300 -0.221 0.000 2.223 106 W HA -0.232 4.492 4.660 0.107 0.000 0.334 106 W C -1.502 174.989 176.519 -0.047 0.000 1.334 106 W CA 1.679 59.002 57.345 -0.036 0.000 1.246 106 W CB 0.275 29.724 29.460 -0.018 0.000 1.184 106 W HN 0.337 8.421 8.180 -0.161 0.000 0.563 107 K N 4.568 124.274 120.400 -1.157 0.000 2.426 107 K HA 0.187 3.890 4.320 -1.028 0.000 0.251 107 K C -1.812 173.643 176.600 -1.909 0.000 0.941 107 K CA -1.875 53.641 56.287 -1.285 0.000 0.808 107 K CB 3.271 35.241 32.500 -0.883 0.000 1.265 107 K HN -0.133 7.420 8.250 -1.160 0.000 0.432 108 H N 3.661 121.833 119.070 -1.498 0.000 2.848 108 H HA -0.126 3.967 4.556 -0.772 0.000 0.317 108 H C -0.496 174.416 175.328 -0.694 0.000 1.046 108 H CA 0.265 55.803 56.048 -0.850 0.000 1.470 108 H CB 0.541 30.110 29.762 -0.322 0.000 1.483 108 H HN 0.277 7.984 8.280 -0.955 0.000 0.548 109 H N 7.246 126.074 119.070 -0.404 0.000 2.632 109 H HA 0.314 4.657 4.556 -0.354 0.000 0.258 109 H C -1.653 173.442 175.328 -0.388 0.000 1.278 109 H CA -2.911 52.935 56.048 -0.338 0.000 1.352 109 H CB -0.022 29.669 29.762 -0.117 0.000 1.418 109 H HN 0.101 8.290 8.280 -0.153 0.000 0.513 110 P HA -0.121 4.091 4.420 -0.347 0.000 0.264 110 P C 0.565 177.825 177.300 -0.068 0.000 1.179 110 P CA -0.274 62.647 63.100 -0.300 0.000 0.763 110 P CB 0.867 32.439 31.700 -0.213 0.000 0.806 111 L N 2.873 124.093 121.223 -0.004 0.000 2.093 111 L HA -0.275 4.090 4.340 0.043 0.000 0.208 111 L C 0.694 177.581 176.870 0.027 0.000 1.085 111 L CA 2.545 57.404 54.840 0.033 0.000 0.755 111 L CB -0.366 41.724 42.059 0.050 0.000 0.904 111 L HN 0.247 8.482 8.230 0.008 0.000 0.435 112 D N -4.628 115.783 120.400 0.019 0.000 2.221 112 D HA -0.173 4.482 4.640 0.024 0.000 0.204 112 D C 0.170 176.483 176.300 0.022 0.000 0.982 112 D CA 1.350 55.362 54.000 0.020 0.000 0.857 112 D CB -0.432 40.378 40.800 0.017 0.000 0.934 112 D HN -0.085 8.294 8.370 0.015 0.000 0.475 113 N N 1.020 119.731 118.700 0.019 0.000 2.468 113 N HA -0.168 4.590 4.740 0.030 0.000 0.265 113 N C -0.146 175.402 175.510 0.063 0.000 1.199 113 N CA 0.734 53.804 53.050 0.034 0.000 0.928 113 N CB 0.417 38.919 38.487 0.024 0.000 1.059 113 N HN -0.582 7.664 8.380 0.006 0.138 0.467 114 K N 2.800 123.240 120.400 0.066 0.000 2.440 114 K HA 0.146 4.502 4.320 0.061 0.000 0.206 114 K C -0.799 175.862 176.600 0.102 0.000 1.025 114 K CA -1.028 55.301 56.287 0.069 0.000 1.135 114 K CB -0.344 32.187 32.500 0.051 0.000 0.856 114 K HN 0.077 8.363 8.250 0.060 0.000 0.502 115 D N 0.936 121.430 120.400 0.156 0.000 2.424 115 D HA -0.067 4.839 4.640 0.210 -0.140 0.244 115 D C 0.125 176.554 176.300 0.215 0.000 1.134 115 D CA 1.344 55.485 54.000 0.234 0.000 0.881 115 D CB 0.683 41.661 40.800 0.297 0.000 1.191 115 D HN -0.567 8.150 8.370 0.155 -0.253 0.445 116 T N -2.708 111.932 114.554 0.143 0.000 3.004 116 T HA 0.205 4.395 4.350 -0.266 0.000 0.266 116 T C 0.513 175.053 174.700 -0.267 0.000 0.986 116 T CA -0.586 61.428 62.100 -0.143 0.000 0.902 116 T CB 1.707 70.461 68.868 -0.189 0.000 1.118 116 T HN 0.074 8.729 8.240 0.238 -0.273 0.522 117 F N 5.878 125.839 119.950 0.019 0.000 2.669 117 F HA 0.093 4.597 4.527 -0.039 0.000 0.353 117 F C -1.927 173.954 175.800 0.135 0.000 1.192 117 F CA 0.015 58.038 58.000 0.038 0.000 1.317 117 F CB -1.182 37.874 39.000 0.093 0.000 1.652 117 F HN -0.684 8.052 8.300 0.450 -0.166 0.608 118 Y N -4.072 116.213 120.300 -0.026 0.000 2.624 118 Y HA 0.751 5.407 4.550 -0.097 -0.165 0.334 118 Y C -2.812 172.923 175.900 -0.276 0.000 1.155 118 Y CA -2.303 55.733 58.100 -0.106 0.000 1.046 118 Y CB 2.360 40.802 38.460 -0.030 0.000 1.316 118 Y HN -0.438 7.540 8.280 -0.398 0.064 0.457 119 V N -7.295 112.471 119.914 -0.247 0.000 3.155 119 V HA 0.751 4.767 4.120 -0.465 -0.174 0.313 119 V C -1.930 174.073 176.094 -0.151 0.000 1.162 119 V CA -3.311 58.720 62.300 -0.448 0.000 1.048 119 V CB 3.659 34.814 31.823 -1.114 0.000 1.092 119 V HN -0.413 7.651 8.190 -0.210 0.000 0.447 120 N N -0.362 118.308 118.700 -0.050 0.000 2.519 120 N HA 0.339 5.340 4.740 0.094 -0.204 0.291 120 N C -1.146 174.558 175.510 0.325 0.000 1.107 120 N CA -0.291 52.849 53.050 0.150 0.000 0.904 120 N CB 3.111 41.726 38.487 0.212 0.000 1.500 120 N HN -0.206 8.116 8.380 -0.095 0.000 0.510 121 L N 3.709 125.123 121.223 0.319 0.000 2.509 121 L HA -0.018 4.596 4.340 0.456 0.000 0.222 121 L C -0.434 176.566 176.870 0.216 0.000 1.123 121 L CA 0.287 55.332 54.840 0.343 0.000 0.856 121 L CB 0.457 42.693 42.059 0.296 0.000 0.985 121 L HN 0.043 8.424 8.230 0.251 0.000 0.456 122 Y N 2.133 122.525 120.300 0.154 0.000 2.526 122 Y HA -0.129 4.448 4.550 0.045 0.000 0.330 122 Y C -2.526 173.393 175.900 0.031 0.000 1.156 122 Y CA -0.171 57.989 58.100 0.101 0.000 1.419 122 Y CB 0.645 39.220 38.460 0.192 0.000 1.250 122 Y HN -0.753 7.953 8.280 0.408 -0.182 0.540 123 P HA -0.212 3.927 4.420 -0.667 -0.119 0.262 123 P C -1.328 175.940 177.300 -0.054 0.000 1.182 123 P CA 0.257 62.938 63.100 -0.697 0.000 0.761 123 P CB 0.361 31.160 31.700 -1.500 0.000 0.795 124 D N 2.764 123.324 120.400 0.268 0.000 2.455 124 D HA -0.143 4.819 4.640 0.536 0.000 0.241 124 D C 1.305 177.792 176.300 0.311 0.000 1.138 124 D CA 0.135 54.391 54.000 0.427 0.000 0.877 124 D CB 1.508 42.568 40.800 0.434 0.000 1.187 124 D HN -0.071 8.534 8.370 0.392 0.000 0.451 125 Y N 4.503 124.943 120.300 0.234 0.000 2.509 125 Y HA -0.351 4.206 4.550 0.011 0.000 0.293 125 Y C 1.155 177.035 175.900 -0.032 0.000 1.133 125 Y CA 3.256 61.359 58.100 0.005 0.000 1.283 125 Y CB 0.289 38.574 38.460 -0.292 0.000 1.001 125 Y HN 0.464 9.093 8.280 0.582 0.000 0.555 126 A N -1.298 121.627 122.820 0.175 0.000 1.969 126 A HA -0.263 4.005 4.320 -0.087 0.000 0.218 126 A C 1.356 178.878 177.584 -0.103 0.000 1.169 126 A CA 2.928 54.966 52.037 0.001 0.000 0.635 126 A CB -0.828 18.223 19.000 0.084 0.000 0.810 126 A HN -0.439 8.041 8.150 0.265 -0.170 0.445 127 S N -0.470 115.314 115.700 0.140 0.000 2.395 127 S HA -0.215 4.464 4.470 0.348 0.000 0.225 127 S C 1.874 176.507 174.600 0.056 0.000 1.027 127 S CA 2.751 61.106 58.200 0.258 0.000 0.965 127 S CB 0.208 63.626 63.200 0.364 0.000 0.812 127 S HN -0.710 7.738 8.310 0.231 0.000 0.482 128 L N 1.364 122.555 121.223 -0.053 0.000 2.046 128 L HA -0.391 3.619 4.340 -0.551 0.000 0.208 128 L C 1.762 178.389 176.870 -0.406 0.000 1.077 128 L CA 3.261 57.860 54.840 -0.401 0.000 0.747 128 L CB -0.407 41.292 42.059 -0.600 0.000 0.896 128 L HN -0.445 7.797 8.230 0.020 0.000 0.432 129 S N -0.896 114.668 115.700 -0.228 0.000 2.383 129 S HA -0.433 3.947 4.470 -0.150 0.000 0.229 129 S C 2.208 176.699 174.600 -0.180 0.000 1.030 129 S CA 3.686 61.770 58.200 -0.193 0.000 1.002 129 S CB -0.163 62.923 63.200 -0.189 0.000 0.829 129 S HN -0.002 8.105 8.310 -0.164 0.105 0.467 130 H N 1.049 120.064 119.070 -0.091 0.000 2.395 130 H HA -0.226 4.332 4.556 0.004 0.000 0.299 130 H C 1.750 176.986 175.328 -0.153 0.000 1.070 130 H CA 2.822 58.863 56.048 -0.010 0.000 1.356 130 H CB 0.110 29.986 29.762 0.190 0.000 1.401 130 H HN -0.741 7.324 8.280 -0.189 0.102 0.524 131 A N -0.408 122.068 122.820 -0.573 0.000 1.969 131 A HA -0.236 3.273 4.320 -1.352 0.000 0.218 131 A C 1.727 179.018 177.584 -0.489 0.000 1.169 131 A CA 2.975 54.268 52.037 -1.240 0.000 0.635 131 A CB -0.794 16.890 19.000 -2.193 0.000 0.810 131 A HN -0.310 7.350 8.150 -0.680 0.082 0.445 132 I N -1.442 118.921 120.570 -0.344 0.000 2.353 132 I HA -0.479 3.744 4.170 0.089 0.000 0.248 132 I C 1.618 177.678 176.117 -0.094 0.000 1.119 132 I CA 3.838 65.079 61.300 -0.098 0.000 1.417 132 I CB -0.006 37.939 38.000 -0.092 0.000 1.078 132 I HN -0.465 7.394 8.210 -0.394 0.115 0.421 133 L N 0.765 121.936 121.223 -0.087 0.000 1.994 133 L HA -0.493 3.787 4.340 -0.100 0.000 0.208 133 L C 1.614 178.418 176.870 -0.110 0.000 1.071 133 L CA 3.844 58.635 54.840 -0.082 0.000 0.745 133 L CB -0.351 41.697 42.059 -0.018 0.000 0.892 133 L HN -0.509 7.673 8.230 -0.080 0.000 0.431 134 D N -1.664 118.714 120.400 -0.038 0.000 2.158 134 D HA -0.312 4.321 4.640 -0.013 0.000 0.197 134 D C 2.656 178.920 176.300 -0.059 0.000 0.995 134 D CA 3.741 57.746 54.000 0.008 0.000 0.846 134 D CB -0.365 40.562 40.800 0.212 0.000 0.941 134 D HN -0.346 8.022 8.370 -0.003 0.000 0.456 135 L N -0.552 120.612 121.223 -0.097 0.000 2.044 135 L HA -0.187 4.076 4.340 -0.128 0.000 0.205 135 L C 1.312 177.973 176.870 -0.348 0.000 1.075 135 L CA 2.931 57.670 54.840 -0.170 0.000 0.747 135 L CB 0.016 41.990 42.059 -0.142 0.000 0.903 135 L HN -0.626 7.537 8.230 -0.088 0.015 0.435 136 V N -0.479 119.194 119.914 -0.401 0.000 2.255 136 V HA -0.702 2.797 4.120 -1.036 0.000 0.247 136 V C 2.054 177.930 176.094 -0.365 0.000 1.051 136 V CA 4.797 66.755 62.300 -0.571 0.000 1.018 136 V CB -0.204 31.438 31.823 -0.301 0.000 0.641 136 V HN -0.390 7.619 8.190 -0.302 0.000 0.445 137 Q N -2.802 116.842 119.800 -0.261 0.000 2.291 137 Q HA -0.312 3.943 4.340 -0.142 0.000 0.206 137 Q C 2.629 178.566 176.000 -0.105 0.000 0.976 137 Q CA 2.580 58.251 55.803 -0.221 0.000 0.875 137 Q CB -0.262 28.224 28.738 -0.420 0.000 0.927 137 Q HN -0.094 8.015 8.270 -0.268 0.000 0.450 138 S N 0.144 115.765 115.700 -0.132 0.000 2.436 138 S HA -0.186 4.264 4.470 -0.032 0.000 0.228 138 S C 1.613 176.174 174.600 -0.064 0.000 1.014 138 S CA 2.337 60.494 58.200 -0.073 0.000 0.950 138 S CB -0.192 62.970 63.200 -0.064 0.000 0.784 138 S HN -0.632 7.443 8.310 -0.173 0.131 0.504 139 L N -2.523 118.598 121.223 -0.169 0.000 2.599 139 L HA -0.114 4.236 4.340 0.016 0.000 0.230 139 L C -0.665 176.289 176.870 0.139 0.000 1.141 139 L CA 0.312 55.103 54.840 -0.082 0.000 0.877 139 L CB -0.063 41.745 42.059 -0.419 0.000 1.009 139 L HN -0.710 7.242 8.230 -0.304 0.096 0.447 140 K N -6.057 114.411 120.400 0.112 0.000 3.160 140 K HA -0.383 4.149 4.320 0.210 -0.086 0.280 140 K C -0.211 176.612 176.600 0.373 0.000 1.154 140 K CA 0.780 57.200 56.287 0.222 0.000 0.822 140 K CB -2.557 30.051 32.500 0.180 0.000 1.239 140 K HN -0.862 7.207 8.250 0.031 0.200 0.489 141 W N -0.434 120.923 121.300 0.096 0.000 2.322 141 W HA -0.132 4.574 4.660 0.076 0.000 0.328 141 W C 0.555 177.159 176.519 0.140 0.000 1.395 141 W CA -0.789 56.611 57.345 0.091 0.000 1.267 141 W CB -0.821 28.671 29.460 0.052 0.000 1.259 141 W HN -0.641 7.738 8.180 0.382 0.030 0.560 142 R N 0.379 121.042 120.500 0.271 0.000 2.206 142 R HA -0.025 4.423 4.340 0.180 0.000 0.198 142 R C -0.903 175.472 176.300 0.124 0.000 0.986 142 R CA 1.193 57.390 56.100 0.162 0.000 1.029 142 R CB 1.129 31.473 30.300 0.074 0.000 0.966 142 R HN 0.077 8.465 8.270 0.197 0.000 0.487 143 S N -4.187 111.565 115.700 0.087 0.000 2.536 143 S HA 0.917 5.621 4.470 0.074 -0.189 0.271 143 S C -1.822 172.769 174.600 -0.016 0.000 1.134 143 S CA -1.548 56.676 58.200 0.040 0.000 0.897 143 S CB 2.852 66.048 63.200 -0.007 0.000 1.094 143 S HN -0.680 7.665 8.310 0.058 0.000 0.473 144 A N 0.925 123.758 122.820 0.021 0.000 2.507 144 A HA 0.682 5.040 4.320 -0.149 -0.128 0.284 144 A C -2.246 175.318 177.584 -0.032 0.000 1.281 144 A CA -1.076 50.951 52.037 -0.016 0.000 0.744 144 A CB 3.379 22.499 19.000 0.200 0.000 1.332 144 A HN 0.195 8.373 8.150 0.048 0.000 0.454 145 T N 0.452 114.975 114.554 -0.052 0.000 3.011 145 T HA 0.450 4.949 4.350 -0.050 -0.179 0.303 145 T C -1.154 173.485 174.700 -0.103 0.000 0.997 145 T CA -0.313 61.740 62.100 -0.078 0.000 1.007 145 T CB 2.320 71.116 68.868 -0.119 0.000 1.017 145 T HN -0.238 7.970 8.240 -0.053 0.000 0.443 146 V N 8.470 128.349 119.914 -0.057 0.000 2.385 146 V HA 0.193 4.402 4.120 -0.087 -0.142 0.269 146 V C -1.687 174.389 176.094 -0.029 0.000 1.043 146 V CA -0.483 61.787 62.300 -0.050 0.000 0.906 146 V CB 0.436 32.256 31.823 -0.005 0.000 0.995 146 V HN 0.613 8.785 8.190 -0.031 0.000 0.467 147 V N 7.452 127.301 119.914 -0.110 0.000 2.384 147 V HA 0.449 4.763 4.120 -0.002 -0.195 0.287 147 V C -1.145 175.007 176.094 0.097 0.000 1.020 147 V CA -1.550 60.718 62.300 -0.053 0.000 0.850 147 V CB 1.410 33.108 31.823 -0.209 0.000 0.987 147 V HN 0.411 8.473 8.190 -0.214 0.000 0.436 148 Y N 3.192 123.481 120.300 -0.018 0.000 2.633 148 Y HA 0.967 5.733 4.550 0.021 -0.203 0.339 148 Y C -2.102 173.800 175.900 0.004 0.000 1.045 148 Y CA -2.991 55.106 58.100 -0.005 0.000 1.098 148 Y CB 3.112 41.543 38.460 -0.048 0.000 1.296 148 Y HN -0.207 8.055 8.280 -0.029 0.000 0.494 149 D N 0.554 120.960 120.400 0.010 0.000 2.799 149 D HA -0.052 4.491 4.640 -0.162 0.000 0.267 149 D C -1.086 175.183 176.300 -0.051 0.000 1.468 149 D CA 0.311 54.265 54.000 -0.077 0.000 1.077 149 D CB 1.340 42.145 40.800 0.008 0.000 1.065 149 D HN -0.021 8.454 8.370 0.176 0.000 0.359 150 D N -2.410 118.039 120.400 0.081 0.000 2.253 150 D HA 0.061 4.733 4.640 0.054 0.000 0.249 150 D C 1.225 177.657 176.300 0.220 0.000 1.049 150 D CA -0.214 53.843 54.000 0.094 0.000 0.929 150 D CB 1.990 42.822 40.800 0.054 0.000 1.176 150 D HN -0.044 8.378 8.370 0.087 0.000 0.437 151 S N 1.678 117.486 115.700 0.180 0.000 2.380 151 S HA -0.381 4.274 4.470 0.309 0.000 0.229 151 S C 1.838 176.435 174.600 -0.005 0.000 1.043 151 S CA 3.545 61.841 58.200 0.160 0.000 1.038 151 S CB -0.251 62.992 63.200 0.072 0.000 0.872 151 S HN 0.444 8.826 8.310 0.121 0.000 0.456 152 T N 4.269 118.815 114.554 -0.013 0.000 2.897 152 T HA -0.322 3.973 4.350 -0.091 0.000 0.271 152 T C 1.606 176.130 174.700 -0.294 0.000 1.084 152 T CA 3.444 65.486 62.100 -0.097 0.000 1.123 152 T CB -0.310 68.570 68.868 0.021 0.000 0.865 152 T HN -0.537 7.804 8.240 0.028 -0.084 0.496 153 G N 0.277 108.941 108.800 -0.227 0.000 2.442 153 G HA2 -0.293 3.405 3.960 -0.436 0.000 0.219 153 G HA3 -0.293 3.572 3.960 -0.158 0.000 0.219 153 G C 0.476 175.107 174.900 -0.449 0.000 1.141 153 G CA 1.897 46.803 45.100 -0.322 0.000 0.763 153 G HN -0.080 8.018 8.290 -0.076 0.146 0.554 154 L N 1.029 121.943 121.223 -0.514 0.000 1.955 154 L HA -0.357 3.682 4.340 -0.501 0.000 0.213 154 L C 1.292 177.953 176.870 -0.347 0.000 1.072 154 L CA 2.786 57.339 54.840 -0.477 0.000 0.755 154 L CB -0.353 41.431 42.059 -0.459 0.000 0.888 154 L HN -0.778 7.130 8.230 -0.517 0.012 0.432 155 I N -6.637 113.742 120.570 -0.318 0.000 2.381 155 I HA -0.335 3.721 4.170 -0.190 0.000 0.255 155 I C 1.959 177.872 176.117 -0.339 0.000 1.140 155 I CA 2.316 63.458 61.300 -0.264 0.000 1.404 155 I CB -0.195 37.676 38.000 -0.214 0.000 1.075 155 I HN -0.186 7.842 8.210 -0.303 0.000 0.433 156 R N -1.411 118.753 120.500 -0.560 0.000 2.052 156 R HA -0.094 3.852 4.340 -0.656 0.000 0.224 156 R C 2.223 178.341 176.300 -0.304 0.000 1.149 156 R CA 2.406 58.089 56.100 -0.694 0.000 0.962 156 R CB 0.573 30.021 30.300 -1.420 0.000 0.856 156 R HN -0.869 6.884 8.270 -0.584 0.166 0.433 157 L N -1.023 120.039 121.223 -0.267 0.000 2.747 157 L HA 0.116 4.414 4.340 -0.070 0.000 0.248 157 L C 0.385 177.182 176.870 -0.122 0.000 1.191 157 L CA -0.124 54.636 54.840 -0.134 0.000 1.003 157 L CB -2.274 39.711 42.059 -0.124 0.000 1.235 157 L HN -0.226 7.801 8.230 -0.338 0.000 0.426 158 Q N -0.146 119.579 119.800 -0.125 0.000 2.079 158 Q HA -0.356 3.925 4.340 -0.098 0.000 0.200 158 Q C 1.744 177.711 176.000 -0.055 0.000 0.974 158 Q CA 3.015 58.764 55.803 -0.089 0.000 0.840 158 Q CB -0.398 28.297 28.738 -0.071 0.000 0.898 158 Q HN -0.574 7.530 8.270 -0.137 0.083 0.430 159 E N -1.879 118.279 120.200 -0.070 0.000 2.401 159 E HA -0.267 4.082 4.350 -0.002 0.000 0.199 159 E C 0.901 177.492 176.600 -0.015 0.000 1.023 159 E CA 1.996 58.364 56.400 -0.054 0.000 0.859 159 E CB -0.686 28.879 29.700 -0.224 0.000 0.780 159 E HN 0.192 8.495 8.360 -0.094 0.000 0.523 160 L N -2.554 118.648 121.223 -0.035 0.000 2.388 160 L HA 0.094 4.436 4.340 0.004 0.000 0.209 160 L C 1.461 178.331 176.870 -0.001 0.000 1.061 160 L CA 1.512 56.343 54.840 -0.014 0.000 0.834 160 L CB 0.970 43.011 42.059 -0.031 0.000 1.029 160 L HN -0.599 7.407 8.230 -0.056 0.190 0.473 161 I N -0.112 120.444 120.570 -0.024 0.000 2.493 161 I HA -0.399 3.762 4.170 -0.014 0.000 0.254 161 I C 1.380 177.500 176.117 0.004 0.000 1.160 161 I CA 2.687 63.974 61.300 -0.021 0.000 1.445 161 I CB -0.605 37.359 38.000 -0.059 0.000 1.086 161 I HN -0.313 7.785 8.210 -0.043 0.087 0.433 162 M N -2.957 116.651 119.600 0.014 0.000 2.571 162 M HA 0.053 4.548 4.480 0.026 0.000 0.235 162 M C 0.047 176.382 176.300 0.058 0.000 1.216 162 M CA 0.376 55.695 55.300 0.031 0.000 0.979 162 M CB -1.019 31.600 32.600 0.031 0.000 1.616 162 M HN -0.592 7.674 8.290 0.009 0.029 0.469 163 A N 1.434 124.295 122.820 0.070 0.000 1.930 163 A HA 0.050 4.440 4.320 0.116 0.000 0.215 163 A C -0.909 176.760 177.584 0.142 0.000 1.176 163 A CA 3.717 55.822 52.037 0.113 0.000 0.632 163 A CB -2.402 16.668 19.000 0.118 0.000 0.819 163 A HN -0.502 7.589 8.150 0.058 0.094 0.445 164 P HA 0.006 4.614 4.420 0.093 -0.132 0.250 164 P C -0.827 176.508 177.300 0.058 0.000 1.239 164 P CA 0.983 64.131 63.100 0.080 0.000 0.756 164 P CB -0.461 31.271 31.700 0.053 0.000 1.013 165 S N -5.197 110.544 115.700 0.068 0.000 2.728 165 S HA 0.140 4.635 4.470 0.042 0.000 0.257 165 S C 0.275 174.918 174.600 0.072 0.000 1.060 165 S CA 0.123 58.356 58.200 0.054 0.000 1.126 165 S CB 1.323 64.547 63.200 0.040 0.000 1.099 165 S HN -0.594 7.677 8.310 0.079 0.086 0.617 166 R N -0.695 119.869 120.500 0.107 0.000 2.552 166 R HA 0.164 4.565 4.340 0.102 0.000 0.314 166 R C -1.203 175.231 176.300 0.223 0.000 1.041 166 R CA 0.220 56.396 56.100 0.127 0.000 1.076 166 R CB 0.335 30.701 30.300 0.110 0.000 1.290 166 R HN -0.467 7.757 8.270 0.117 0.116 0.563 167 Y N -1.228 119.091 120.300 0.032 0.000 2.927 167 Y HA -0.104 4.466 4.550 0.032 0.000 0.392 167 Y C -1.851 174.070 175.900 0.035 0.000 1.159 167 Y CA -0.682 57.439 58.100 0.035 0.000 1.220 167 Y CB 1.116 39.601 38.460 0.041 0.000 1.506 167 Y HN -0.747 7.560 8.280 0.160 0.069 0.481 168 N N 1.367 119.544 118.700 -0.872 0.000 2.421 168 N HA -0.036 4.532 4.740 -0.286 0.000 0.201 168 N C -1.506 173.815 175.510 -0.316 0.000 1.198 168 N CA -0.092 52.639 53.050 -0.532 0.000 0.838 168 N CB -0.438 37.710 38.487 -0.564 0.000 1.011 168 N HN -0.001 7.245 8.380 -1.890 0.000 0.463 169 I N 0.152 120.659 120.570 -0.105 0.000 2.359 169 I HA 0.051 4.436 4.170 0.055 -0.183 0.294 169 I C -1.886 174.284 176.117 0.087 0.000 0.987 169 I CA -1.458 59.904 61.300 0.103 0.000 1.225 169 I CB 1.859 40.087 38.000 0.380 0.000 1.366 169 I HN -0.999 7.138 8.210 0.007 0.078 0.466 170 R N 8.610 129.147 120.500 0.062 0.000 2.229 170 R HA 0.223 4.583 4.340 0.034 0.000 0.328 170 R C -2.510 173.816 176.300 0.044 0.000 1.009 170 R CA -0.625 55.498 56.100 0.038 0.000 0.864 170 R CB 1.672 31.980 30.300 0.013 0.000 1.085 170 R HN 0.307 8.614 8.270 0.061 0.000 0.453 171 L N 5.783 127.028 121.223 0.036 0.000 2.377 171 L HA 0.280 4.777 4.340 0.038 -0.134 0.270 171 L C -0.702 176.174 176.870 0.010 0.000 0.991 171 L CA -1.072 53.788 54.840 0.034 0.000 0.851 171 L CB 1.689 43.778 42.059 0.050 0.000 1.218 171 L HN 0.320 8.568 8.230 0.030 0.000 0.420 172 K N 6.956 127.353 120.400 -0.006 0.000 2.126 172 K HA 0.224 4.539 4.320 -0.009 0.000 0.257 172 K C -1.734 174.860 176.600 -0.009 0.000 1.007 172 K CA -0.109 56.170 56.287 -0.014 0.000 0.928 172 K CB 1.908 34.388 32.500 -0.033 0.000 1.013 172 K HN 0.045 8.288 8.250 -0.012 0.000 0.473 173 I N 1.510 122.083 120.570 0.003 0.000 2.499 173 I HA 0.667 5.037 4.170 0.034 -0.179 0.288 173 I C -0.189 175.960 176.117 0.053 0.000 1.048 173 I CA -1.140 60.181 61.300 0.035 0.000 1.062 173 I CB 2.702 40.727 38.000 0.042 0.000 1.238 173 I HN 0.196 8.407 8.210 0.002 0.000 0.426 174 R N 6.115 126.657 120.500 0.068 0.000 2.855 174 R HA 0.434 4.783 4.340 0.015 0.000 0.266 174 R C -2.371 173.897 176.300 -0.054 0.000 1.034 174 R CA -1.983 54.124 56.100 0.012 0.000 0.944 174 R CB 4.446 34.721 30.300 -0.041 0.000 1.219 174 R HN 0.591 8.912 8.270 0.085 0.000 0.474 175 Q N 0.472 120.143 119.800 -0.215 0.000 2.347 175 Q HA 0.546 4.551 4.340 -0.834 -0.166 0.271 175 Q C -0.970 174.838 176.000 -0.319 0.000 1.064 175 Q CA -1.539 53.928 55.803 -0.562 0.000 0.800 175 Q CB 3.570 31.878 28.738 -0.717 0.000 1.304 175 Q HN 0.090 8.270 8.270 -0.150 0.000 0.438 176 L N 5.912 126.953 121.223 -0.303 0.000 2.483 176 L HA -0.033 4.240 4.340 -0.112 0.000 0.276 176 L C -1.441 175.338 176.870 -0.151 0.000 1.213 176 L CA -0.724 54.019 54.840 -0.160 0.000 0.843 176 L CB -0.790 41.200 42.059 -0.114 0.000 1.107 176 L HN 0.185 8.189 8.230 -0.377 0.000 0.487 177 P HA -0.010 4.361 4.420 -0.082 0.000 0.262 177 P C -0.198 177.055 177.300 -0.080 0.000 1.182 177 P CA 0.149 63.200 63.100 -0.081 0.000 0.761 177 P CB 0.399 32.063 31.700 -0.059 0.000 0.795 178 I N -1.943 118.583 120.570 -0.073 0.000 3.030 178 I HA -0.028 4.102 4.170 -0.067 0.000 0.270 178 I C 0.286 176.374 176.117 -0.048 0.000 1.211 178 I CA 1.564 62.827 61.300 -0.062 0.000 1.479 178 I CB -0.082 37.885 38.000 -0.055 0.000 1.105 178 I HN -0.029 8.139 8.210 -0.070 0.000 0.447 179 D N 0.248 120.622 120.400 -0.043 0.000 2.339 179 D HA 0.181 4.801 4.640 -0.033 0.000 0.217 179 D C -0.549 175.731 176.300 -0.034 0.000 1.050 179 D CA 0.569 54.548 54.000 -0.035 0.000 0.856 179 D CB 0.099 40.881 40.800 -0.030 0.000 0.922 179 D HN 0.140 8.484 8.370 -0.045 0.000 0.518 180 S N -2.139 113.537 115.700 -0.039 0.000 2.625 180 S HA 0.155 4.605 4.470 -0.034 0.000 0.271 180 S C -1.703 172.871 174.600 -0.043 0.000 1.161 180 S CA -1.394 56.783 58.200 -0.037 0.000 0.820 180 S CB 1.551 64.731 63.200 -0.034 0.000 1.137 180 S HN -0.916 7.309 8.310 -0.045 0.058 0.470 181 D N -0.405 119.971 120.400 -0.041 0.000 2.398 181 D HA 0.128 4.737 4.640 -0.052 0.000 0.210 181 D C -0.950 175.323 176.300 -0.045 0.000 1.094 181 D CA 0.257 54.229 54.000 -0.047 0.000 0.839 181 D CB 0.490 41.262 40.800 -0.047 0.000 0.963 181 D HN 0.054 8.402 8.370 -0.037 0.000 0.506 182 D N 1.126 121.503 120.400 -0.039 0.000 2.453 182 D HA 0.097 4.715 4.640 -0.036 0.000 0.223 182 D C 0.396 176.674 176.300 -0.038 0.000 1.183 182 D CA -0.480 53.499 54.000 -0.035 0.000 0.933 182 D CB -0.287 40.496 40.800 -0.028 0.000 1.038 182 D HN -0.694 7.592 8.370 -0.037 0.062 0.513 183 S N 4.977 120.651 115.700 -0.043 0.000 2.701 183 S HA 0.022 4.469 4.470 -0.039 0.000 0.220 183 S C 1.075 175.656 174.600 -0.031 0.000 0.954 183 S CA 0.691 58.867 58.200 -0.040 0.000 0.936 183 S CB 0.128 63.300 63.200 -0.047 0.000 0.777 183 S HN 0.045 8.584 8.310 -0.048 -0.257 0.518 184 R N 2.354 122.837 120.500 -0.029 0.000 2.073 184 R HA -0.238 4.089 4.340 -0.022 0.000 0.234 184 R C -0.584 175.706 176.300 -0.017 0.000 1.134 184 R CA 5.577 61.664 56.100 -0.021 0.000 0.952 184 R CB -2.250 28.041 30.300 -0.017 0.000 0.850 184 R HN -0.368 8.079 8.270 -0.029 -0.195 0.433 185 P HA -0.219 4.192 4.420 -0.015 0.000 0.215 185 P C 1.252 178.540 177.300 -0.019 0.000 1.157 185 P CA 3.262 66.352 63.100 -0.018 0.000 0.868 185 P CB -0.535 31.153 31.700 -0.021 0.000 0.788 186 L N -2.621 118.588 121.223 -0.023 0.000 1.990 186 L HA -0.315 4.008 4.340 -0.028 0.000 0.213 186 L C 1.817 178.678 176.870 -0.015 0.000 1.072 186 L CA 2.877 57.703 54.840 -0.024 0.000 0.755 186 L CB -0.314 41.729 42.059 -0.026 0.000 0.889 186 L HN -0.377 7.837 8.230 -0.026 0.000 0.432 187 L N -2.591 118.628 121.223 -0.006 0.000 2.079 187 L HA -0.544 3.804 4.340 0.013 0.000 0.210 187 L C 2.457 179.329 176.870 0.004 0.000 1.081 187 L CA 3.113 57.955 54.840 0.004 0.000 0.752 187 L CB -0.751 41.307 42.059 -0.002 0.000 0.896 187 L HN -0.542 7.605 8.230 -0.009 0.077 0.433 188 K N -2.303 118.096 120.400 -0.002 0.000 2.063 188 K HA -0.449 3.875 4.320 0.008 0.000 0.208 188 K C 1.905 178.500 176.600 -0.009 0.000 1.048 188 K CA 4.107 60.394 56.287 -0.000 0.000 0.928 188 K CB -0.475 32.023 32.500 -0.003 0.000 0.713 188 K HN -0.111 8.136 8.250 -0.006 0.000 0.442 189 E N -0.539 119.651 120.200 -0.017 0.000 2.150 189 E HA -0.249 4.084 4.350 -0.027 0.000 0.193 189 E C 2.628 179.203 176.600 -0.041 0.000 0.985 189 E CA 2.735 59.119 56.400 -0.028 0.000 0.814 189 E CB -0.314 29.369 29.700 -0.029 0.000 0.752 189 E HN -0.551 7.712 8.360 -0.017 0.086 0.466 190 M N -0.838 118.741 119.600 -0.036 0.000 2.200 190 M HA -0.219 4.457 4.480 -0.077 -0.241 0.265 190 M C 2.111 178.367 176.300 -0.074 0.000 1.066 190 M CA 3.523 58.790 55.300 -0.055 0.000 1.127 190 M CB 0.328 32.910 32.600 -0.029 0.000 1.379 190 M HN -0.439 7.837 8.290 -0.024 0.000 0.420 191 K N 0.036 120.424 120.400 -0.019 0.000 2.025 191 K HA -0.277 4.049 4.320 0.011 0.000 0.207 191 K C 3.314 179.880 176.600 -0.056 0.000 1.049 191 K CA 3.236 59.524 56.287 0.002 0.000 0.933 191 K CB -0.135 32.406 32.500 0.068 0.000 0.714 191 K HN -0.252 7.998 8.250 -0.001 0.000 0.438 192 R N -1.355 119.120 120.500 -0.041 0.000 2.091 192 R HA -0.237 4.082 4.340 -0.035 0.000 0.238 192 R C 2.057 178.305 176.300 -0.086 0.000 1.136 192 R CA 2.628 58.700 56.100 -0.047 0.000 0.959 192 R CB -0.186 30.095 30.300 -0.032 0.000 0.856 192 R HN -0.043 8.211 8.270 -0.027 0.000 0.437 193 G N -4.806 103.930 108.800 -0.106 0.000 2.625 193 G HA2 -0.096 3.804 3.960 -0.101 0.000 0.214 193 G HA3 -0.096 3.948 3.960 -0.123 -0.157 0.214 193 G C -0.868 173.901 174.900 -0.218 0.000 1.132 193 G CA -0.274 44.748 45.100 -0.130 0.000 0.782 193 G HN -0.423 7.738 8.290 -0.094 0.073 0.538 194 R N -5.355 114.945 120.500 -0.335 0.000 3.770 194 R HA -0.592 3.187 4.340 -0.935 0.000 0.305 194 R C -0.903 174.815 176.300 -0.970 0.000 1.184 194 R CA 0.843 56.530 56.100 -0.689 0.000 0.823 194 R CB -3.334 26.781 30.300 -0.308 0.000 1.285 194 R HN -0.510 7.391 8.270 -0.281 0.201 0.499 195 E N -0.735 119.098 120.200 -0.613 0.000 2.104 195 E HA -0.122 4.011 4.350 -0.362 0.000 0.278 195 E C -0.963 175.374 176.600 -0.439 0.000 1.127 195 E CA 0.596 56.744 56.400 -0.419 0.000 0.897 195 E CB -0.386 29.190 29.700 -0.206 0.000 1.043 195 E HN -0.554 7.509 8.360 -0.440 0.034 0.410 196 F N 2.643 122.505 119.950 -0.147 0.000 2.559 196 F HA 0.057 4.463 4.527 -0.201 0.000 0.286 196 F C -0.186 175.538 175.800 -0.128 0.000 1.108 196 F CA 0.993 58.852 58.000 -0.235 0.000 1.436 196 F CB 1.574 40.303 39.000 -0.452 0.000 1.130 196 F HN -0.210 7.955 8.300 -0.224 0.000 0.584 197 R N -0.716 119.679 120.500 -0.174 0.000 2.207 197 R HA 0.500 4.767 4.340 -0.413 -0.175 0.334 197 R C -1.358 174.772 176.300 -0.283 0.000 1.013 197 R CA -0.007 55.756 56.100 -0.562 0.000 0.858 197 R CB 0.447 29.817 30.300 -1.550 0.000 1.094 197 R HN -0.377 7.764 8.270 -0.216 0.000 0.457 198 I N 2.834 123.416 120.570 0.019 0.000 2.619 198 I HA 0.434 4.670 4.170 -0.138 -0.149 0.292 198 I C -1.731 174.327 176.117 -0.099 0.000 1.100 198 I CA -1.211 60.039 61.300 -0.083 0.000 1.043 198 I CB 4.583 42.423 38.000 -0.266 0.000 1.239 198 I HN 0.323 8.652 8.210 0.200 0.000 0.420 199 I N 3.874 124.311 120.570 -0.222 0.000 2.362 199 I HA 0.405 4.684 4.170 -0.110 -0.174 0.289 199 I C -1.368 174.519 176.117 -0.383 0.000 0.994 199 I CA -1.067 60.125 61.300 -0.181 0.000 1.158 199 I CB 1.953 39.949 38.000 -0.008 0.000 1.315 199 I HN 0.432 8.508 8.210 -0.223 0.000 0.451 200 F N 7.539 127.364 119.950 -0.208 0.000 2.361 200 F HA 0.517 5.166 4.527 -0.091 -0.177 0.364 200 F C -1.234 174.589 175.800 0.038 0.000 1.117 200 F CA -1.617 56.293 58.000 -0.150 0.000 1.071 200 F CB 1.533 40.333 39.000 -0.334 0.000 1.188 200 F HN 0.717 8.918 8.300 -0.164 0.000 0.464 201 D N 4.230 124.767 120.400 0.229 0.000 2.317 201 D HA 0.805 5.596 4.640 0.253 0.000 0.234 201 D C -0.679 175.751 176.300 0.217 0.000 1.112 201 D CA -0.982 53.150 54.000 0.220 0.000 0.840 201 D CB 1.745 42.629 40.800 0.140 0.000 1.078 201 D HN 0.104 8.584 8.370 0.184 0.000 0.486 202 C N 1.774 121.209 119.300 0.225 0.000 3.045 202 C HA 0.386 4.918 4.460 0.119 0.000 0.338 202 C C -2.139 172.946 174.990 0.158 0.000 1.267 202 C CA -1.752 57.362 59.018 0.160 0.000 1.177 202 C CB 2.710 30.537 27.740 0.144 0.000 1.380 202 C HN -0.164 8.222 8.230 0.260 0.000 0.469 203 S N 0.328 116.082 115.700 0.090 0.000 2.580 203 S HA 0.013 4.583 4.470 0.166 0.000 0.266 203 S C 1.447 176.072 174.600 0.041 0.000 1.354 203 S CA 0.076 58.329 58.200 0.087 0.000 1.008 203 S CB 1.557 64.758 63.200 0.002 0.000 0.898 203 S HN 0.367 8.711 8.310 0.056 0.000 0.555 204 H N 1.117 120.204 119.070 0.027 0.000 2.421 204 H HA -0.253 4.269 4.556 -0.056 0.000 0.298 204 H C 1.644 176.938 175.328 -0.058 0.000 1.087 204 H CA 3.295 59.323 56.048 -0.033 0.000 1.330 204 H CB -1.101 28.635 29.762 -0.043 0.000 1.388 204 H HN 0.700 9.211 8.280 0.385 0.000 0.526 205 T N 2.083 116.128 114.554 -0.848 0.000 2.643 205 T HA -0.412 3.677 4.350 -0.435 0.000 0.264 205 T C 1.720 176.273 174.700 -0.246 0.000 1.045 205 T CA 4.132 65.924 62.100 -0.514 0.000 1.155 205 T CB -0.145 68.451 68.868 -0.454 0.000 0.863 205 T HN -0.296 7.218 8.240 -1.192 0.010 0.420 206 M N 1.030 120.517 119.600 -0.188 0.000 2.106 206 M HA -0.398 4.014 4.480 -0.113 0.000 0.259 206 M C 1.295 177.521 176.300 -0.123 0.000 1.068 206 M CA 2.247 57.477 55.300 -0.116 0.000 1.100 206 M CB -0.522 32.040 32.600 -0.063 0.000 1.351 206 M HN -0.725 7.447 8.290 -0.196 0.000 0.404 207 A N -1.351 121.395 122.820 -0.122 0.000 1.908 207 A HA -0.318 3.925 4.320 -0.128 0.000 0.218 207 A C 1.635 179.059 177.584 -0.267 0.000 1.181 207 A CA 3.102 55.022 52.037 -0.195 0.000 0.627 207 A CB -0.875 17.951 19.000 -0.291 0.000 0.818 207 A HN -0.078 7.919 8.150 -0.107 0.088 0.445 208 A N -1.971 120.733 122.820 -0.193 0.000 1.902 208 A HA -0.443 3.806 4.320 -0.119 0.000 0.217 208 A C 1.758 179.285 177.584 -0.095 0.000 1.181 208 A CA 3.053 55.018 52.037 -0.121 0.000 0.623 208 A CB -0.839 18.120 19.000 -0.069 0.000 0.818 208 A HN -0.277 7.768 8.150 -0.175 0.000 0.443 209 Q N -0.827 118.908 119.800 -0.108 0.000 2.084 209 Q HA -0.297 4.007 4.340 -0.061 0.000 0.202 209 Q C 2.479 178.405 176.000 -0.122 0.000 0.978 209 Q CA 2.678 58.427 55.803 -0.090 0.000 0.844 209 Q CB -0.425 28.259 28.738 -0.088 0.000 0.898 209 Q HN -0.604 7.594 8.270 -0.120 0.000 0.426 210 I N 0.058 120.514 120.570 -0.190 0.000 2.252 210 I HA -0.441 3.592 4.170 -0.229 0.000 0.245 210 I C 2.160 178.099 176.117 -0.296 0.000 1.102 210 I CA 4.027 65.157 61.300 -0.282 0.000 1.385 210 I CB 0.000 37.706 38.000 -0.491 0.000 1.064 210 I HN -0.149 7.855 8.210 -0.196 0.088 0.414 211 L N -0.220 120.824 121.223 -0.298 0.000 1.989 211 L HA -0.491 3.624 4.340 -0.375 0.000 0.211 211 L C 2.141 178.842 176.870 -0.281 0.000 1.071 211 L CA 3.465 58.068 54.840 -0.394 0.000 0.749 211 L CB -0.601 41.101 42.059 -0.595 0.000 0.890 211 L HN -0.030 8.027 8.230 -0.288 0.000 0.431 212 K N -1.635 118.733 120.400 -0.053 0.000 2.103 212 K HA -0.444 4.025 4.320 0.249 0.000 0.207 212 K C 2.627 179.241 176.600 0.024 0.000 1.048 212 K CA 3.171 59.518 56.287 0.101 0.000 0.930 212 K CB -0.253 32.309 32.500 0.103 0.000 0.716 212 K HN -0.620 7.610 8.250 -0.034 0.000 0.444 213 Q N -1.759 118.017 119.800 -0.040 0.000 2.163 213 Q HA -0.184 4.148 4.340 -0.013 0.000 0.198 213 Q C 2.444 178.418 176.000 -0.044 0.000 0.954 213 Q CA 2.359 58.139 55.803 -0.037 0.000 0.851 213 Q CB 0.191 28.897 28.738 -0.053 0.000 0.928 213 Q HN -0.506 7.708 8.270 -0.074 0.012 0.459 214 A N 0.434 123.202 122.820 -0.087 0.000 1.917 214 A HA -0.320 3.963 4.320 -0.062 0.000 0.219 214 A C 1.570 179.141 177.584 -0.022 0.000 1.182 214 A CA 3.169 55.165 52.037 -0.069 0.000 0.633 214 A CB -0.654 18.287 19.000 -0.098 0.000 0.819 214 A HN 0.383 8.455 8.150 -0.130 0.000 0.448 215 M N -1.594 118.007 119.600 0.001 0.000 2.099 215 M HA -0.346 4.166 4.480 0.054 0.000 0.262 215 M C 2.275 178.608 176.300 0.055 0.000 1.067 215 M CA 3.487 58.823 55.300 0.060 0.000 1.124 215 M CB 0.060 32.758 32.600 0.163 0.000 1.353 215 M HN -0.329 7.950 8.290 -0.017 0.000 0.410 216 A N 0.032 122.880 122.820 0.047 0.000 2.032 216 A HA -0.274 4.073 4.320 0.045 0.000 0.221 216 A C 1.602 179.202 177.584 0.026 0.000 1.165 216 A CA 2.812 54.871 52.037 0.036 0.000 0.645 216 A CB -0.517 18.499 19.000 0.026 0.000 0.807 216 A HN -0.441 7.737 8.150 0.046 0.000 0.453 217 M N -4.972 114.637 119.600 0.014 0.000 2.561 217 M HA 0.106 4.596 4.480 0.016 0.000 0.238 217 M C 0.309 176.621 176.300 0.020 0.000 1.131 217 M CA -2.157 53.149 55.300 0.011 0.000 1.046 217 M CB -0.653 31.945 32.600 -0.003 0.000 1.532 217 M HN -0.537 7.614 8.290 0.006 0.142 0.497 218 G N -1.536 107.279 108.800 0.026 0.000 2.176 218 G HA2 -0.432 3.563 3.960 0.058 0.000 0.252 218 G HA3 -0.432 3.568 3.960 0.066 0.000 0.252 218 G C -0.170 174.738 174.900 0.014 0.000 1.024 218 G CA 1.001 46.130 45.100 0.047 0.000 0.755 218 G HN 0.025 8.156 8.290 0.029 0.176 0.507 219 M N -3.228 116.305 119.600 -0.112 0.000 2.313 219 M HA 0.084 4.143 4.480 -0.701 0.000 0.273 219 M C -0.399 175.631 176.300 -0.450 0.000 1.049 219 M CA -0.129 54.855 55.300 -0.528 0.000 1.004 219 M CB 0.967 33.252 32.600 -0.525 0.000 1.461 219 M HN -0.428 7.817 8.290 -0.075 0.000 0.514 220 M N 0.736 120.285 119.600 -0.085 0.000 3.176 220 M HA 0.016 4.492 4.480 -0.007 0.000 0.284 220 M C -1.358 174.979 176.300 0.062 0.000 1.392 220 M CA -0.558 54.750 55.300 0.012 0.000 1.520 220 M CB -2.063 30.583 32.600 0.076 0.000 1.100 220 M HN -0.245 8.027 8.290 -0.030 0.000 0.555 221 T N -2.377 112.243 114.554 0.110 0.000 2.654 221 T HA 0.443 4.853 4.350 0.100 0.000 0.289 221 T C 0.064 174.829 174.700 0.109 0.000 1.062 221 T CA -2.739 59.455 62.100 0.156 0.000 1.041 221 T CB 2.397 71.422 68.868 0.263 0.000 1.417 221 T HN -0.738 7.576 8.240 0.124 0.000 0.510 222 E N -0.140 120.049 120.200 -0.018 0.000 2.482 222 E HA -0.122 4.339 4.350 -0.117 -0.181 0.196 222 E C -0.091 176.363 176.600 -0.242 0.000 1.047 222 E CA 1.654 57.957 56.400 -0.161 0.000 0.869 222 E CB -1.243 28.307 29.700 -0.250 0.000 0.836 222 E HN 0.479 8.816 8.360 -0.038 0.000 0.520 223 Y N -2.178 118.080 120.300 -0.070 0.000 2.544 223 Y HA -0.204 4.123 4.550 -0.372 0.000 0.286 223 Y C -0.529 175.122 175.900 -0.415 0.000 1.141 223 Y CA 1.577 59.472 58.100 -0.342 0.000 1.299 223 Y CB 0.431 38.578 38.460 -0.522 0.000 1.030 223 Y HN -0.798 7.491 8.280 0.092 0.046 0.543 224 Y N -2.932 117.368 120.300 -0.001 0.000 2.487 224 Y HA 0.106 4.846 4.550 0.087 -0.138 0.337 224 Y C -1.333 174.446 175.900 -0.201 0.000 1.076 224 Y CA -0.988 57.070 58.100 -0.070 0.000 1.115 224 Y CB 3.256 41.592 38.460 -0.207 0.000 1.235 224 Y HN -0.764 7.630 8.280 0.262 0.043 0.468 225 H N 1.945 120.951 119.070 -0.106 0.000 3.013 225 H HA 0.513 5.216 4.556 -0.081 -0.196 0.326 225 H C -1.728 173.725 175.328 0.207 0.000 0.973 225 H CA -2.340 53.707 56.048 -0.001 0.000 1.369 225 H CB 3.218 33.115 29.762 0.226 0.000 1.598 225 H HN 0.215 8.583 8.280 0.147 0.000 0.518 226 F N 5.516 125.812 119.950 0.576 0.000 2.421 226 F HA 0.710 5.571 4.527 0.242 -0.189 0.337 226 F C -0.830 175.139 175.800 0.281 0.000 1.105 226 F CA -3.610 54.594 58.000 0.340 0.000 1.049 226 F CB 1.748 40.935 39.000 0.312 0.000 1.139 226 F HN 0.226 8.732 8.300 0.342 0.000 0.479 227 I N 0.159 120.889 120.570 0.267 0.000 2.404 227 I HA 0.557 5.066 4.170 0.220 -0.207 0.293 227 I C -1.392 174.715 176.117 -0.016 0.000 0.992 227 I CA -1.173 60.208 61.300 0.136 0.000 1.149 227 I CB 2.786 40.808 38.000 0.037 0.000 1.315 227 I HN 0.726 9.070 8.210 0.224 0.000 0.446 228 F N 5.611 125.734 119.950 0.288 0.000 2.469 228 F HA 0.568 5.448 4.527 0.332 -0.153 0.332 228 F C 0.784 176.764 175.800 0.299 0.000 1.103 228 F CA -1.208 56.965 58.000 0.290 0.000 0.979 228 F CB 2.715 41.853 39.000 0.231 0.000 1.137 228 F HN 0.282 8.864 8.300 0.469 0.000 0.463 229 T N -0.970 113.854 114.554 0.450 0.000 3.081 229 T HA -0.114 4.494 4.350 0.429 0.000 0.255 229 T C 0.716 175.627 174.700 0.352 0.000 1.113 229 T CA 0.870 63.196 62.100 0.376 0.000 1.082 229 T CB 0.368 69.406 68.868 0.283 0.000 0.939 229 T HN 0.081 8.576 8.240 0.425 0.000 0.506 230 T N 3.454 118.235 114.554 0.379 0.000 2.871 230 T HA -0.187 4.348 4.350 0.308 0.000 0.296 230 T C 1.554 176.420 174.700 0.278 0.000 0.998 230 T CA 0.046 62.331 62.100 0.309 0.000 1.162 230 T CB 0.738 69.767 68.868 0.268 0.000 0.947 230 T HN -0.410 8.059 8.240 0.439 0.034 0.536 231 L N 7.263 128.630 121.223 0.241 0.000 2.551 231 L HA -0.071 4.407 4.340 0.229 0.000 0.228 231 L C 0.468 177.483 176.870 0.243 0.000 1.153 231 L CA 1.391 56.358 54.840 0.210 0.000 0.851 231 L CB -0.140 41.986 42.059 0.111 0.000 0.959 231 L HN 0.479 8.861 8.230 0.254 0.000 0.451 232 D N -1.670 118.823 120.400 0.155 0.000 2.342 232 D HA 0.156 4.761 4.640 -0.058 0.000 0.221 232 D C 1.215 177.451 176.300 -0.107 0.000 1.101 232 D CA 0.382 54.360 54.000 -0.036 0.000 0.837 232 D CB 0.029 40.722 40.800 -0.178 0.000 0.938 232 D HN -0.553 7.855 8.370 0.167 0.062 0.508 233 L N 1.630 122.895 121.223 0.070 0.000 2.013 233 L HA -0.343 3.967 4.340 -0.049 0.000 0.212 233 L C 0.658 177.526 176.870 -0.004 0.000 1.073 233 L CA 3.322 58.180 54.840 0.029 0.000 0.753 233 L CB -0.308 41.825 42.059 0.124 0.000 0.890 233 L HN -0.824 7.434 8.230 0.163 0.070 0.432 234 Y N -6.679 113.627 120.300 0.011 0.000 2.651 234 Y HA -0.283 4.270 4.550 0.005 0.000 0.296 234 Y C -0.192 175.706 175.900 -0.004 0.000 1.150 234 Y CA 0.605 58.708 58.100 0.004 0.000 1.348 234 Y CB -1.245 37.219 38.460 0.007 0.000 0.983 234 Y HN -0.093 8.433 8.280 0.410 0.000 0.555 235 A N -1.701 120.733 122.820 -0.644 0.000 2.267 235 A HA 0.087 4.128 4.320 -0.464 0.000 0.213 235 A C -0.168 177.287 177.584 -0.215 0.000 1.192 235 A CA -0.216 51.506 52.037 -0.525 0.000 0.851 235 A CB 1.044 19.647 19.000 -0.662 0.000 0.881 235 A HN -0.344 7.250 8.150 -0.606 0.193 0.494 236 L N -0.416 120.723 121.223 -0.140 0.000 2.395 236 L HA -0.056 4.258 4.340 -0.043 0.000 0.269 236 L C -0.434 176.417 176.870 -0.032 0.000 1.133 236 L CA -0.793 54.010 54.840 -0.061 0.000 0.812 236 L CB 0.692 42.710 42.059 -0.069 0.000 1.125 236 L HN -0.758 7.382 8.230 -0.149 0.000 0.452 237 D N 1.566 121.956 120.400 -0.017 0.000 2.342 237 D HA -0.105 4.517 4.640 -0.030 0.000 0.260 237 D C 0.001 176.295 176.300 -0.009 0.000 1.278 237 D CA 0.366 54.350 54.000 -0.026 0.000 0.910 237 D CB -0.237 40.537 40.800 -0.043 0.000 1.079 237 D HN 0.193 8.555 8.370 -0.014 0.000 0.496 238 L N 4.115 125.338 121.223 -0.001 0.000 2.769 238 L HA 0.266 4.720 4.340 0.189 0.000 0.240 238 L C 1.092 177.916 176.870 -0.077 0.000 1.163 238 L CA -0.963 53.914 54.840 0.061 0.000 0.962 238 L CB -0.064 42.056 42.059 0.102 0.000 1.258 238 L HN 0.168 8.391 8.230 -0.010 0.000 0.513 239 E N 1.378 121.494 120.200 -0.140 0.000 2.106 239 E HA -0.173 4.101 4.350 -0.126 0.000 0.192 239 E C -0.135 176.345 176.600 -0.201 0.000 0.984 239 E CA 3.462 59.780 56.400 -0.137 0.000 0.806 239 E CB -2.362 27.294 29.700 -0.075 0.000 0.750 239 E HN -0.506 7.910 8.360 -0.125 -0.131 0.458 240 P HA -0.152 4.117 4.420 -0.252 0.000 0.231 240 P C -0.632 176.419 177.300 -0.416 0.000 1.158 240 P CA 1.643 64.438 63.100 -0.508 0.000 0.763 240 P CB -0.310 30.882 31.700 -0.847 0.000 0.805 241 Y N -7.020 113.286 120.300 0.010 0.000 2.423 241 Y HA 0.265 4.839 4.550 0.040 0.000 0.257 241 Y C 1.495 177.370 175.900 -0.042 0.000 1.087 241 Y CA -0.813 57.295 58.100 0.012 0.000 1.258 241 Y CB 0.943 39.419 38.460 0.028 0.000 1.237 241 Y HN -0.540 7.413 8.280 -0.240 0.182 0.517 242 R N 1.720 122.185 120.500 -0.058 0.000 2.285 242 R HA -0.231 4.049 4.340 -0.101 0.000 0.213 242 R C 0.313 176.407 176.300 -0.343 0.000 1.068 242 R CA 2.977 58.934 56.100 -0.239 0.000 1.004 242 R CB -0.751 29.318 30.300 -0.386 0.000 0.873 242 R HN -0.729 7.469 8.270 -0.120 0.000 0.467 243 Y N -2.818 117.511 120.300 0.049 0.000 2.524 243 Y HA 0.150 4.713 4.550 0.023 0.000 0.266 243 Y C 0.511 176.433 175.900 0.037 0.000 1.180 243 Y CA -0.353 57.766 58.100 0.031 0.000 1.244 243 Y CB -0.696 37.775 38.460 0.017 0.000 1.125 243 Y HN -0.206 8.026 8.280 -0.013 0.039 0.524 244 S N -0.226 115.565 115.700 0.151 0.000 2.458 244 S HA -0.039 4.510 4.470 0.131 0.000 0.223 244 S C 1.470 176.112 174.600 0.070 0.000 1.019 244 S CA 0.528 58.802 58.200 0.123 0.000 0.937 244 S CB 0.912 64.195 63.200 0.137 0.000 0.788 244 S HN -0.515 7.813 8.310 0.122 0.055 0.511 245 G N 0.753 109.577 108.800 0.039 0.000 2.238 245 G HA2 -0.297 3.654 3.960 -0.016 0.000 0.217 245 G HA3 -0.297 3.653 3.960 -0.018 0.000 0.217 245 G C -0.184 174.689 174.900 -0.045 0.000 0.996 245 G CA -0.312 44.782 45.100 -0.010 0.000 0.632 245 G HN 0.013 8.327 8.290 0.040 0.000 0.503 246 V N 2.392 122.288 119.914 -0.029 0.000 2.843 246 V HA -0.411 3.855 4.120 -0.103 -0.207 0.305 246 V C -0.058 175.961 176.094 -0.125 0.000 1.120 246 V CA 1.742 63.990 62.300 -0.086 0.000 1.254 246 V CB 0.121 31.893 31.823 -0.084 0.000 0.901 246 V HN -0.681 7.455 8.190 0.005 0.058 0.503 247 N N 5.105 123.669 118.700 -0.226 0.000 2.455 247 N HA 0.073 4.643 4.740 -0.283 0.000 0.280 247 N C -1.803 173.631 175.510 -0.128 0.000 1.055 247 N CA -0.530 52.289 53.050 -0.384 0.000 0.961 247 N CB 1.398 39.214 38.487 -1.119 0.000 1.121 247 N HN -0.368 7.869 8.380 -0.239 0.000 0.476 248 L N 4.581 125.826 121.223 0.036 0.000 2.439 248 L HA 0.693 5.481 4.340 0.429 -0.191 0.270 248 L C -1.721 175.307 176.870 0.264 0.000 0.972 248 L CA -0.483 54.524 54.840 0.278 0.000 0.836 248 L CB 3.634 45.851 42.059 0.263 0.000 1.255 248 L HN 0.571 8.791 8.230 -0.016 0.000 0.404 249 T N 6.016 120.773 114.554 0.339 0.000 2.896 249 T HA 0.841 5.416 4.350 0.104 -0.163 0.297 249 T C -1.576 173.176 174.700 0.086 0.000 1.108 249 T CA -1.584 60.612 62.100 0.160 0.000 1.004 249 T CB 3.421 72.372 68.868 0.138 0.000 1.159 249 T HN 0.281 8.777 8.240 0.426 0.000 0.499 250 G N 0.785 109.503 108.800 -0.138 0.000 2.428 250 G HA2 0.582 4.377 3.960 -0.375 0.000 0.305 250 G HA3 0.582 4.582 3.960 0.067 0.000 0.305 250 G C -3.117 171.467 174.900 -0.527 0.000 1.260 250 G CA 0.707 45.662 45.100 -0.241 0.000 0.853 250 G HN -0.235 7.941 8.290 -0.190 0.000 0.480 251 F N -2.022 117.982 119.950 0.089 0.000 2.598 251 F HA 0.891 5.579 4.527 0.037 -0.139 0.327 251 F C -0.815 175.021 175.800 0.062 0.000 1.057 251 F CA -1.835 56.192 58.000 0.045 0.000 0.957 251 F CB 4.993 43.986 39.000 -0.010 0.000 1.278 251 F HN -0.203 8.284 8.300 0.312 0.000 0.484 252 R N -0.838 119.790 120.500 0.213 0.000 2.508 252 R HA 0.399 4.803 4.340 0.108 0.000 0.283 252 R C -2.132 174.186 176.300 0.029 0.000 1.120 252 R CA -0.274 55.871 56.100 0.076 0.000 0.958 252 R CB 3.780 34.048 30.300 -0.054 0.000 1.215 252 R HN 0.046 8.458 8.270 0.237 0.000 0.427 253 I N 5.469 126.026 120.570 -0.022 0.000 3.941 253 I HA 0.079 4.250 4.170 0.002 0.000 0.321 253 I C -1.497 174.570 176.117 -0.084 0.000 1.284 253 I CA -0.382 60.889 61.300 -0.048 0.000 1.226 253 I CB 1.217 39.136 38.000 -0.135 0.000 1.045 253 I HN 0.749 8.946 8.210 -0.021 0.000 0.420 254 L N 0.374 121.514 121.223 -0.138 0.000 2.433 254 L HA -0.182 4.082 4.340 -0.128 0.000 0.275 254 L C -0.874 175.888 176.870 -0.180 0.000 1.128 254 L CA 0.560 55.296 54.840 -0.173 0.000 0.875 254 L CB 0.469 42.380 42.059 -0.247 0.000 1.171 254 L HN -0.613 7.524 8.230 -0.156 0.000 0.463 255 N N 7.192 125.817 118.700 -0.125 0.000 3.178 255 N HA -0.019 4.668 4.740 -0.088 0.000 0.300 255 N C 0.494 175.941 175.510 -0.104 0.000 1.242 255 N CA -1.433 51.558 53.050 -0.097 0.000 1.192 255 N CB -1.256 37.189 38.487 -0.070 0.000 1.463 255 N HN 0.102 8.414 8.380 -0.113 0.000 0.539 256 V N 2.490 122.323 119.914 -0.134 0.000 2.759 256 V HA -0.478 3.578 4.120 -0.107 0.000 0.256 256 V C 0.279 176.333 176.094 -0.067 0.000 1.080 256 V CA 2.826 65.057 62.300 -0.115 0.000 1.101 256 V CB 0.039 31.767 31.823 -0.159 0.000 0.698 256 V HN -0.283 7.766 8.190 -0.166 0.041 0.477 257 D N -2.569 117.796 120.400 -0.058 0.000 2.104 257 D HA -0.227 4.396 4.640 -0.029 0.000 0.194 257 D C 0.372 176.657 176.300 -0.024 0.000 0.994 257 D CA 2.077 56.056 54.000 -0.034 0.000 0.830 257 D CB -0.048 40.735 40.800 -0.029 0.000 0.959 257 D HN -0.163 8.141 8.370 -0.066 0.026 0.452 258 N N 0.489 119.171 118.700 -0.029 0.000 2.359 258 N HA -0.045 4.690 4.740 -0.008 0.000 0.261 258 N C -0.612 174.900 175.510 0.003 0.000 1.267 258 N CA -1.083 51.959 53.050 -0.014 0.000 0.864 258 N CB 1.242 39.714 38.487 -0.025 0.000 1.063 258 N HN -0.861 7.667 8.380 -0.040 -0.172 0.474 259 P HA -0.259 4.181 4.420 0.032 0.000 0.216 259 P C 0.848 178.206 177.300 0.095 0.000 1.153 259 P CA 2.547 65.674 63.100 0.046 0.000 0.848 259 P CB 0.239 31.964 31.700 0.042 0.000 0.787 260 H N -1.970 117.091 119.070 -0.016 0.000 2.423 260 H HA -0.224 4.337 4.556 0.008 0.000 0.297 260 H C 2.305 177.624 175.328 -0.014 0.000 1.075 260 H CA 2.816 58.860 56.048 -0.007 0.000 1.342 260 H CB 0.173 29.927 29.762 -0.014 0.000 1.395 260 H HN 0.035 8.420 8.280 0.174 0.000 0.530 261 V N -0.134 119.730 119.914 -0.084 0.000 2.307 261 V HA -0.516 3.443 4.120 -0.268 0.000 0.245 261 V C 1.543 177.576 176.094 -0.100 0.000 1.045 261 V CA 3.864 66.065 62.300 -0.166 0.000 1.024 261 V CB -0.150 31.593 31.823 -0.133 0.000 0.651 261 V HN -0.104 8.072 8.190 -0.023 0.000 0.449 262 S N -0.070 115.607 115.700 -0.038 0.000 2.383 262 S HA -0.446 4.016 4.470 -0.014 0.000 0.229 262 S C 2.048 176.659 174.600 0.019 0.000 1.030 262 S CA 3.643 61.839 58.200 -0.007 0.000 1.002 262 S CB -0.198 63.005 63.200 0.006 0.000 0.829 262 S HN -0.525 7.770 8.310 -0.025 0.000 0.467 263 A N 1.338 124.182 122.820 0.040 0.000 1.883 263 A HA -0.287 4.081 4.320 0.079 0.000 0.217 263 A C 1.688 179.315 177.584 0.072 0.000 1.186 263 A CA 3.358 55.442 52.037 0.078 0.000 0.624 263 A CB -0.742 18.347 19.000 0.149 0.000 0.822 263 A HN -0.294 7.885 8.150 0.048 0.000 0.444 264 I N -1.653 118.921 120.570 0.007 0.000 2.286 264 I HA -0.367 3.880 4.170 0.129 0.000 0.245 264 I C 1.993 178.162 176.117 0.087 0.000 1.104 264 I CA 2.325 63.645 61.300 0.033 0.000 1.397 264 I CB -0.725 37.182 38.000 -0.154 0.000 1.072 264 I HN -0.862 7.226 8.210 -0.062 0.084 0.417 265 V N -0.145 119.781 119.914 0.020 0.000 2.469 265 V HA -0.573 3.600 4.120 0.088 0.000 0.251 265 V C 1.936 178.111 176.094 0.135 0.000 1.064 265 V CA 4.709 67.055 62.300 0.076 0.000 1.066 265 V CB -0.590 31.258 31.823 0.040 0.000 0.667 265 V HN 0.141 8.315 8.190 -0.027 0.000 0.461 266 E N 0.316 120.574 120.200 0.097 0.000 2.046 266 E HA -0.242 4.143 4.350 0.059 0.000 0.190 266 E C 2.072 178.725 176.600 0.088 0.000 0.982 266 E CA 2.728 59.174 56.400 0.077 0.000 0.800 266 E CB -0.079 29.660 29.700 0.064 0.000 0.756 266 E HN -0.612 7.775 8.360 0.081 0.021 0.449 267 K N -1.501 118.992 120.400 0.155 0.000 2.063 267 K HA -0.281 4.133 4.320 0.156 0.000 0.208 267 K C 1.956 178.649 176.600 0.156 0.000 1.048 267 K CA 3.026 59.439 56.287 0.210 0.000 0.928 267 K CB -0.270 32.441 32.500 0.351 0.000 0.713 267 K HN -0.688 7.663 8.250 0.168 0.000 0.442 268 W N -0.109 121.146 121.300 -0.075 0.000 2.381 268 W HA -0.246 3.917 4.660 -0.827 0.000 0.301 268 W C 1.167 177.492 176.519 -0.324 0.000 1.205 268 W CA 2.521 59.593 57.345 -0.456 0.000 1.285 268 W CB 0.469 29.647 29.460 -0.470 0.000 1.133 268 W HN -0.345 8.031 8.180 0.326 0.000 0.521 269 S N -0.535 114.976 115.700 -0.316 0.000 2.515 269 S HA -0.238 3.813 4.470 -0.698 0.000 0.231 269 S C 1.135 175.534 174.600 -0.334 0.000 0.987 269 S CA 2.152 60.109 58.200 -0.404 0.000 0.936 269 S CB -0.121 63.016 63.200 -0.106 0.000 0.766 269 S HN -0.519 7.774 8.310 -0.029 0.000 0.528 270 M N -0.823 118.635 119.600 -0.236 0.000 2.618 270 M HA -0.062 4.329 4.480 -0.148 0.000 0.240 270 M C 0.253 176.422 176.300 -0.218 0.000 1.123 270 M CA 2.007 57.208 55.300 -0.165 0.000 1.060 270 M CB 0.220 32.784 32.600 -0.060 0.000 1.535 270 M HN -0.632 7.516 8.290 -0.181 0.033 0.507 271 E N -2.652 117.302 120.200 -0.409 0.000 2.541 271 E HA 0.071 4.268 4.350 -0.255 0.000 0.219 271 E C -0.054 176.109 176.600 -0.728 0.000 0.922 271 E CA -0.447 55.688 56.400 -0.440 0.000 1.095 271 E CB 1.562 31.036 29.700 -0.375 0.000 1.112 271 E HN -0.407 7.427 8.360 -0.559 0.191 0.516 286 G N 1.411 110.198 108.800 -0.021 0.000 2.359 286 G HA2 -0.406 3.538 3.960 -0.027 0.000 0.298 286 G HA3 -0.406 3.556 3.960 0.003 0.000 0.298 286 G C -1.527 173.397 174.900 0.040 0.000 1.030 286 G CA 0.683 45.780 45.100 -0.005 0.000 1.149 286 G HN 0.453 8.719 8.290 -0.041 0.000 0.512 287 V N -0.885 119.057 119.914 0.048 0.000 3.040 287 V HA 0.120 4.333 4.120 0.154 0.000 0.312 287 V C -1.534 174.671 176.094 0.185 0.000 1.115 287 V CA -2.700 59.664 62.300 0.106 0.000 0.998 287 V CB 2.700 34.531 31.823 0.013 0.000 1.042 287 V HN -0.599 7.601 8.190 0.017 0.000 0.433 288 M N 4.713 124.450 119.600 0.228 0.000 2.093 288 M HA 0.199 4.905 4.480 0.377 0.000 0.297 288 M C -1.338 175.028 176.300 0.110 0.000 0.938 288 M CA -0.845 54.586 55.300 0.219 0.000 0.920 288 M CB 1.829 34.467 32.600 0.064 0.000 1.517 288 M HN 0.189 8.633 8.290 0.257 0.000 0.427 289 M N 4.023 123.651 119.600 0.046 0.000 2.184 289 M HA -0.021 4.515 4.480 -0.081 -0.105 0.296 289 M C 1.727 178.032 176.300 0.009 0.000 1.165 289 M CA 0.304 55.584 55.300 -0.033 0.000 1.175 289 M CB 0.154 32.699 32.600 -0.091 0.000 1.392 289 M HN 0.293 8.643 8.290 0.099 0.000 0.457 290 T N 2.920 117.499 114.554 0.042 0.000 2.777 290 T HA -0.389 3.996 4.350 0.059 0.000 0.266 290 T C 1.538 176.284 174.700 0.077 0.000 1.040 290 T CA 4.725 66.868 62.100 0.073 0.000 1.141 290 T CB 0.087 69.025 68.868 0.117 0.000 0.868 290 T HN 0.140 8.651 8.240 0.024 -0.256 0.444 291 D N 1.310 121.769 120.400 0.099 0.000 2.092 291 D HA -0.331 4.412 4.640 0.171 0.000 0.193 291 D C 2.103 178.442 176.300 0.065 0.000 0.994 291 D CA 4.005 58.079 54.000 0.123 0.000 0.828 291 D CB -0.809 40.069 40.800 0.129 0.000 0.963 291 D HN 0.329 8.755 8.370 0.093 0.000 0.450 292 A N -0.142 122.657 122.820 -0.036 0.000 1.883 292 A HA -0.270 3.969 4.320 -0.135 0.000 0.217 292 A C 1.797 179.271 177.584 -0.185 0.000 1.186 292 A CA 2.917 54.828 52.037 -0.210 0.000 0.624 292 A CB -0.705 17.971 19.000 -0.539 0.000 0.822 292 A HN -0.038 8.092 8.150 -0.033 0.000 0.444 293 A N -2.256 120.462 122.820 -0.171 0.000 2.067 293 A HA -0.184 4.020 4.320 -0.193 0.000 0.219 293 A C 2.086 179.699 177.584 0.048 0.000 1.158 293 A CA 2.480 54.444 52.037 -0.122 0.000 0.661 293 A CB -0.585 18.332 19.000 -0.138 0.000 0.801 293 A HN -0.475 7.580 8.150 -0.157 0.000 0.452 294 L N -2.041 119.236 121.223 0.090 0.000 2.209 294 L HA -0.177 4.251 4.340 0.147 0.000 0.207 294 L C 1.966 178.976 176.870 0.234 0.000 1.094 294 L CA 2.139 57.073 54.840 0.156 0.000 0.790 294 L CB 0.021 42.178 42.059 0.162 0.000 0.932 294 L HN -0.133 8.012 8.230 0.073 0.129 0.447 295 L N 0.016 121.380 121.223 0.234 0.000 2.072 295 L HA -0.294 4.258 4.340 0.353 0.000 0.205 295 L C 1.182 178.239 176.870 0.312 0.000 1.079 295 L CA 2.648 57.669 54.840 0.301 0.000 0.752 295 L CB -0.698 41.530 42.059 0.281 0.000 0.906 295 L HN -0.376 7.964 8.230 0.184 0.000 0.436 296 Y N -0.105 120.269 120.300 0.123 0.000 2.165 296 Y HA -0.503 4.150 4.550 0.171 0.000 0.286 296 Y C 1.211 177.214 175.900 0.171 0.000 1.155 296 Y CA 3.254 61.433 58.100 0.131 0.000 1.164 296 Y CB -0.093 38.390 38.460 0.038 0.000 0.978 296 Y HN -0.213 8.256 8.280 0.316 0.000 0.513 297 D N -1.142 119.538 120.400 0.466 0.000 2.178 297 D HA -0.300 4.589 4.640 0.415 0.000 0.202 297 D C 1.989 178.455 176.300 0.277 0.000 0.974 297 D CA 3.024 57.249 54.000 0.376 0.000 0.841 297 D CB -0.579 40.416 40.800 0.325 0.000 0.953 297 D HN -0.556 8.062 8.370 0.414 0.000 0.478 298 A N 0.235 123.247 122.820 0.319 0.000 1.873 298 A HA -0.185 4.326 4.320 0.318 0.000 0.215 298 A C 2.050 179.875 177.584 0.401 0.000 1.186 298 A CA 3.208 55.474 52.037 0.382 0.000 0.616 298 A CB -0.516 18.802 19.000 0.530 0.000 0.823 298 A HN -0.399 7.862 8.150 0.334 0.089 0.442 299 V N -1.621 118.477 119.914 0.307 0.000 2.407 299 V HA -0.643 3.593 4.120 0.193 0.000 0.248 299 V C 2.233 178.313 176.094 -0.024 0.000 1.055 299 V CA 4.788 67.141 62.300 0.088 0.000 1.049 299 V CB -0.144 31.564 31.823 -0.191 0.000 0.662 299 V HN -0.155 8.200 8.190 0.274 0.000 0.455 300 H N -0.245 118.715 119.070 -0.183 0.000 2.293 300 H HA -0.299 4.082 4.556 -0.291 0.000 0.300 300 H C 2.342 177.394 175.328 -0.459 0.000 1.082 300 H CA 4.675 60.527 56.048 -0.327 0.000 1.308 300 H CB -0.197 29.387 29.762 -0.298 0.000 1.375 300 H HN -0.751 7.658 8.280 0.215 0.000 0.495 301 I N -0.511 119.880 120.570 -0.298 0.000 2.151 301 I HA -0.584 3.238 4.170 -0.581 0.000 0.243 301 I C 1.778 177.852 176.117 -0.073 0.000 1.080 301 I CA 4.497 65.620 61.300 -0.295 0.000 1.339 301 I CB -0.239 37.739 38.000 -0.036 0.000 1.039 301 I HN -0.272 7.845 8.210 -0.155 0.000 0.409 302 V N -0.430 119.520 119.914 0.060 0.000 2.358 302 V HA -0.605 3.588 4.120 0.122 0.000 0.246 302 V C 2.100 178.334 176.094 0.235 0.000 1.047 302 V CA 4.762 67.166 62.300 0.173 0.000 1.035 302 V CB -0.209 31.799 31.823 0.307 0.000 0.658 302 V HN -0.233 8.021 8.190 0.107 0.000 0.452 303 S N 0.659 116.404 115.700 0.074 0.000 2.368 303 S HA -0.303 4.209 4.470 0.070 0.000 0.225 303 S C 2.233 176.871 174.600 0.064 0.000 1.030 303 S CA 4.006 62.221 58.200 0.025 0.000 0.999 303 S CB -0.521 62.589 63.200 -0.150 0.000 0.844 303 S HN -0.538 7.775 8.310 0.006 0.000 0.459 304 V N 1.270 121.152 119.914 -0.054 0.000 2.548 304 V HA -0.349 3.779 4.120 0.012 0.000 0.249 304 V C 1.685 177.833 176.094 0.090 0.000 1.055 304 V CA 4.016 66.296 62.300 -0.033 0.000 1.065 304 V CB -0.219 31.455 31.823 -0.249 0.000 0.681 304 V HN 0.291 8.385 8.190 -0.160 0.000 0.462 305 C N -1.780 117.617 119.300 0.162 0.000 2.468 305 C HA -0.261 4.337 4.460 0.230 0.000 0.277 305 C C 1.600 176.765 174.990 0.291 0.000 1.400 305 C CA 3.122 62.299 59.018 0.265 0.000 1.770 305 C CB -1.689 26.231 27.740 0.301 0.000 1.905 305 C HN -0.271 8.045 8.230 0.144 0.000 0.519 306 Y N 2.323 122.755 120.300 0.219 0.000 2.130 306 Y HA -0.404 4.005 4.550 -0.234 0.000 0.287 306 Y C 1.756 177.565 175.900 -0.151 0.000 1.124 306 Y CA 3.497 61.562 58.100 -0.059 0.000 1.118 306 Y CB 0.069 38.493 38.460 -0.060 0.000 0.994 306 Y HN -0.438 8.034 8.280 0.477 0.095 0.497 307 Q N -0.949 118.911 119.800 0.100 0.000 2.118 307 Q HA -0.436 3.887 4.340 -0.029 0.000 0.211 307 Q C 1.554 177.470 176.000 -0.140 0.000 0.998 307 Q CA 3.052 58.847 55.803 -0.013 0.000 0.872 307 Q CB -0.070 28.707 28.738 0.066 0.000 0.925 307 Q HN -0.444 7.978 8.270 0.252 0.000 0.414 308 R N -3.651 116.783 120.500 -0.109 0.000 2.115 308 R HA -0.140 4.177 4.340 -0.039 0.000 0.226 308 R C 0.288 176.382 176.300 -0.342 0.000 1.100 308 R CA 1.037 57.077 56.100 -0.100 0.000 0.980 308 R CB 0.416 30.763 30.300 0.077 0.000 0.875 308 R HN -0.628 7.602 8.270 -0.050 0.009 0.445 309 A N 0.008 122.372 122.820 -0.759 0.000 2.310 309 A HA 0.153 3.506 4.320 -1.612 0.000 0.260 309 A C -2.006 175.226 177.584 -0.586 0.000 1.112 309 A CA -1.322 49.999 52.037 -1.193 0.000 0.804 309 A CB -0.790 17.387 19.000 -1.373 0.000 1.081 309 A HN -0.707 7.044 8.150 -0.667 0.000 0.499 310 P HA -0.051 4.245 4.420 -0.206 0.000 0.272 310 P C -1.219 175.855 177.300 -0.377 0.000 1.254 310 P CA -0.552 62.395 63.100 -0.255 0.000 0.795 310 P CB 0.719 32.360 31.700 -0.098 0.000 1.022 311 Q N 0.408 120.026 119.800 -0.303 0.000 2.330 311 Q HA -0.129 3.950 4.340 -0.435 0.000 0.279 311 Q C -0.542 175.142 176.000 -0.528 0.000 1.024 311 Q CA 1.116 56.697 55.803 -0.370 0.000 0.900 311 Q CB 0.064 28.659 28.738 -0.238 0.000 1.221 311 Q HN 0.239 8.378 8.270 -0.218 0.000 0.396 312 M N 0.820 120.014 119.600 -0.677 0.000 2.569 312 M HA 0.291 3.605 4.480 -1.945 0.000 0.279 312 M C -1.916 174.035 176.300 -0.581 0.000 1.253 312 M CA -1.111 53.469 55.300 -1.201 0.000 0.867 312 M CB 3.628 35.526 32.600 -1.170 0.000 1.727 312 M HN -0.438 7.517 8.290 -0.558 0.000 0.467 313 T N -1.447 112.788 114.554 -0.532 0.000 2.856 313 T HA 0.382 4.789 4.350 0.094 0.000 0.283 313 T C -0.326 174.589 174.700 0.359 0.000 1.008 313 T CA -1.754 60.390 62.100 0.072 0.000 0.997 313 T CB 2.246 71.221 68.868 0.179 0.000 0.992 313 T HN -0.048 7.553 8.240 -1.065 0.000 0.454 314 V N 3.196 123.223 119.914 0.189 0.000 2.775 314 V HA -0.125 3.926 4.120 -0.115 0.000 0.299 314 V C -0.717 175.376 176.094 -0.002 0.000 1.062 314 V CA 0.776 63.073 62.300 -0.005 0.000 1.063 314 V CB 0.644 32.389 31.823 -0.131 0.000 0.994 314 V HN 0.228 8.492 8.190 0.123 0.000 0.483 315 N N 2.588 121.194 118.700 -0.157 0.000 2.229 315 N HA 0.162 4.901 4.740 -0.003 0.000 0.298 315 N C -0.897 174.540 175.510 -0.122 0.000 1.114 315 N CA -0.826 52.190 53.050 -0.057 0.000 0.776 315 N CB 3.929 42.458 38.487 0.071 0.000 1.501 315 N HN 0.053 8.191 8.380 -0.403 0.000 0.474 316 S N 1.881 117.542 115.700 -0.066 0.000 2.531 316 S HA 0.006 4.550 4.470 -0.089 -0.128 0.279 316 S C -0.802 173.758 174.600 -0.065 0.000 1.305 316 S CA 0.310 58.469 58.200 -0.069 0.000 1.058 316 S CB 0.409 63.584 63.200 -0.042 0.000 0.899 316 S HN 0.273 8.560 8.310 -0.038 0.000 0.493 317 L N 5.102 126.275 121.223 -0.083 0.000 2.401 317 L HA 0.313 4.604 4.340 -0.081 0.000 0.266 317 L C -1.668 175.136 176.870 -0.110 0.000 0.991 317 L CA -0.807 53.979 54.840 -0.089 0.000 0.818 317 L CB 3.729 45.736 42.059 -0.086 0.000 1.321 317 L HN -0.182 7.893 8.230 -0.088 0.102 0.413 318 Q N 0.008 119.700 119.800 -0.179 0.000 2.282 318 Q HA 0.226 4.472 4.340 -0.158 0.000 0.260 318 Q C -0.497 175.330 176.000 -0.288 0.000 0.964 318 Q CA -1.022 54.610 55.803 -0.284 0.000 0.880 318 Q CB 1.447 29.795 28.738 -0.649 0.000 1.286 318 Q HN 0.195 8.350 8.270 -0.193 0.000 0.445 319 c N 2.188 120.696 118.600 -0.154 0.000 2.481 319 c HA -0.060 4.438 4.570 -0.119 0.000 0.275 319 c C 0.839 174.856 174.090 -0.121 0.000 1.419 319 c CA 0.522 56.790 56.329 -0.102 0.000 1.773 319 c CB -0.463 42.035 42.510 -0.019 0.000 1.862 319 c HN 0.656 8.852 8.230 -0.056 0.000 0.530 320 H N -2.424 116.564 119.070 -0.137 0.000 2.486 320 H HA 0.165 4.619 4.556 -0.169 0.000 0.287 320 H C 0.014 175.122 175.328 -0.366 0.000 1.010 320 H CA 0.535 56.474 56.048 -0.181 0.000 1.324 320 H CB -0.098 29.603 29.762 -0.101 0.000 1.446 320 H HN -0.146 7.938 8.280 -0.270 0.034 0.537 321 R N -0.543 119.466 120.500 -0.819 0.000 3.141 321 R HA -0.040 4.008 4.340 -0.486 0.000 0.244 321 R C -0.551 175.321 176.300 -0.714 0.000 1.161 321 R CA 0.370 56.105 56.100 -0.609 0.000 1.091 321 R CB 0.560 30.599 30.300 -0.436 0.000 0.957 321 R HN 0.194 7.779 8.270 -1.142 0.000 0.512 322 H N -3.642 115.376 119.070 -0.087 0.000 2.904 322 H HA 0.170 4.696 4.556 -0.050 0.000 0.242 322 H C -1.263 174.040 175.328 -0.040 0.000 1.193 322 H CA -0.173 55.845 56.048 -0.050 0.000 0.946 322 H CB 0.517 30.262 29.762 -0.027 0.000 2.135 322 H HN 0.215 8.450 8.280 -0.075 0.000 0.652 323 K N 1.119 121.527 120.400 0.015 0.000 2.185 323 K HA 0.268 4.610 4.320 0.037 0.000 0.269 323 K C -1.277 175.332 176.600 0.015 0.000 0.987 323 K CA -0.848 55.451 56.287 0.020 0.000 0.865 323 K CB 0.962 33.468 32.500 0.010 0.000 1.090 323 K HN -0.179 8.044 8.250 -0.045 0.000 0.450 324 A N 3.822 126.660 122.820 0.030 0.000 2.264 324 A HA 0.077 4.496 4.320 0.027 -0.082 0.304 324 A C -1.047 176.619 177.584 0.138 0.000 1.100 324 A CA -0.800 51.262 52.037 0.042 0.000 0.839 324 A CB 1.283 20.283 19.000 -0.000 0.000 1.121 324 A HN 0.091 8.258 8.150 0.029 0.000 0.496 325 W N 1.617 122.890 121.300 -0.047 0.000 2.308 325 W HA -0.062 4.615 4.660 0.029 0.000 0.324 325 W C 1.114 177.640 176.519 0.012 0.000 1.387 325 W CA -0.746 56.610 57.345 0.018 0.000 1.250 325 W CB 1.003 30.503 29.460 0.068 0.000 1.257 325 W HN -0.022 8.316 8.180 0.262 0.000 0.554 326 R N 9.305 129.818 120.500 0.022 0.000 2.080 326 R HA -0.335 3.862 4.340 -0.238 0.000 0.236 326 R C 0.573 176.510 176.300 -0.604 0.000 1.137 326 R CA 2.919 58.809 56.100 -0.351 0.000 0.943 326 R CB -0.175 29.794 30.300 -0.551 0.000 0.846 326 R HN 0.209 8.646 8.270 0.278 0.000 0.431 327 F N -6.185 113.347 119.950 -0.698 0.000 2.811 327 F HA 0.105 4.390 4.527 -0.403 0.000 0.301 327 F C 0.870 176.142 175.800 -0.880 0.000 1.151 327 F CA 0.162 57.726 58.000 -0.727 0.000 1.412 327 F CB -0.590 37.991 39.000 -0.699 0.000 1.113 327 F HN -0.096 7.708 8.300 -0.827 0.000 0.579 328 G N 0.906 109.253 108.800 -0.755 0.000 2.628 328 G HA2 -0.484 3.324 3.960 -0.254 0.000 0.217 328 G HA3 -0.484 3.704 3.960 0.121 -0.156 0.217 328 G C 0.958 176.015 174.900 0.263 0.000 1.240 328 G CA 2.420 47.432 45.100 -0.145 0.000 0.792 328 G HN -0.579 7.078 8.290 -0.740 0.189 0.593 329 G N 0.468 109.450 108.800 0.304 0.000 2.469 329 G HA2 -0.452 3.629 3.960 0.202 0.000 0.219 329 G HA3 -0.452 3.618 3.960 0.182 0.000 0.219 329 G C 0.960 175.917 174.900 0.095 0.000 1.150 329 G CA 1.818 47.049 45.100 0.220 0.000 0.763 329 G HN 0.066 8.498 8.290 0.237 0.000 0.561 330 R N 1.041 121.601 120.500 0.101 0.000 2.081 330 R HA -0.274 4.154 4.340 0.148 0.000 0.235 330 R C 1.819 178.324 176.300 0.342 0.000 1.131 330 R CA 2.766 58.972 56.100 0.176 0.000 0.960 330 R CB -0.132 30.268 30.300 0.168 0.000 0.856 330 R HN -0.387 7.918 8.270 0.057 0.000 0.436 331 F N 0.926 120.920 119.950 0.074 0.000 2.113 331 F HA -0.253 4.373 4.527 0.164 0.000 0.297 331 F C 1.708 177.612 175.800 0.172 0.000 1.103 331 F CA 1.525 59.602 58.000 0.129 0.000 1.248 331 F CB -0.232 38.811 39.000 0.071 0.000 0.999 331 F HN -0.356 8.102 8.300 0.263 0.000 0.475 332 M N -0.974 118.693 119.600 0.110 0.000 2.202 332 M HA -0.483 3.871 4.480 -0.211 0.000 0.262 332 M C 1.698 177.900 176.300 -0.164 0.000 1.063 332 M CA 2.804 58.021 55.300 -0.137 0.000 1.097 332 M CB -0.441 31.961 32.600 -0.330 0.000 1.382 332 M HN 0.058 8.469 8.290 0.202 0.000 0.413 333 N N -0.713 117.944 118.700 -0.072 0.000 2.300 333 N HA -0.241 4.398 4.740 -0.168 0.000 0.179 333 N C 2.086 177.542 175.510 -0.091 0.000 1.016 333 N CA 2.792 55.771 53.050 -0.118 0.000 0.876 333 N CB -0.430 37.977 38.487 -0.133 0.000 0.979 333 N HN -0.464 7.900 8.380 -0.000 0.016 0.432 334 F N 0.471 120.415 119.950 -0.011 0.000 2.126 334 F HA -0.312 4.243 4.527 0.046 0.000 0.299 334 F C 2.525 178.322 175.800 -0.006 0.000 1.096 334 F CA 3.820 61.842 58.000 0.038 0.000 1.255 334 F CB 0.014 39.105 39.000 0.152 0.000 0.997 334 F HN -0.928 7.569 8.300 0.330 0.000 0.479 335 I N -2.269 118.331 120.570 0.049 0.000 2.315 335 I HA -0.474 3.711 4.170 0.025 0.000 0.248 335 I C 2.460 178.550 176.117 -0.046 0.000 1.117 335 I CA 3.168 64.427 61.300 -0.067 0.000 1.404 335 I CB -0.148 37.667 38.000 -0.308 0.000 1.071 335 I HN -0.470 7.730 8.210 -0.016 0.000 0.419 336 K N -1.033 119.296 120.400 -0.120 0.000 2.155 336 K HA -0.266 3.930 4.320 -0.207 0.000 0.203 336 K C 1.447 178.108 176.600 0.102 0.000 1.052 336 K CA 3.141 59.366 56.287 -0.103 0.000 0.948 336 K CB -0.053 32.333 32.500 -0.191 0.000 0.728 336 K HN -0.516 7.647 8.250 -0.144 0.000 0.448 337 E N -4.113 116.114 120.200 0.045 0.000 2.489 337 E HA -0.052 4.328 4.350 0.049 0.000 0.193 337 E C -0.583 176.084 176.600 0.111 0.000 1.057 337 E CA -0.681 55.744 56.400 0.042 0.000 0.866 337 E CB 0.411 30.069 29.700 -0.071 0.000 0.916 337 E HN -0.716 7.642 8.360 -0.003 0.000 0.500 338 A N 0.655 123.599 122.820 0.207 0.000 2.483 338 A HA -0.081 4.366 4.320 0.211 0.000 0.238 338 A C -1.246 176.447 177.584 0.182 0.000 1.070 338 A CA 1.013 53.187 52.037 0.229 0.000 0.770 338 A CB 0.678 19.854 19.000 0.292 0.000 1.008 338 A HN -0.843 7.387 8.150 0.254 0.073 0.497 339 Q N 1.148 121.066 119.800 0.197 0.000 2.285 339 Q HA 0.739 5.346 4.340 0.115 -0.198 0.269 339 Q C -1.587 174.595 176.000 0.303 0.000 1.030 339 Q CA -1.038 54.865 55.803 0.167 0.000 0.788 339 Q CB 2.879 31.677 28.738 0.100 0.000 1.266 339 Q HN 0.164 8.571 8.270 0.227 0.000 0.438 340 W N 5.166 126.477 121.300 0.019 0.000 3.624 340 W HA 0.158 4.858 4.660 0.066 0.000 0.312 340 W C -2.847 173.691 176.519 0.031 0.000 1.203 340 W CA -0.405 56.970 57.345 0.051 0.000 1.225 340 W CB 3.649 33.161 29.460 0.088 0.000 1.321 340 W HN 0.192 8.510 8.180 0.229 0.000 0.506 341 E N 7.336 127.181 120.200 -0.591 0.000 1.941 341 E HA 0.067 4.389 4.350 -0.251 -0.123 0.275 341 E C -0.999 175.194 176.600 -0.678 0.000 1.113 341 E CA -0.363 55.746 56.400 -0.485 0.000 0.878 341 E CB -0.501 28.978 29.700 -0.369 0.000 1.070 341 E HN 0.209 8.137 8.360 -0.719 0.000 0.399 342 G N 3.878 112.551 108.800 -0.211 0.000 2.642 342 G HA2 0.336 4.365 3.960 0.116 0.000 0.291 342 G HA3 0.336 4.690 3.960 0.334 -0.194 0.291 342 G C -0.064 174.829 174.900 -0.013 0.000 1.345 342 G CA -1.391 43.758 45.100 0.082 0.000 1.043 342 G HN 0.159 8.415 8.290 -0.056 0.000 0.528 343 L N -1.428 119.789 121.223 -0.009 0.000 2.127 343 L HA -0.220 4.019 4.340 -0.167 0.000 0.211 343 L C 1.254 178.072 176.870 -0.087 0.000 1.089 343 L CA 2.686 57.447 54.840 -0.131 0.000 0.757 343 L CB 0.017 41.918 42.059 -0.262 0.000 0.899 343 L HN 0.085 8.702 8.230 0.063 -0.349 0.434 344 T N -7.597 106.938 114.554 -0.031 0.000 3.312 344 T HA 0.139 4.571 4.350 -0.066 -0.121 0.251 344 T C 0.226 174.911 174.700 -0.025 0.000 1.012 344 T CA -0.932 61.143 62.100 -0.041 0.000 0.925 344 T CB -0.399 68.445 68.868 -0.041 0.000 1.049 344 T HN -0.411 8.136 8.240 0.015 -0.297 0.583 345 G N 1.480 110.261 108.800 -0.030 0.000 2.615 345 G HA2 -0.471 3.464 3.960 -0.041 0.000 0.218 345 G HA3 -0.471 3.486 3.960 -0.005 0.000 0.218 345 G C -2.032 172.856 174.900 -0.020 0.000 1.339 345 G CA -0.599 44.487 45.100 -0.024 0.000 0.884 345 G HN -0.529 7.648 8.290 -0.046 0.086 0.559 346 R N 1.190 121.681 120.500 -0.014 0.000 2.401 346 R HA -0.017 4.430 4.340 -0.036 -0.128 0.299 346 R C -0.375 175.926 176.300 0.002 0.000 1.064 346 R CA 0.622 56.712 56.100 -0.017 0.000 1.000 346 R CB -0.116 30.171 30.300 -0.022 0.000 0.973 346 R HN 0.214 8.479 8.270 -0.007 0.000 0.438 347 I N 5.069 125.644 120.570 0.009 0.000 2.377 347 I HA 0.189 4.298 4.170 -0.102 0.000 0.293 347 I C -1.476 174.528 176.117 -0.188 0.000 0.987 347 I CA -0.581 60.672 61.300 -0.078 0.000 1.185 347 I CB 2.456 40.454 38.000 -0.003 0.000 1.341 347 I HN 0.445 8.682 8.210 0.045 0.000 0.455 348 V N 4.798 124.497 119.914 -0.358 0.000 3.077 348 V HA 0.387 4.455 4.120 -0.348 -0.157 0.299 348 V C -2.411 173.412 176.094 -0.451 0.000 1.276 348 V CA -1.873 60.223 62.300 -0.341 0.000 0.993 348 V CB 3.701 35.461 31.823 -0.104 0.000 1.076 348 V HN 0.107 8.082 8.190 -0.358 0.000 0.434 349 F N 2.460 122.442 119.950 0.053 0.000 2.522 349 F HA 0.404 5.078 4.527 0.060 -0.111 0.324 349 F C -0.843 174.962 175.800 0.008 0.000 1.077 349 F CA -2.235 55.784 58.000 0.033 0.000 0.944 349 F CB 2.591 41.587 39.000 -0.006 0.000 1.175 349 F HN 0.270 8.577 8.300 0.012 0.000 0.468 350 N N 2.317 121.141 118.700 0.206 0.000 2.411 350 N HA -0.220 4.565 4.740 0.075 0.000 0.265 350 N C 0.861 176.404 175.510 0.056 0.000 1.266 350 N CA 0.739 53.849 53.050 0.100 0.000 0.889 350 N CB 1.205 39.742 38.487 0.084 0.000 1.069 350 N HN 0.056 8.576 8.380 0.233 0.000 0.476 351 K N 5.910 126.323 120.400 0.020 0.000 2.148 351 K HA -0.257 4.050 4.320 -0.023 0.000 0.204 351 K C 1.523 178.076 176.600 -0.077 0.000 1.050 351 K CA 3.011 59.282 56.287 -0.026 0.000 0.942 351 K CB -0.188 32.293 32.500 -0.031 0.000 0.724 351 K HN 0.529 8.791 8.250 0.020 0.000 0.446 352 T N -3.606 110.912 114.554 -0.060 0.000 2.668 352 T HA -0.218 4.076 4.350 -0.093 0.000 0.258 352 T C 1.907 176.535 174.700 -0.121 0.000 1.051 352 T CA 3.043 65.095 62.100 -0.079 0.000 1.155 352 T CB 0.275 69.118 68.868 -0.043 0.000 0.864 352 T HN -0.372 8.008 8.240 -0.035 -0.162 0.413 353 S N 0.830 116.475 115.700 -0.091 0.000 2.496 353 S HA -0.064 4.325 4.470 -0.135 0.000 0.224 353 S C 1.691 176.136 174.600 -0.259 0.000 0.996 353 S CA 1.024 59.149 58.200 -0.124 0.000 0.927 353 S CB 0.638 63.822 63.200 -0.028 0.000 0.774 353 S HN -0.375 8.214 8.310 -0.050 -0.308 0.524 354 G N 2.374 111.029 108.800 -0.241 0.000 2.155 354 G HA2 -0.363 3.409 3.960 -0.312 0.000 0.257 354 G HA3 -0.363 3.254 3.960 -0.572 0.000 0.257 354 G C -1.557 173.261 174.900 -0.136 0.000 0.983 354 G CA 0.730 45.626 45.100 -0.339 0.000 0.676 354 G HN -0.143 8.047 8.290 -0.166 0.000 0.528 355 L N -2.377 118.869 121.223 0.037 0.000 2.352 355 L HA 0.133 4.591 4.340 0.197 0.000 0.269 355 L C -1.009 176.060 176.870 0.332 0.000 1.034 355 L CA -1.656 53.296 54.840 0.186 0.000 0.806 355 L CB 1.748 43.901 42.059 0.156 0.000 1.244 355 L HN -0.793 7.401 8.230 0.023 0.050 0.447 356 R N 0.157 120.883 120.500 0.377 0.000 2.565 356 R HA 0.347 4.871 4.340 0.307 0.000 0.286 356 R C 0.163 176.712 176.300 0.414 0.000 1.256 356 R CA -0.861 55.445 56.100 0.344 0.000 1.238 356 R CB -0.474 29.979 30.300 0.255 0.000 1.153 356 R HN 0.371 8.859 8.270 0.364 0.000 0.553 357 T N 1.314 116.068 114.554 0.334 0.000 3.037 357 T HA 0.080 4.695 4.350 0.442 0.000 0.252 357 T C -0.487 174.283 174.700 0.116 0.000 1.073 357 T CA 0.288 62.572 62.100 0.308 0.000 1.091 357 T CB 0.766 69.753 68.868 0.199 0.000 0.935 357 T HN -0.185 8.210 8.240 0.258 0.000 0.488 358 D N 1.751 122.207 120.400 0.093 0.000 2.256 358 D HA 0.260 4.712 4.640 -0.313 0.000 0.240 358 D C -1.965 174.357 176.300 0.038 0.000 1.062 358 D CA -0.331 53.605 54.000 -0.106 0.000 0.832 358 D CB 1.735 42.492 40.800 -0.071 0.000 1.135 358 D HN -0.204 8.255 8.370 0.149 0.000 0.484 359 F N -2.074 117.880 119.950 0.007 0.000 2.807 359 F HA 0.307 4.820 4.527 -0.024 0.000 0.316 359 F C -2.976 172.847 175.800 0.039 0.000 1.162 359 F CA -1.337 56.667 58.000 0.007 0.000 0.910 359 F CB 1.780 40.787 39.000 0.012 0.000 1.314 359 F HN -0.298 7.595 8.300 -0.679 0.000 0.454 360 D N 0.020 120.594 120.400 0.290 0.000 2.217 360 D HA 0.616 5.524 4.640 0.169 -0.167 0.243 360 D C -0.879 175.615 176.300 0.323 0.000 1.054 360 D CA -0.550 53.581 54.000 0.219 0.000 0.838 360 D CB 2.263 43.120 40.800 0.094 0.000 1.162 360 D HN 0.092 8.632 8.370 0.283 0.000 0.472 361 L N 2.226 123.678 121.223 0.383 0.000 2.329 361 L HA 0.288 4.788 4.340 0.267 0.000 0.279 361 L C -1.358 175.668 176.870 0.261 0.000 1.014 361 L CA -1.221 53.827 54.840 0.346 0.000 0.814 361 L CB 2.582 44.917 42.059 0.460 0.000 1.257 361 L HN 0.299 8.784 8.230 0.424 0.000 0.424 362 D N 2.964 123.464 120.400 0.166 0.000 2.264 362 D HA 0.228 5.062 4.640 0.104 -0.131 0.250 362 D C -0.724 175.638 176.300 0.105 0.000 1.113 362 D CA -0.451 53.612 54.000 0.105 0.000 0.871 362 D CB 1.101 41.920 40.800 0.031 0.000 1.167 362 D HN -0.050 8.401 8.370 0.135 0.000 0.447 363 I N 2.041 122.647 120.570 0.060 0.000 2.331 363 I HA 0.184 4.411 4.170 -0.130 -0.135 0.292 363 I C -0.192 175.893 176.117 -0.054 0.000 0.998 363 I CA -1.902 59.366 61.300 -0.053 0.000 1.267 363 I CB -0.501 37.458 38.000 -0.068 0.000 1.386 363 I HN -0.246 7.890 8.210 0.069 0.115 0.476 364 I N 1.550 122.072 120.570 -0.080 0.000 2.797 364 I HA 0.941 5.301 4.170 -0.016 -0.199 0.307 364 I C -1.281 174.824 176.117 -0.020 0.000 1.033 364 I CA -2.333 58.951 61.300 -0.026 0.000 1.071 364 I CB 4.117 42.125 38.000 0.013 0.000 1.255 364 I HN 0.037 8.168 8.210 -0.132 0.000 0.445 365 S N -0.072 115.632 115.700 0.007 0.000 2.550 365 S HA 0.724 5.419 4.470 0.046 -0.197 0.270 365 S C -2.014 172.599 174.600 0.023 0.000 1.145 365 S CA -1.649 56.566 58.200 0.024 0.000 0.852 365 S CB 3.561 66.768 63.200 0.012 0.000 1.119 365 S HN 0.232 8.547 8.310 0.008 0.000 0.465 366 L N 3.581 124.822 121.223 0.029 0.000 2.268 366 L HA 0.334 4.680 4.340 0.009 0.000 0.289 366 L C -1.613 175.245 176.870 -0.021 0.000 1.064 366 L CA -1.001 53.847 54.840 0.013 0.000 0.824 366 L CB 0.635 42.718 42.059 0.041 0.000 1.202 366 L HN -0.014 8.241 8.230 0.041 0.000 0.433 367 K N 5.893 126.273 120.400 -0.033 0.000 2.393 367 K HA 0.306 4.601 4.320 -0.042 0.000 0.241 367 K C 1.006 177.555 176.600 -0.085 0.000 1.055 367 K CA -3.029 53.232 56.287 -0.044 0.000 0.951 367 K CB 0.736 33.221 32.500 -0.026 0.000 1.285 367 K HN -0.406 7.827 8.250 -0.028 0.000 0.500 368 E N 1.017 121.175 120.200 -0.071 0.000 2.072 368 E HA -0.312 4.020 4.350 -0.274 -0.146 0.191 368 E C 1.095 177.630 176.600 -0.109 0.000 0.985 368 E CA 3.328 59.657 56.400 -0.119 0.000 0.801 368 E CB 0.037 29.766 29.700 0.049 0.000 0.750 368 E HN 0.433 8.772 8.360 -0.035 0.000 0.452 369 D N -4.300 116.082 120.400 -0.031 0.000 2.403 369 D HA -0.255 4.392 4.640 0.011 0.000 0.227 369 D C 0.515 176.796 176.300 -0.033 0.000 0.995 369 D CA 1.295 55.288 54.000 -0.011 0.000 0.928 369 D CB -0.215 40.587 40.800 0.005 0.000 0.887 369 D HN 0.036 8.396 8.370 -0.017 0.000 0.529 370 G N -1.532 107.226 108.800 -0.069 0.000 2.483 370 G HA2 -0.318 3.590 3.960 -0.086 0.000 0.521 370 G HA3 -0.318 3.619 3.960 -0.038 0.000 0.521 370 G C -1.889 172.996 174.900 -0.026 0.000 1.278 370 G CA -0.912 44.154 45.100 -0.057 0.000 0.965 370 G HN -0.699 7.321 8.290 -0.094 0.214 0.504 371 L N 2.065 123.286 121.223 -0.003 0.000 2.410 371 L HA 0.181 4.713 4.340 0.017 -0.183 0.273 371 L C -0.153 176.727 176.870 0.018 0.000 1.152 371 L CA 0.540 55.391 54.840 0.019 0.000 0.855 371 L CB 0.507 42.593 42.059 0.046 0.000 1.129 371 L HN 0.141 8.371 8.230 -0.001 0.000 0.463 372 E N 4.090 124.298 120.200 0.013 0.000 2.412 372 E HA 0.265 4.620 4.350 0.009 0.000 0.279 372 E C -2.350 174.252 176.600 0.003 0.000 0.984 372 E CA -2.263 54.141 56.400 0.007 0.000 0.788 372 E CB 3.203 32.904 29.700 0.002 0.000 1.277 372 E HN 0.320 8.688 8.360 0.013 0.000 0.455 373 K N 3.733 124.132 120.400 -0.001 0.000 2.338 373 K HA -0.011 4.501 4.320 -0.004 -0.194 0.290 373 K C 0.239 176.840 176.600 0.000 0.000 1.069 373 K CA 0.351 56.636 56.287 -0.002 0.000 0.941 373 K CB -0.215 32.282 32.500 -0.004 0.000 1.023 373 K HN 0.438 8.687 8.250 -0.001 0.000 0.477 374 V N 1.916 121.829 119.914 -0.001 0.000 3.043 374 V HA 0.458 4.580 4.120 0.003 0.000 0.357 374 V C -1.879 174.221 176.094 0.009 0.000 1.372 374 V CA -1.697 60.604 62.300 0.002 0.000 1.214 374 V CB 0.094 31.916 31.823 -0.002 0.000 1.224 374 V HN 0.282 8.468 8.190 -0.007 0.000 0.507 375 G N -1.513 107.298 108.800 0.018 0.000 2.345 375 G HA2 0.204 4.236 3.960 0.033 0.000 0.285 375 G HA3 0.204 4.220 3.960 0.042 -0.031 0.285 375 G C -2.655 172.283 174.900 0.065 0.000 1.297 375 G CA 0.273 45.395 45.100 0.038 0.000 0.875 375 G HN -0.849 7.394 8.290 0.016 0.057 0.506 376 V N -7.448 112.527 119.914 0.102 0.000 3.206 376 V HA 1.039 5.441 4.120 0.165 -0.183 0.305 376 V C -2.940 173.308 176.094 0.258 0.000 1.257 376 V CA -3.090 59.299 62.300 0.148 0.000 1.057 376 V CB 3.988 35.861 31.823 0.084 0.000 1.075 376 V HN -0.030 8.220 8.190 0.101 0.000 0.443 377 W N 0.744 122.075 121.300 0.051 0.000 3.363 377 W HA 0.590 5.469 4.660 0.013 -0.211 0.306 377 W C -2.623 173.889 176.519 -0.012 0.000 1.253 377 W CA -0.333 57.033 57.345 0.035 0.000 1.195 377 W CB 3.756 33.275 29.460 0.100 0.000 1.366 377 W HN 0.183 8.559 8.180 0.326 0.000 0.551 378 S N 2.093 117.222 115.700 -0.951 0.000 2.547 378 S HA 0.751 4.818 4.470 -0.889 -0.130 0.270 378 S C -1.950 171.656 174.600 -1.657 0.000 1.150 378 S CA -3.151 54.413 58.200 -1.060 0.000 0.850 378 S CB 1.679 64.587 63.200 -0.486 0.000 1.118 378 S HN -0.333 7.194 8.310 -1.305 0.000 0.461 379 P HA -0.234 3.656 4.420 -0.882 0.000 0.219 379 P C 0.147 177.120 177.300 -0.546 0.000 1.146 379 P CA 2.263 64.868 63.100 -0.824 0.000 0.808 379 P CB -0.006 31.428 31.700 -0.443 0.000 0.779 380 A N -2.285 120.251 122.820 -0.473 0.000 1.843 380 A HA -0.170 3.996 4.320 -0.257 0.000 0.213 380 A C 1.156 178.559 177.584 -0.302 0.000 1.202 380 A CA 1.899 53.750 52.037 -0.311 0.000 0.607 380 A CB 0.059 18.917 19.000 -0.237 0.000 0.847 380 A HN 0.164 7.985 8.150 -0.501 0.028 0.445 381 D N -3.568 116.623 120.400 -0.348 0.000 2.350 381 D HA 0.118 4.638 4.640 -0.201 0.000 0.213 381 D C 0.985 177.109 176.300 -0.293 0.000 1.031 381 D CA -0.438 53.404 54.000 -0.264 0.000 0.861 381 D CB 0.636 41.311 40.800 -0.208 0.000 0.926 381 D HN -0.572 7.555 8.370 -0.404 0.000 0.520 382 G N -0.627 107.873 108.800 -0.501 0.000 2.581 382 G HA2 -0.442 3.083 3.960 -0.817 0.000 0.291 382 G HA3 -0.442 3.398 3.960 -0.200 0.000 0.291 382 G C -0.657 174.095 174.900 -0.246 0.000 1.277 382 G CA -0.058 44.763 45.100 -0.466 0.000 0.959 382 G HN -0.239 7.612 8.290 -0.648 0.051 0.554 383 L N 2.218 123.511 121.223 0.116 0.000 2.417 383 L HA 0.145 4.827 4.340 0.320 -0.150 0.268 383 L C -0.027 176.884 176.870 0.069 0.000 1.158 383 L CA 0.328 55.293 54.840 0.208 0.000 0.819 383 L CB 0.994 43.183 42.059 0.216 0.000 1.112 383 L HN 0.046 8.365 8.230 0.148 0.000 0.458 384 N N 5.622 124.364 118.700 0.071 0.000 2.454 384 N HA 0.195 4.947 4.740 0.021 0.000 0.291 384 N C -2.264 173.269 175.510 0.038 0.000 1.079 384 N CA -0.462 52.607 53.050 0.032 0.000 0.893 384 N CB 1.842 40.333 38.487 0.006 0.000 1.512 384 N HN 0.023 8.467 8.380 0.106 0.000 0.497 385 I N 0.000 120.586 120.570 0.026 0.000 2.984 385 I HA 0.000 4.185 4.170 0.026 0.000 0.288 385 I CA 0.000 61.313 61.300 0.022 0.000 1.566 385 I CB 0.000 38.013 38.000 0.021 0.000 1.214 385 I HN 0.000 8.223 8.210 0.021 0.000 0.494