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 3jwb_1_A DATA FIRST_RESID 2 DATA SEQUENCE SDXRTYGFNT QIVHAGQQPD PSTGALSTPI FQTSTFVFDS AEQGAARFAL DATA SEQUENCE EESGYIYTRL GNPTTDALEK KLAVLERGEA GLATASGISA ITTTLLTLCQ DATA SEQUENCE QGDHIVSASA IYGCTHAFLS HSMPKFGINV SFVDAAKPEE IRAAMRPETK DATA SEQUENCE VVYIETPANP TLSLVDIETV AGIAHQQGAL LVVDNTFMSP YCQQPLQLGA DATA SEQUENCE DIVVHSVTXY INGHGDVIGG IIVGKQEFID QARFVGLKDI TGGCMSPFNA DATA SEQUENCE WLTLRGVKTL GIRMERHCEN ALKIARFLEG HPSITRVYYP GLSSHPQYEL DATA SEQUENCE GQRQMSLPGG IISFEIAGGL EAGRRMINSV ELCLLAVSLG DTETLIQHPA DATA SEQUENCE SMTHSPVAPE ERLKAGITDG LIRLSVGLED PEDIINDLEH AIRKAT VARS RESID RESNAME ATOMNAME SS_SHIFT SHIFT RC_SHIFT HM_SHIFT EF_SHIFT SIGMA FORMAT %4d %4s %4s %9.3f %9.3f %9.3f %9.3f %9.3f %9.3f 2 S HA 0.000 4.470 4.470 -0.000 0.000 0.327 2 S C 0.000 174.616 174.600 0.027 0.000 1.055 2 S CA 0.000 58.219 58.200 0.032 0.000 1.107 2 S CB 0.000 63.146 63.200 -0.090 0.000 0.593 6 T N -2.428 112.072 114.554 -0.090 0.000 3.037 6 T HA 0.198 3.979 4.350 -0.947 0.000 0.251 6 T C 0.681 175.267 174.700 -0.191 0.000 1.079 6 T CA 0.289 62.279 62.100 -0.183 0.000 1.067 6 T CB -0.052 68.630 68.868 -0.309 0.000 0.948 6 T HN -0.043 8.197 8.240 -0.000 0.000 0.496 7 Y N 2.180 122.494 120.300 0.024 0.000 2.295 7 Y HA 0.570 4.552 4.550 -0.947 0.000 0.331 7 Y C 1.665 177.599 175.900 0.057 0.000 1.311 7 Y CA -0.624 57.494 58.100 0.030 0.000 1.430 7 Y CB -0.121 38.350 38.460 0.019 0.000 1.339 7 Y HN 0.256 8.536 8.280 -0.000 0.000 0.552 8 G N -0.094 108.868 108.800 0.270 0.000 2.664 8 G HA2 -0.036 3.356 3.960 -0.947 0.000 0.242 8 G HA3 -0.036 3.356 3.960 -0.947 0.000 0.242 8 G C 0.344 175.381 174.900 0.229 0.000 1.225 8 G CA -0.297 44.931 45.100 0.214 0.000 0.849 8 G HN 0.710 9.000 8.290 -0.000 0.000 0.581 9 F N 0.609 120.620 119.950 0.102 0.000 2.171 9 F HA -0.120 3.839 4.527 -0.946 0.000 0.300 9 F C 2.527 178.406 175.800 0.133 0.000 1.090 9 F CA 1.683 59.749 58.000 0.111 0.000 1.293 9 F CB 0.147 39.200 39.000 0.088 0.000 1.013 9 F HN 0.405 8.705 8.300 -0.000 0.000 0.486 10 N N -0.506 118.343 118.700 0.248 0.000 2.142 10 N HA -0.142 4.029 4.740 -0.947 0.000 0.186 10 N C 1.765 177.292 175.510 0.029 0.000 1.023 10 N CA 1.964 55.095 53.050 0.135 0.000 0.852 10 N CB -0.680 37.896 38.487 0.147 0.000 0.998 10 N HN 0.268 8.648 8.380 -0.000 0.000 0.424 11 T N 1.911 116.500 114.554 0.059 0.000 2.746 11 T HA -0.130 3.651 4.350 -0.947 0.000 0.267 11 T C 1.979 176.699 174.700 0.032 0.000 1.039 11 T CA 1.138 63.268 62.100 0.050 0.000 1.142 11 T CB -0.155 68.730 68.868 0.029 0.000 0.866 11 T HN 0.346 8.586 8.240 -0.000 0.000 0.444 12 Q N 0.158 119.948 119.800 -0.016 0.000 2.084 12 Q HA 0.008 3.780 4.340 -0.947 0.000 0.202 12 Q C 2.397 178.294 176.000 -0.172 0.000 0.978 12 Q CA 1.113 56.866 55.803 -0.083 0.000 0.844 12 Q CB -0.365 28.262 28.738 -0.185 0.000 0.898 12 Q HN 0.505 8.775 8.270 -0.000 0.000 0.426 13 I N 0.058 120.474 120.570 -0.256 0.000 2.151 13 I HA -0.310 3.292 4.170 -0.947 0.000 0.243 13 I C 2.165 178.177 176.117 -0.175 0.000 1.080 13 I CA 1.100 62.265 61.300 -0.226 0.000 1.339 13 I CB -0.218 37.679 38.000 -0.172 0.000 1.039 13 I HN 0.069 8.279 8.210 -0.000 0.000 0.409 14 V N -0.231 119.574 119.914 -0.182 0.000 2.323 14 V HA -0.248 3.304 4.120 -0.947 0.000 0.244 14 V C 2.188 178.059 176.094 -0.372 0.000 1.041 14 V CA 1.781 63.900 62.300 -0.302 0.000 1.025 14 V CB -0.705 30.883 31.823 -0.392 0.000 0.656 14 V HN 0.442 8.632 8.190 -0.000 0.000 0.451 15 H N -0.644 118.365 119.070 -0.101 0.000 2.557 15 H HA 0.408 4.397 4.556 -0.946 0.000 0.281 15 H C 1.363 176.662 175.328 -0.048 0.000 0.990 15 H CA 0.543 56.543 56.048 -0.080 0.000 1.278 15 H CB 0.091 29.787 29.762 -0.110 0.000 1.451 15 H HN 0.430 8.710 8.280 -0.000 0.000 0.516 16 A N 0.786 123.640 122.820 0.057 0.000 2.546 16 A HA 0.337 4.089 4.320 -0.947 0.000 0.243 16 A C 1.547 179.145 177.584 0.023 0.000 1.063 16 A CA 1.038 53.099 52.037 0.040 0.000 0.757 16 A CB -0.465 18.533 19.000 -0.003 0.000 0.991 16 A HN 0.629 8.779 8.150 -0.000 0.000 0.503 17 G N 1.336 110.161 108.800 0.042 0.000 2.205 17 G HA2 -0.231 3.161 3.960 -0.947 0.000 0.261 17 G HA3 -0.231 3.161 3.960 -0.947 0.000 0.261 17 G C 0.168 175.098 174.900 0.051 0.000 0.980 17 G CA 0.800 45.924 45.100 0.040 0.000 0.632 17 G HN 0.995 9.285 8.290 -0.000 0.000 0.533 18 Q N -0.246 119.587 119.800 0.056 0.000 2.387 18 Q HA 0.685 4.456 4.340 -0.947 0.000 0.273 18 Q C -0.080 175.973 176.000 0.088 0.000 1.089 18 Q CA -0.616 55.226 55.803 0.065 0.000 0.824 18 Q CB 1.830 30.586 28.738 0.031 0.000 1.367 18 Q HN 0.682 8.952 8.270 -0.000 0.000 0.443 19 Q N -0.655 119.199 119.800 0.091 0.000 2.687 19 Q HA 0.586 4.358 4.340 -0.947 0.000 0.295 19 Q C -2.877 173.176 176.000 0.088 0.000 0.920 19 Q CA -2.035 53.822 55.803 0.090 0.000 0.766 19 Q CB 0.848 29.633 28.738 0.078 0.000 1.467 19 Q HN 0.248 8.518 8.270 -0.000 0.000 0.415 20 P HA 0.049 4.469 4.420 -0.000 0.000 0.269 20 P C -0.977 176.374 177.300 0.084 0.000 1.209 20 P CA 0.116 63.260 63.100 0.073 0.000 0.776 20 P CB 0.325 32.059 31.700 0.058 0.000 0.876 21 D N 3.132 123.587 120.400 0.091 0.000 2.493 21 D HA -0.018 4.054 4.640 -0.947 0.000 0.240 21 D C -1.421 174.934 176.300 0.093 0.000 1.142 21 D CA -0.964 53.102 54.000 0.111 0.000 0.872 21 D CB 0.422 41.283 40.800 0.103 0.000 1.173 21 D HN 0.186 8.556 8.370 -0.000 0.000 0.467 22 P HA -0.066 4.354 4.420 -0.000 0.000 0.221 22 P C 0.800 178.143 177.300 0.072 0.000 1.150 22 P CA 0.700 63.848 63.100 0.081 0.000 0.800 22 P CB 0.298 32.049 31.700 0.085 0.000 0.787 23 S N -1.477 114.272 115.700 0.083 0.000 2.425 23 S HA -0.043 3.859 4.470 -0.947 0.000 0.225 23 S C 1.696 176.325 174.600 0.049 0.000 1.024 23 S CA 1.715 59.955 58.200 0.068 0.000 0.951 23 S CB -0.673 62.575 63.200 0.080 0.000 0.796 23 S HN 0.376 8.686 8.310 -0.000 0.000 0.498 24 T N -3.689 110.893 114.554 0.048 0.000 2.992 24 T HA 0.464 4.245 4.350 -0.947 0.000 0.255 24 T C 1.419 176.136 174.700 0.030 0.000 0.938 24 T CA 0.824 62.943 62.100 0.031 0.000 0.895 24 T CB 0.405 69.285 68.868 0.020 0.000 1.221 24 T HN 0.521 8.761 8.240 -0.000 0.000 0.512 25 G N 1.971 110.795 108.800 0.040 0.000 2.179 25 G HA2 -0.025 3.367 3.960 -0.947 0.000 0.260 25 G HA3 -0.025 3.367 3.960 -0.947 0.000 0.260 25 G C 0.418 175.339 174.900 0.036 0.000 0.977 25 G CA -0.032 45.091 45.100 0.038 0.000 0.641 25 G HN 1.402 9.692 8.290 -0.000 0.000 0.533 26 A N -0.098 122.742 122.820 0.034 0.000 2.566 26 A HA 0.483 4.235 4.320 -0.947 0.000 0.245 26 A C 1.529 179.141 177.584 0.046 0.000 1.056 26 A CA 1.001 53.056 52.037 0.030 0.000 0.757 26 A CB 0.272 19.281 19.000 0.014 0.000 0.979 26 A HN 1.338 9.488 8.150 -0.000 0.000 0.508 27 L N 3.628 124.877 121.223 0.044 0.000 2.023 27 L HA 0.035 3.807 4.340 -0.947 0.000 0.205 27 L C 1.688 178.594 176.870 0.060 0.000 1.073 27 L CA 2.253 57.121 54.840 0.048 0.000 0.745 27 L CB -0.767 41.312 42.059 0.034 0.000 0.900 27 L HN 0.710 8.940 8.230 -0.000 0.000 0.435 28 S N -0.076 115.670 115.700 0.077 0.000 2.549 28 S HA 0.023 3.924 4.470 -0.947 0.000 0.286 28 S C 0.236 174.939 174.600 0.171 0.000 1.314 28 S CA -0.333 57.947 58.200 0.133 0.000 1.062 28 S CB -0.175 63.162 63.200 0.228 0.000 0.865 28 S HN 0.477 8.787 8.310 -0.000 0.000 0.498 29 T N 7.825 122.501 114.554 0.204 0.000 2.831 29 T HA 0.176 3.958 4.350 -0.947 0.000 0.291 29 T C -2.308 172.545 174.700 0.255 0.000 0.981 29 T CA -0.385 61.857 62.100 0.236 0.000 1.174 29 T CB 0.173 69.185 68.868 0.241 0.000 0.929 29 T HN 0.517 8.757 8.240 -0.000 0.000 0.532 30 P HA 0.158 4.578 4.420 -0.000 0.000 0.269 30 P C -0.182 176.912 177.300 -0.344 0.000 1.209 30 P CA -0.294 62.633 63.100 -0.289 0.000 0.776 30 P CB 0.306 31.605 31.700 -0.668 0.000 0.876 31 I N 2.787 123.054 120.570 -0.506 0.000 2.294 31 I HA 0.136 3.738 4.170 -0.947 0.000 0.295 31 I C 0.138 176.037 176.117 -0.364 0.000 1.098 31 I CA -0.172 60.894 61.300 -0.390 0.000 1.277 31 I CB -0.455 37.234 38.000 -0.518 0.000 1.434 31 I HN 0.223 8.433 8.210 -0.000 0.000 0.498 32 F N 4.571 124.472 119.950 -0.082 0.000 2.640 32 F HA 0.141 4.105 4.527 -0.938 0.000 0.354 32 F C 1.156 176.885 175.800 -0.118 0.000 1.213 32 F CA -0.360 57.577 58.000 -0.105 0.000 1.314 32 F CB -0.143 38.810 39.000 -0.079 0.000 1.679 32 F HN 0.477 8.777 8.300 -0.000 0.000 0.622 33 Q N 2.121 121.895 119.800 -0.044 0.000 2.837 33 Q HA 0.164 3.936 4.340 -0.947 0.000 0.235 33 Q C -0.210 175.728 176.000 -0.103 0.000 1.348 33 Q CA 0.148 55.914 55.803 -0.061 0.000 0.990 33 Q CB 0.156 28.834 28.738 -0.101 0.000 1.570 33 Q HN 0.400 8.670 8.270 -0.000 0.000 0.575 34 T N -0.037 114.443 114.554 -0.124 0.000 2.903 34 T HA 0.490 4.271 4.350 -0.947 0.000 0.299 34 T C 0.638 175.202 174.700 -0.226 0.000 1.093 34 T CA 0.070 62.036 62.100 -0.223 0.000 1.002 34 T CB 1.267 69.886 68.868 -0.416 0.000 1.127 34 T HN 0.487 8.727 8.240 -0.000 0.000 0.488 35 S N 1.422 116.988 115.700 -0.223 0.000 2.452 35 S HA 0.195 4.097 4.470 -0.947 0.000 0.225 35 S C 0.845 175.322 174.600 -0.205 0.000 1.057 35 S CA 0.053 58.101 58.200 -0.252 0.000 0.949 35 S CB -0.248 62.854 63.200 -0.164 0.000 0.836 35 S HN 0.661 8.971 8.310 -0.000 0.000 0.518 36 T N 2.694 117.155 114.554 -0.154 0.000 2.889 36 T HA 0.615 4.396 4.350 -0.947 0.000 0.291 36 T C -1.115 173.397 174.700 -0.312 0.000 0.995 36 T CA -0.061 62.015 62.100 -0.041 0.000 1.092 36 T CB 0.425 69.279 68.868 -0.023 0.000 0.954 36 T HN 0.201 8.441 8.240 -0.000 0.000 0.506 37 F N 0.974 120.884 119.950 -0.065 0.000 2.532 37 F HA 0.557 4.516 4.527 -0.946 0.000 0.321 37 F C -0.110 175.448 175.800 -0.403 0.000 1.089 37 F CA -1.057 56.837 58.000 -0.178 0.000 0.926 37 F CB 1.606 40.524 39.000 -0.137 0.000 1.168 37 F HN 0.185 8.485 8.300 -0.000 0.000 0.459 38 V N 3.527 123.330 119.914 -0.185 0.000 2.472 38 V HA 0.383 3.935 4.120 -0.947 0.000 0.290 38 V C -0.493 175.430 176.094 -0.284 0.000 1.037 38 V CA -0.794 61.352 62.300 -0.257 0.000 0.908 38 V CB 1.232 33.010 31.823 -0.074 0.000 0.985 38 V HN 0.429 8.619 8.190 -0.000 0.000 0.454 39 F N 1.706 121.739 119.950 0.137 0.000 2.397 39 F HA 0.435 4.396 4.527 -0.944 0.000 0.331 39 F C 1.350 177.200 175.800 0.083 0.000 1.090 39 F CA -0.951 57.117 58.000 0.114 0.000 1.065 39 F CB 0.764 39.834 39.000 0.116 0.000 1.184 39 F HN 0.473 8.773 8.300 -0.000 0.000 0.499 40 D N 0.024 120.582 120.400 0.263 0.000 2.234 40 D HA -0.017 4.055 4.640 -0.947 0.000 0.205 40 D C 0.488 176.868 176.300 0.134 0.000 0.962 40 D CA 1.041 55.135 54.000 0.156 0.000 0.855 40 D CB 0.264 41.136 40.800 0.120 0.000 0.951 40 D HN 0.458 8.828 8.370 -0.000 0.000 0.500 41 S N -1.679 114.111 115.700 0.149 0.000 2.615 41 S HA 0.596 4.498 4.470 -0.947 0.000 0.269 41 S C 0.739 175.379 174.600 0.067 0.000 1.161 41 S CA -0.264 57.990 58.200 0.091 0.000 0.817 41 S CB 1.777 65.010 63.200 0.055 0.000 1.131 41 S HN -0.060 8.250 8.310 -0.000 0.000 0.467 42 A N 0.960 123.796 122.820 0.027 0.000 1.908 42 A HA -0.072 3.679 4.320 -0.947 0.000 0.218 42 A C 1.810 179.355 177.584 -0.065 0.000 1.181 42 A CA 2.262 54.285 52.037 -0.023 0.000 0.627 42 A CB -1.371 17.616 19.000 -0.022 0.000 0.818 42 A HN 0.894 9.044 8.150 -0.000 0.000 0.445 43 E N -0.515 119.664 120.200 -0.036 0.000 2.085 43 E HA -0.232 3.550 4.350 -0.947 0.000 0.194 43 E C 2.167 178.732 176.600 -0.058 0.000 0.994 43 E CA 1.555 57.929 56.400 -0.043 0.000 0.801 43 E CB -0.312 29.378 29.700 -0.018 0.000 0.743 43 E HN 0.795 9.155 8.360 -0.000 0.000 0.453 44 Q N -0.184 119.597 119.800 -0.032 0.000 2.084 44 Q HA -0.128 3.644 4.340 -0.947 0.000 0.202 44 Q C 2.165 178.057 176.000 -0.181 0.000 0.978 44 Q CA 1.616 57.408 55.803 -0.019 0.000 0.844 44 Q CB -0.343 28.457 28.738 0.102 0.000 0.898 44 Q HN 0.379 8.649 8.270 -0.000 0.000 0.426 45 G N 0.236 108.776 108.800 -0.433 0.000 2.418 45 G HA2 -0.250 3.142 3.960 -0.947 0.000 0.217 45 G HA3 -0.250 3.142 3.960 -0.947 0.000 0.217 45 G C 1.430 176.082 174.900 -0.412 0.000 1.158 45 G CA 0.890 45.343 45.100 -1.079 0.000 0.771 45 G HN 0.491 8.781 8.290 -0.000 0.000 0.545 46 A N 1.225 123.906 122.820 -0.231 0.000 1.873 46 A HA 0.288 4.040 4.320 -0.947 0.000 0.215 46 A C 2.847 180.400 177.584 -0.050 0.000 1.186 46 A CA 2.246 54.215 52.037 -0.113 0.000 0.616 46 A CB -0.908 18.030 19.000 -0.103 0.000 0.823 46 A HN 0.795 8.945 8.150 -0.000 0.000 0.442 47 A N 0.156 122.934 122.820 -0.069 0.000 1.859 47 A HA -0.233 3.518 4.320 -0.947 0.000 0.217 47 A C 2.263 179.818 177.584 -0.048 0.000 1.198 47 A CA 1.741 53.748 52.037 -0.049 0.000 0.629 47 A CB -0.608 18.367 19.000 -0.041 0.000 0.830 47 A HN 0.540 8.690 8.150 -0.000 0.000 0.446 48 R N -1.935 118.528 120.500 -0.061 0.000 2.091 48 R HA -0.140 3.631 4.340 -0.947 0.000 0.238 48 R C 1.935 178.168 176.300 -0.112 0.000 1.136 48 R CA 1.669 57.721 56.100 -0.081 0.000 0.959 48 R CB -0.658 29.617 30.300 -0.041 0.000 0.856 48 R HN 0.559 8.829 8.270 -0.000 0.000 0.437 49 F N 1.130 120.995 119.950 -0.142 0.000 2.293 49 F HA -0.078 3.881 4.527 -0.947 0.000 0.300 49 F C 2.570 178.294 175.800 -0.126 0.000 1.086 49 F CA 0.874 58.803 58.000 -0.119 0.000 1.375 49 F CB -0.394 38.525 39.000 -0.134 0.000 1.045 49 F HN 0.069 8.369 8.300 -0.000 0.000 0.516 50 A N 0.571 123.417 122.820 0.044 0.000 1.896 50 A HA -0.199 3.553 4.320 -0.947 0.000 0.220 50 A C 1.212 178.765 177.584 -0.052 0.000 1.206 50 A CA 1.857 53.890 52.037 -0.007 0.000 0.647 50 A CB -1.346 17.635 19.000 -0.031 0.000 0.828 50 A HN 0.288 8.438 8.150 -0.000 0.000 0.455 51 L N -2.433 118.725 121.223 -0.109 0.000 2.657 51 L HA 0.450 4.221 4.340 -0.947 0.000 0.239 51 L C 0.646 177.455 176.870 -0.101 0.000 1.215 51 L CA -0.478 54.286 54.840 -0.127 0.000 1.161 51 L CB -0.320 41.602 42.059 -0.228 0.000 1.436 51 L HN 0.157 8.387 8.230 -0.000 0.000 0.414 52 E N 1.043 121.201 120.200 -0.070 0.000 2.065 52 E HA -0.206 3.576 4.350 -0.947 0.000 0.201 52 E C 0.516 177.079 176.600 -0.061 0.000 1.016 52 E CA 1.629 57.994 56.400 -0.058 0.000 0.818 52 E CB 0.483 30.157 29.700 -0.044 0.000 0.749 52 E HN 0.861 9.221 8.360 -0.000 0.000 0.453 53 E N 0.113 120.274 120.200 -0.064 0.000 2.299 53 E HA 0.264 4.045 4.350 -0.947 0.000 0.260 53 E C -0.823 175.727 176.600 -0.084 0.000 0.944 53 E CA -0.437 55.926 56.400 -0.062 0.000 0.815 53 E CB 1.615 31.288 29.700 -0.045 0.000 1.252 53 E HN 0.014 8.374 8.360 -0.000 0.000 0.418 54 S N 0.221 115.867 115.700 -0.089 0.000 2.690 54 S HA 0.916 4.818 4.470 -0.947 0.000 0.291 54 S C 0.250 174.749 174.600 -0.168 0.000 1.138 54 S CA 0.166 58.283 58.200 -0.139 0.000 1.013 54 S CB 1.567 64.687 63.200 -0.134 0.000 1.053 54 S HN 0.937 9.247 8.310 -0.000 0.000 0.539 55 G N -0.040 108.570 108.800 -0.317 0.000 2.361 55 G HA2 0.262 3.654 3.960 -0.947 0.000 0.331 55 G HA3 0.262 3.654 3.960 -0.947 0.000 0.331 55 G C -1.916 172.637 174.900 -0.577 0.000 1.324 55 G CA -1.029 43.845 45.100 -0.376 0.000 0.984 55 G HN 0.695 8.985 8.290 -0.000 0.000 0.586 56 Y N -1.082 119.056 120.300 -0.269 0.000 2.488 56 Y HA 0.799 4.785 4.550 -0.939 0.000 0.325 56 Y C 1.513 177.164 175.900 -0.415 0.000 1.204 56 Y CA -0.528 57.218 58.100 -0.589 0.000 1.229 56 Y CB 1.707 39.345 38.460 -1.371 0.000 1.274 56 Y HN 0.444 8.724 8.280 -0.000 0.000 0.493 57 I N -0.937 119.497 120.570 -0.227 0.000 4.317 57 I HA 0.129 3.731 4.170 -0.947 0.000 0.289 57 I C -1.429 174.910 176.117 0.370 0.000 1.164 57 I CA -0.044 61.328 61.300 0.120 0.000 1.312 57 I CB 1.238 39.239 38.000 0.002 0.000 1.569 57 I HN 0.471 8.681 8.210 -0.000 0.000 0.450 58 Y N 0.189 120.577 120.300 0.147 0.000 2.409 58 Y HA 0.166 4.152 4.550 -0.940 0.000 0.321 58 Y C 0.704 176.742 175.900 0.230 0.000 1.209 58 Y CA -0.672 57.599 58.100 0.286 0.000 1.086 58 Y CB 1.382 39.956 38.460 0.191 0.000 1.320 58 Y HN -0.151 8.129 8.280 -0.000 0.000 0.440 59 T N 3.557 118.060 114.554 -0.085 0.000 2.849 59 T HA -0.161 3.621 4.350 -0.947 0.000 0.270 59 T C 1.811 176.475 174.700 -0.060 0.000 1.066 59 T CA 2.010 64.093 62.100 -0.029 0.000 1.130 59 T CB -0.112 68.713 68.868 -0.072 0.000 0.864 59 T HN 0.639 8.879 8.240 -0.000 0.000 0.481 60 R N 0.511 120.949 120.500 -0.104 0.000 2.120 60 R HA 0.010 3.782 4.340 -0.947 0.000 0.234 60 R C 2.060 178.405 176.300 0.075 0.000 1.123 60 R CA 1.141 57.275 56.100 0.056 0.000 0.975 60 R CB -0.276 30.151 30.300 0.211 0.000 0.866 60 R HN 0.383 8.653 8.270 -0.000 0.000 0.446 61 L N -1.151 120.149 121.223 0.128 0.000 2.162 61 L HA 0.266 4.038 4.340 -0.947 0.000 0.205 61 L C 1.031 177.882 176.870 -0.032 0.000 1.086 61 L CA 0.512 55.382 54.840 0.050 0.000 0.778 61 L CB 0.103 42.249 42.059 0.145 0.000 0.928 61 L HN 0.383 8.613 8.230 -0.000 0.000 0.446 62 G N -0.724 108.093 108.800 0.028 0.000 2.411 62 G HA2 0.227 3.619 3.960 -0.947 0.000 0.295 62 G HA3 0.227 3.619 3.960 -0.947 0.000 0.295 62 G C -2.140 172.799 174.900 0.066 0.000 1.542 62 G CA -0.491 44.646 45.100 0.061 0.000 0.814 62 G HN -0.048 8.242 8.290 -0.000 0.000 0.557 63 N N 0.831 119.534 118.700 0.005 0.000 2.446 63 N HA 0.402 4.573 4.740 -0.947 0.000 0.272 63 N C -2.426 172.840 175.510 -0.406 0.000 1.127 63 N CA -1.341 51.550 53.050 -0.266 0.000 0.896 63 N CB 3.107 41.586 38.487 -0.013 0.000 1.658 63 N HN 0.052 8.432 8.380 -0.000 0.000 0.483 64 P HA -0.017 4.403 4.420 -0.000 0.000 0.217 64 P C 1.040 178.317 177.300 -0.038 0.000 1.150 64 P CA 1.566 64.359 63.100 -0.511 0.000 0.832 64 P CB 0.289 31.392 31.700 -0.995 0.000 0.787 65 T N -0.831 113.794 114.554 0.119 0.000 2.737 65 T HA -0.130 3.651 4.350 -0.947 0.000 0.265 65 T C 1.861 176.636 174.700 0.125 0.000 1.038 65 T CA 2.285 64.517 62.100 0.220 0.000 1.144 65 T CB -1.333 67.701 68.868 0.277 0.000 0.866 65 T HN 0.318 8.558 8.240 -0.000 0.000 0.434 66 T N 0.448 115.050 114.554 0.081 0.000 2.867 66 T HA -0.121 3.661 4.350 -0.947 0.000 0.268 66 T C 1.698 176.428 174.700 0.051 0.000 1.057 66 T CA 1.577 63.711 62.100 0.057 0.000 1.136 66 T CB -0.530 68.363 68.868 0.040 0.000 0.874 66 T HN 0.350 8.590 8.240 -0.000 0.000 0.466 67 D N 2.082 122.520 120.400 0.062 0.000 2.123 67 D HA -0.029 4.042 4.640 -0.947 0.000 0.196 67 D C 2.357 178.697 176.300 0.067 0.000 0.992 67 D CA 1.393 55.440 54.000 0.079 0.000 0.833 67 D CB -0.592 40.297 40.800 0.148 0.000 0.954 67 D HN 0.486 8.856 8.370 -0.000 0.000 0.455 68 A N 0.023 122.887 122.820 0.074 0.000 1.883 68 A HA -0.136 3.615 4.320 -0.947 0.000 0.217 68 A C 2.188 179.792 177.584 0.034 0.000 1.186 68 A CA 1.554 53.628 52.037 0.062 0.000 0.624 68 A CB -1.023 18.026 19.000 0.080 0.000 0.822 68 A HN 0.406 8.556 8.150 -0.000 0.000 0.444 69 L N 0.034 121.273 121.223 0.028 0.000 2.017 69 L HA -0.158 3.614 4.340 -0.947 0.000 0.208 69 L C 2.197 179.073 176.870 0.010 0.000 1.073 69 L CA 2.509 57.351 54.840 0.004 0.000 0.745 69 L CB -0.697 41.363 42.059 0.002 0.000 0.894 69 L HN 0.536 8.766 8.230 -0.000 0.000 0.432 70 E N -0.604 119.609 120.200 0.023 0.000 2.077 70 E HA -0.248 3.534 4.350 -0.947 0.000 0.193 70 E C 2.157 178.775 176.600 0.029 0.000 0.989 70 E CA 1.522 57.938 56.400 0.026 0.000 0.800 70 E CB -0.099 29.614 29.700 0.022 0.000 0.746 70 E HN 0.485 8.845 8.360 -0.000 0.000 0.452 71 K N 0.794 121.212 120.400 0.030 0.000 2.097 71 K HA -0.133 3.618 4.320 -0.947 0.000 0.205 71 K C 2.165 178.779 176.600 0.023 0.000 1.050 71 K CA 0.885 57.191 56.287 0.031 0.000 0.938 71 K CB -0.033 32.489 32.500 0.037 0.000 0.718 71 K HN -0.048 8.202 8.250 -0.000 0.000 0.442 72 K N 0.913 121.319 120.400 0.010 0.000 2.002 72 K HA -0.134 3.618 4.320 -0.947 0.000 0.209 72 K C 2.002 178.594 176.600 -0.014 0.000 1.048 72 K CA 1.022 57.300 56.287 -0.013 0.000 0.930 72 K CB 0.059 32.537 32.500 -0.036 0.000 0.714 72 K HN 0.013 8.263 8.250 -0.000 0.000 0.438 73 L N 0.839 122.062 121.223 -0.000 0.000 2.141 73 L HA -0.096 3.676 4.340 -0.947 0.000 0.209 73 L C 2.544 179.449 176.870 0.057 0.000 1.094 73 L CA 1.714 56.565 54.840 0.018 0.000 0.763 73 L CB -1.389 40.681 42.059 0.019 0.000 0.908 73 L HN 0.308 8.538 8.230 -0.000 0.000 0.437 74 A N -0.452 122.401 122.820 0.055 0.000 1.883 74 A HA -0.164 3.588 4.320 -0.947 0.000 0.217 74 A C 2.438 180.063 177.584 0.068 0.000 1.186 74 A CA 1.844 53.922 52.037 0.069 0.000 0.624 74 A CB -0.726 18.309 19.000 0.059 0.000 0.822 74 A HN 0.214 8.364 8.150 -0.000 0.000 0.444 75 V N 0.279 120.221 119.914 0.046 0.000 2.295 75 V HA -0.266 3.285 4.120 -0.947 0.000 0.246 75 V C 2.571 178.703 176.094 0.063 0.000 1.049 75 V CA 2.014 64.340 62.300 0.043 0.000 1.024 75 V CB -0.764 31.067 31.823 0.014 0.000 0.648 75 V HN 0.579 8.769 8.190 -0.000 0.000 0.447 76 L N -0.408 120.836 121.223 0.035 0.000 2.131 76 L HA -0.121 3.651 4.340 -0.947 0.000 0.210 76 L C 2.372 179.418 176.870 0.293 0.000 1.092 76 L CA 1.300 56.202 54.840 0.104 0.000 0.759 76 L CB -0.554 41.520 42.059 0.025 0.000 0.903 76 L HN 0.357 8.587 8.230 -0.000 0.000 0.435 77 E N 0.328 120.645 120.200 0.194 0.000 2.489 77 E HA -0.015 3.766 4.350 -0.947 0.000 0.193 77 E C 0.068 176.751 176.600 0.138 0.000 1.057 77 E CA -0.083 56.426 56.400 0.182 0.000 0.866 77 E CB 0.289 30.095 29.700 0.176 0.000 0.916 77 E HN 0.169 8.529 8.360 -0.000 0.000 0.500 78 R N -0.470 120.110 120.500 0.133 0.000 3.422 78 R HA -0.169 3.602 4.340 -0.947 0.000 0.267 78 R C 0.284 176.631 176.300 0.078 0.000 1.074 78 R CA 0.917 57.077 56.100 0.098 0.000 0.718 78 R CB -2.113 28.240 30.300 0.088 0.000 1.157 78 R HN 0.247 8.517 8.270 -0.000 0.000 0.440 79 G N -1.154 107.695 108.800 0.082 0.000 2.597 79 G HA2 0.469 3.861 3.960 -0.947 0.000 0.317 79 G HA3 0.469 3.861 3.960 -0.947 0.000 0.317 79 G C 0.438 175.379 174.900 0.069 0.000 1.230 79 G CA -0.713 44.433 45.100 0.076 0.000 0.996 79 G HN 0.205 8.495 8.290 -0.000 0.000 0.490 80 E N -0.475 119.766 120.200 0.069 0.000 2.076 80 E HA 0.243 4.024 4.350 -0.947 0.000 0.190 80 E C 0.972 177.607 176.600 0.059 0.000 0.979 80 E CA 1.021 57.457 56.400 0.060 0.000 0.807 80 E CB 0.248 29.984 29.700 0.059 0.000 0.761 80 E HN 0.490 8.850 8.360 -0.000 0.000 0.454 81 A N 0.401 123.263 122.820 0.070 0.000 2.606 81 A HA 0.674 4.426 4.320 -0.947 0.000 0.293 81 A C -0.575 177.049 177.584 0.066 0.000 1.082 81 A CA -0.222 51.849 52.037 0.057 0.000 0.685 81 A CB 1.899 20.925 19.000 0.045 0.000 1.284 81 A HN 0.129 8.279 8.150 -0.000 0.000 0.408 82 G N -0.833 107.994 108.800 0.045 0.000 2.498 82 G HA2 0.700 4.092 3.960 -0.947 0.000 0.312 82 G HA3 0.700 4.092 3.960 -0.947 0.000 0.312 82 G C -1.862 173.047 174.900 0.015 0.000 1.230 82 G CA -0.557 44.572 45.100 0.049 0.000 0.968 82 G HN 1.383 9.673 8.290 -0.000 0.000 0.481 83 L N 1.000 122.234 121.223 0.017 0.000 2.528 83 L HA 0.764 4.535 4.340 -0.947 0.000 0.267 83 L C 0.150 177.023 176.870 0.004 0.000 0.961 83 L CA -0.568 54.260 54.840 -0.021 0.000 0.866 83 L CB 1.371 43.390 42.059 -0.068 0.000 1.248 83 L HN 0.867 9.097 8.230 -0.000 0.000 0.404 84 A N 2.847 125.667 122.820 -0.000 0.000 2.322 84 A HA 0.842 4.593 4.320 -0.947 0.000 0.269 84 A C 0.097 177.684 177.584 0.005 0.000 1.094 84 A CA 0.398 52.442 52.037 0.012 0.000 0.807 84 A CB 0.510 19.518 19.000 0.014 0.000 1.047 84 A HN 0.861 9.011 8.150 -0.000 0.000 0.487 85 T N -2.813 111.751 114.554 0.016 0.000 2.865 85 T HA 0.620 4.401 4.350 -0.947 0.000 0.294 85 T C 0.774 175.485 174.700 0.018 0.000 1.119 85 T CA 0.018 62.124 62.100 0.011 0.000 1.007 85 T CB 1.270 70.145 68.868 0.011 0.000 1.225 85 T HN 1.359 9.599 8.240 -0.000 0.000 0.515 86 A N 0.831 123.661 122.820 0.017 0.000 2.067 86 A HA 0.438 4.189 4.320 -0.947 0.000 0.219 86 A C 1.192 178.791 177.584 0.026 0.000 1.158 86 A CA 1.140 53.191 52.037 0.024 0.000 0.661 86 A CB -1.015 18.000 19.000 0.024 0.000 0.801 86 A HN 1.828 9.978 8.150 -0.000 0.000 0.452 87 S N -4.942 110.772 115.700 0.022 0.000 2.595 87 S HA 0.496 4.397 4.470 -0.947 0.000 0.270 87 S C 0.903 175.515 174.600 0.019 0.000 1.145 87 S CA 0.053 58.266 58.200 0.023 0.000 0.825 87 S CB 0.729 63.946 63.200 0.028 0.000 1.107 87 S HN 0.782 9.092 8.310 -0.000 0.000 0.461 88 G N 0.905 109.713 108.800 0.013 0.000 2.440 88 G HA2 -0.085 3.306 3.960 -0.947 0.000 0.218 88 G HA3 -0.085 3.306 3.960 -0.947 0.000 0.218 88 G C 1.183 176.086 174.900 0.007 0.000 1.154 88 G CA 1.117 46.222 45.100 0.007 0.000 0.767 88 G HN 0.651 8.941 8.290 -0.000 0.000 0.552 89 I N 1.201 121.779 120.570 0.013 0.000 2.163 89 I HA -0.163 3.438 4.170 -0.947 0.000 0.243 89 I C 2.916 178.996 176.117 -0.062 0.000 1.085 89 I CA 1.668 62.969 61.300 0.002 0.000 1.347 89 I CB -1.131 36.894 38.000 0.042 0.000 1.044 89 I HN 0.236 8.446 8.210 -0.000 0.000 0.408 90 S N 0.251 115.930 115.700 -0.035 0.000 2.399 90 S HA -0.120 3.782 4.470 -0.947 0.000 0.231 90 S C 2.190 176.771 174.600 -0.033 0.000 1.022 90 S CA 1.300 59.473 58.200 -0.045 0.000 0.983 90 S CB -0.122 63.069 63.200 -0.016 0.000 0.803 90 S HN 0.500 8.810 8.310 -0.000 0.000 0.480 91 A N 1.253 124.072 122.820 -0.001 0.000 1.902 91 A HA -0.032 3.720 4.320 -0.947 0.000 0.217 91 A C 2.052 179.658 177.584 0.036 0.000 1.181 91 A CA 1.544 53.600 52.037 0.032 0.000 0.623 91 A CB -0.701 18.336 19.000 0.061 0.000 0.818 91 A HN 0.612 8.762 8.150 -0.000 0.000 0.443 92 I N 0.009 120.583 120.570 0.006 0.000 2.202 92 I HA -0.208 3.393 4.170 -0.947 0.000 0.242 92 I C 2.858 178.908 176.117 -0.113 0.000 1.091 92 I CA 1.834 63.130 61.300 -0.007 0.000 1.368 92 I CB -0.455 37.531 38.000 -0.024 0.000 1.058 92 I HN 0.551 8.761 8.210 -0.000 0.000 0.410 93 T N -2.985 111.412 114.554 -0.262 0.000 2.942 93 T HA -0.080 3.702 4.350 -0.947 0.000 0.265 93 T C 1.841 176.474 174.700 -0.112 0.000 1.062 93 T CA 1.439 63.303 62.100 -0.395 0.000 1.139 93 T CB -0.663 67.788 68.868 -0.696 0.000 0.883 93 T HN 0.163 8.403 8.240 -0.000 0.000 0.468 94 T N 2.207 116.725 114.554 -0.060 0.000 2.708 94 T HA -0.106 3.676 4.350 -0.947 0.000 0.266 94 T C 2.175 176.912 174.700 0.062 0.000 1.037 94 T CA 1.968 64.065 62.100 -0.006 0.000 1.146 94 T CB -0.977 67.883 68.868 -0.014 0.000 0.865 94 T HN 0.509 8.749 8.240 -0.000 0.000 0.435 95 T N 2.464 117.090 114.554 0.119 0.000 2.622 95 T HA -0.009 3.772 4.350 -0.947 0.000 0.266 95 T C 1.977 176.812 174.700 0.225 0.000 1.047 95 T CA 1.094 63.359 62.100 0.275 0.000 1.159 95 T CB -0.500 68.531 68.868 0.272 0.000 0.863 95 T HN 0.252 8.492 8.240 -0.000 0.000 0.422 96 L N 0.244 121.553 121.223 0.144 0.000 2.156 96 L HA 0.069 3.841 4.340 -0.947 0.000 0.208 96 L C 2.375 179.337 176.870 0.154 0.000 1.095 96 L CA 0.856 55.785 54.840 0.147 0.000 0.770 96 L CB -0.490 41.675 42.059 0.176 0.000 0.914 96 L HN 0.240 8.470 8.230 -0.000 0.000 0.439 97 L N -1.001 120.310 121.223 0.146 0.000 2.395 97 L HA -0.092 3.679 4.340 -0.947 0.000 0.218 97 L C 2.411 179.324 176.870 0.072 0.000 1.130 97 L CA 0.726 55.628 54.840 0.104 0.000 0.826 97 L CB -0.562 41.539 42.059 0.070 0.000 0.941 97 L HN 0.213 8.443 8.230 -0.000 0.000 0.451 98 T N -0.010 114.605 114.554 0.101 0.000 2.851 98 T HA -0.032 3.750 4.350 -0.947 0.000 0.262 98 T C 1.911 176.697 174.700 0.143 0.000 1.043 98 T CA 0.994 63.158 62.100 0.106 0.000 1.140 98 T CB 0.005 68.940 68.868 0.111 0.000 0.872 98 T HN 0.192 8.432 8.240 -0.000 0.000 0.446 99 L N 0.033 121.361 121.223 0.175 0.000 2.209 99 L HA 0.142 3.914 4.340 -0.947 0.000 0.207 99 L C 0.697 177.620 176.870 0.088 0.000 1.094 99 L CA 0.226 55.152 54.840 0.144 0.000 0.790 99 L CB -0.011 42.119 42.059 0.119 0.000 0.932 99 L HN 0.276 8.506 8.230 -0.000 0.000 0.447 100 C N -0.446 118.901 119.300 0.077 0.000 2.454 100 C HA 0.603 4.495 4.460 -0.947 0.000 0.336 100 C C 0.075 175.093 174.990 0.047 0.000 1.189 100 C CA -0.748 58.303 59.018 0.056 0.000 1.877 100 C CB 1.422 29.190 27.740 0.047 0.000 2.348 100 C HN 0.401 8.631 8.230 -0.000 0.000 0.508 101 Q N 0.899 120.724 119.800 0.042 0.000 2.615 101 Q HA 0.495 4.267 4.340 -0.947 0.000 0.298 101 Q C -1.273 174.755 176.000 0.047 0.000 1.023 101 Q CA -0.766 55.059 55.803 0.037 0.000 0.768 101 Q CB 1.022 29.779 28.738 0.030 0.000 1.500 101 Q HN 0.787 9.057 8.270 -0.000 0.000 0.441 102 Q N -0.101 119.730 119.800 0.053 0.000 2.283 102 Q HA 0.288 4.060 4.340 -0.947 0.000 0.301 102 Q C 0.561 176.588 176.000 0.044 0.000 1.063 102 Q CA 0.974 56.812 55.803 0.059 0.000 0.952 102 Q CB 0.008 28.784 28.738 0.064 0.000 1.166 102 Q HN 1.117 9.387 8.270 -0.000 0.000 0.381 103 G N 2.149 110.974 108.800 0.041 0.000 2.234 103 G HA2 -0.211 3.180 3.960 -0.947 0.000 0.235 103 G HA3 -0.211 3.180 3.960 -0.947 0.000 0.235 103 G C -0.313 174.612 174.900 0.042 0.000 0.997 103 G CA 0.090 45.210 45.100 0.034 0.000 0.623 103 G HN 0.719 9.009 8.290 -0.000 0.000 0.514 104 D N 0.202 120.631 120.400 0.049 0.000 2.377 104 D HA 0.549 4.620 4.640 -0.947 0.000 0.245 104 D C 0.235 176.592 176.300 0.094 0.000 1.196 104 D CA 0.148 54.184 54.000 0.061 0.000 0.962 104 D CB 0.607 41.434 40.800 0.044 0.000 1.127 104 D HN 0.404 8.774 8.370 -0.000 0.000 0.471 105 H N -0.143 118.909 119.070 -0.030 0.000 2.851 105 H HA 0.529 4.517 4.556 -0.947 0.000 0.372 105 H C -1.201 174.087 175.328 -0.066 0.000 1.158 105 H CA -0.639 55.376 56.048 -0.055 0.000 1.159 105 H CB 1.172 30.904 29.762 -0.050 0.000 1.757 105 H HN 0.218 8.498 8.280 -0.000 0.000 0.546 106 I N 4.060 124.171 120.570 -0.764 0.000 2.533 106 I HA 0.185 3.787 4.170 -0.947 0.000 0.290 106 I C -0.532 175.125 176.117 -0.767 0.000 1.056 106 I CA -1.015 59.941 61.300 -0.572 0.000 1.057 106 I CB 2.345 40.131 38.000 -0.356 0.000 1.240 106 I HN 0.216 8.426 8.210 -0.000 0.000 0.423 107 V N 4.617 124.277 119.914 -0.423 0.000 2.370 107 V HA 0.403 3.954 4.120 -0.947 0.000 0.279 107 V C 0.037 176.021 176.094 -0.184 0.000 1.029 107 V CA -0.152 61.984 62.300 -0.273 0.000 0.870 107 V CB 1.422 33.188 31.823 -0.095 0.000 0.984 107 V HN 0.781 8.971 8.190 -0.000 0.000 0.451 108 S N 4.186 119.747 115.700 -0.231 0.000 2.542 108 S HA 0.818 4.719 4.470 -0.947 0.000 0.293 108 S C 0.028 174.671 174.600 0.071 0.000 1.089 108 S CA -0.174 57.988 58.200 -0.064 0.000 0.961 108 S CB 1.703 64.804 63.200 -0.165 0.000 1.062 108 S HN 1.147 9.457 8.310 -0.000 0.000 0.483 109 A N 2.859 125.770 122.820 0.151 0.000 2.520 109 A HA 0.360 4.112 4.320 -0.947 0.000 0.235 109 A C 1.228 178.998 177.584 0.310 0.000 1.065 109 A CA 0.119 52.256 52.037 0.168 0.000 0.764 109 A CB -0.178 18.882 19.000 0.101 0.000 1.002 109 A HN 0.929 9.079 8.150 -0.000 0.000 0.502 110 S N 1.096 116.953 115.700 0.262 0.000 2.395 110 S HA 0.090 3.992 4.470 -0.947 0.000 0.225 110 S C 1.396 176.105 174.600 0.183 0.000 1.027 110 S CA 0.820 59.178 58.200 0.263 0.000 0.965 110 S CB -0.124 63.167 63.200 0.151 0.000 0.812 110 S HN 1.113 9.423 8.310 -0.000 0.000 0.482 111 A N 2.526 125.411 122.820 0.109 0.000 3.026 111 A HA 0.481 4.232 4.320 -0.947 0.000 0.272 111 A C 0.291 177.920 177.584 0.074 0.000 1.782 111 A CA -0.326 51.742 52.037 0.051 0.000 1.451 111 A CB -1.209 17.795 19.000 0.007 0.000 1.081 111 A HN 0.563 8.713 8.150 -0.000 0.000 0.611 112 I N -3.196 117.460 120.570 0.144 0.000 3.145 112 I HA 0.564 4.165 4.170 -0.947 0.000 0.313 112 I C -0.096 176.141 176.117 0.202 0.000 1.122 112 I CA -1.559 59.857 61.300 0.193 0.000 0.987 112 I CB 1.125 39.326 38.000 0.335 0.000 1.236 112 I HN 0.270 8.480 8.210 -0.000 0.000 0.453 113 Y N 2.513 122.876 120.300 0.104 0.000 2.895 113 Y HA 0.155 4.137 4.550 -0.947 0.000 0.334 113 Y C 1.398 177.387 175.900 0.147 0.000 1.261 113 Y CA 0.986 59.153 58.100 0.111 0.000 1.560 113 Y CB 1.133 39.667 38.460 0.123 0.000 1.253 113 Y HN 0.774 9.054 8.280 -0.000 0.000 0.582 114 G N 3.491 112.015 108.800 -0.460 0.000 2.476 114 G HA2 -0.301 3.091 3.960 -0.947 0.000 0.218 114 G HA3 -0.301 3.091 3.960 -0.947 0.000 0.218 114 G C 1.528 176.278 174.900 -0.249 0.000 1.164 114 G CA 1.101 46.016 45.100 -0.309 0.000 0.768 114 G HN 0.811 9.101 8.290 -0.000 0.000 0.560 115 C N 0.596 119.574 119.300 -0.537 0.000 2.435 115 C HA 0.016 3.907 4.460 -0.947 0.000 0.279 115 C C 3.217 178.291 174.990 0.139 0.000 1.321 115 C CA 1.395 60.349 59.018 -0.107 0.000 1.752 115 C CB -1.052 26.698 27.740 0.017 0.000 1.959 115 C HN 0.457 8.687 8.230 -0.000 0.000 0.500 116 T N -0.791 113.905 114.554 0.237 0.000 2.746 116 T HA -0.207 3.574 4.350 -0.947 0.000 0.267 116 T C 1.810 176.667 174.700 0.262 0.000 1.039 116 T CA 1.452 63.726 62.100 0.290 0.000 1.142 116 T CB -0.507 68.568 68.868 0.344 0.000 0.866 116 T HN 0.628 8.868 8.240 -0.000 0.000 0.444 117 H N 1.172 120.317 119.070 0.124 0.000 2.353 117 H HA 0.043 4.031 4.556 -0.948 0.000 0.300 117 H C 2.435 177.794 175.328 0.052 0.000 1.090 117 H CA 1.600 57.691 56.048 0.072 0.000 1.327 117 H CB -0.281 29.443 29.762 -0.063 0.000 1.383 117 H HN 0.368 8.648 8.280 -0.000 0.000 0.508 118 A N 0.666 123.627 122.820 0.236 0.000 1.902 118 A HA -0.188 3.564 4.320 -0.947 0.000 0.217 118 A C 2.361 180.083 177.584 0.230 0.000 1.181 118 A CA 1.380 53.572 52.037 0.258 0.000 0.623 118 A CB -1.160 17.977 19.000 0.229 0.000 0.818 118 A HN 0.476 8.626 8.150 -0.000 0.000 0.443 119 F N 0.731 120.734 119.950 0.088 0.000 2.075 119 F HA -0.147 3.813 4.527 -0.945 0.000 0.297 119 F C 1.867 177.680 175.800 0.022 0.000 1.113 119 F CA 1.858 59.897 58.000 0.065 0.000 1.218 119 F CB -0.390 38.643 39.000 0.054 0.000 0.984 119 F HN 0.135 8.435 8.300 -0.000 0.000 0.472 120 L N -0.756 120.397 121.223 -0.118 0.000 2.093 120 L HA -0.178 3.594 4.340 -0.947 0.000 0.208 120 L C 2.485 179.254 176.870 -0.168 0.000 1.085 120 L CA 1.309 56.000 54.840 -0.249 0.000 0.755 120 L CB -0.855 41.157 42.059 -0.078 0.000 0.904 120 L HN 0.106 8.336 8.230 -0.000 0.000 0.435 121 S N -1.724 113.887 115.700 -0.147 0.000 2.395 121 S HA -0.062 3.840 4.470 -0.947 0.000 0.225 121 S C 1.703 176.026 174.600 -0.462 0.000 1.027 121 S CA 0.723 58.729 58.200 -0.324 0.000 0.965 121 S CB -0.066 62.749 63.200 -0.641 0.000 0.812 121 S HN 0.479 8.789 8.310 -0.000 0.000 0.482 122 H N -0.627 118.410 119.070 -0.055 0.000 2.521 122 H HA 0.371 4.358 4.556 -0.948 0.000 0.267 122 H C 2.092 177.322 175.328 -0.165 0.000 0.963 122 H CA 0.670 56.670 56.048 -0.080 0.000 1.175 122 H CB -0.254 29.484 29.762 -0.039 0.000 1.450 122 H HN 0.222 8.502 8.280 -0.000 0.000 0.472 123 S N 1.033 116.674 115.700 -0.098 0.000 2.362 123 S HA -0.048 3.854 4.470 -0.947 0.000 0.221 123 S C 2.216 176.576 174.600 -0.400 0.000 1.032 123 S CA 0.624 58.687 58.200 -0.229 0.000 0.973 123 S CB 0.097 63.293 63.200 -0.007 0.000 0.849 123 S HN 0.101 8.411 8.310 -0.000 0.000 0.465 124 M N 1.232 120.542 119.600 -0.483 0.000 2.082 124 M HA -0.045 3.867 4.480 -0.947 0.000 0.258 124 M C -1.029 175.159 176.300 -0.188 0.000 1.069 124 M CA 1.441 56.536 55.300 -0.341 0.000 1.102 124 M CB -2.639 29.675 32.600 -0.476 0.000 1.336 124 M HN 0.103 8.393 8.290 -0.000 0.000 0.404 125 P HA -0.163 4.257 4.420 -0.000 0.000 0.220 125 P C 1.080 178.297 177.300 -0.138 0.000 1.148 125 P CA 1.391 64.417 63.100 -0.124 0.000 0.803 125 P CB -0.352 31.288 31.700 -0.100 0.000 0.782 126 K N -1.190 119.049 120.400 -0.268 0.000 2.439 126 K HA -0.026 3.726 4.320 -0.947 0.000 0.197 126 K C 0.654 177.048 176.600 -0.343 0.000 1.041 126 K CA 1.076 57.161 56.287 -0.337 0.000 0.970 126 K CB -0.583 31.644 32.500 -0.455 0.000 0.773 126 K HN 0.029 8.279 8.250 -0.000 0.000 0.479 127 F N 0.827 120.762 119.950 -0.026 0.000 2.641 127 F HA 0.367 4.325 4.527 -0.948 0.000 0.302 127 F C 1.327 177.119 175.800 -0.013 0.000 1.098 127 F CA -0.274 57.719 58.000 -0.011 0.000 1.318 127 F CB 0.650 39.647 39.000 -0.005 0.000 1.035 127 F HN 0.295 8.595 8.300 -0.000 0.000 0.551 128 G N 0.948 109.805 108.800 0.095 0.000 2.162 128 G HA2 -0.311 3.081 3.960 -0.947 0.000 0.260 128 G HA3 -0.311 3.081 3.960 -0.947 0.000 0.260 128 G C 0.190 175.120 174.900 0.050 0.000 0.976 128 G CA -0.069 45.067 45.100 0.061 0.000 0.655 128 G HN 0.333 8.623 8.290 -0.000 0.000 0.533 129 I N 1.658 122.255 120.570 0.045 0.000 2.307 129 I HA 0.287 3.889 4.170 -0.947 0.000 0.289 129 I C -0.239 175.854 176.117 -0.040 0.000 1.021 129 I CA -0.945 60.362 61.300 0.012 0.000 1.224 129 I CB 0.911 38.920 38.000 0.014 0.000 1.376 129 I HN -0.024 8.186 8.210 -0.000 0.000 0.470 130 N N 5.809 124.505 118.700 -0.007 0.000 2.509 130 N HA 0.503 4.675 4.740 -0.947 0.000 0.287 130 N C -0.745 174.703 175.510 -0.104 0.000 1.121 130 N CA -0.350 52.698 53.050 -0.003 0.000 0.977 130 N CB 2.515 41.061 38.487 0.098 0.000 1.167 130 N HN 0.179 8.559 8.380 -0.000 0.000 0.476 131 V N 0.765 120.561 119.914 -0.197 0.000 2.638 131 V HA 0.353 3.904 4.120 -0.947 0.000 0.306 131 V C -0.259 175.587 176.094 -0.413 0.000 1.052 131 V CA -0.739 61.282 62.300 -0.465 0.000 0.885 131 V CB 1.876 33.317 31.823 -0.638 0.000 0.999 131 V HN 0.570 8.760 8.190 -0.000 0.000 0.424 132 S N 4.372 119.820 115.700 -0.420 0.000 2.437 132 S HA 0.734 4.636 4.470 -0.947 0.000 0.305 132 S C -0.766 173.617 174.600 -0.362 0.000 1.109 132 S CA -0.312 57.772 58.200 -0.195 0.000 1.099 132 S CB 0.674 63.927 63.200 0.088 0.000 1.004 132 S HN 0.444 8.754 8.310 -0.000 0.000 0.475 133 F N 2.561 122.496 119.950 -0.026 0.000 2.404 133 F HA 0.631 4.590 4.527 -0.948 0.000 0.339 133 F C 0.542 176.350 175.800 0.013 0.000 1.105 133 F CA -0.648 57.342 58.000 -0.016 0.000 1.087 133 F CB 1.300 40.295 39.000 -0.009 0.000 1.143 133 F HN 0.370 8.670 8.300 -0.000 0.000 0.491 134 V N -1.153 118.874 119.914 0.188 0.000 3.181 134 V HA 0.561 4.113 4.120 -0.947 0.000 0.308 134 V C -1.276 174.879 176.094 0.101 0.000 1.214 134 V CA -1.019 61.349 62.300 0.113 0.000 1.053 134 V CB 1.988 33.848 31.823 0.061 0.000 1.069 134 V HN 0.578 8.768 8.190 -0.000 0.000 0.441 135 D N 1.481 121.920 120.400 0.065 0.000 2.393 135 D HA 0.541 4.613 4.640 -0.947 0.000 0.232 135 D C 0.949 177.269 176.300 0.033 0.000 1.192 135 D CA 0.411 54.439 54.000 0.047 0.000 0.882 135 D CB 1.367 42.186 40.800 0.032 0.000 1.038 135 D HN 0.951 9.321 8.370 -0.000 0.000 0.499 136 A N 3.583 126.421 122.820 0.031 0.000 2.209 136 A HA 0.117 3.869 4.320 -0.947 0.000 0.212 136 A C 1.945 179.531 177.584 0.003 0.000 1.158 136 A CA 1.022 53.066 52.037 0.012 0.000 0.742 136 A CB -0.140 18.862 19.000 0.003 0.000 0.790 136 A HN 0.591 8.741 8.150 -0.000 0.000 0.472 137 A N -0.309 122.518 122.820 0.010 0.000 2.168 137 A HA 0.043 3.795 4.320 -0.947 0.000 0.215 137 A C 0.986 178.576 177.584 0.011 0.000 1.152 137 A CA 0.629 52.673 52.037 0.012 0.000 0.716 137 A CB -0.125 18.887 19.000 0.020 0.000 0.794 137 A HN 0.412 8.562 8.150 -0.000 0.000 0.465 138 K N -0.058 120.348 120.400 0.010 0.000 2.478 138 K HA 0.291 4.043 4.320 -0.947 0.000 0.236 138 K C -2.441 174.161 176.600 0.004 0.000 1.021 138 K CA -1.837 54.455 56.287 0.008 0.000 1.010 138 K CB 1.517 34.024 32.500 0.012 0.000 1.331 138 K HN -0.037 8.213 8.250 -0.000 0.000 0.470 139 P HA -0.264 4.156 4.420 -0.000 0.000 0.219 139 P C 1.151 178.447 177.300 -0.007 0.000 1.146 139 P CA 1.128 64.222 63.100 -0.011 0.000 0.808 139 P CB 0.267 31.958 31.700 -0.016 0.000 0.779 140 E N 0.724 120.923 120.200 -0.001 0.000 2.204 140 E HA -0.214 3.568 4.350 -0.947 0.000 0.194 140 E C 1.465 178.068 176.600 0.005 0.000 0.989 140 E CA 1.305 57.705 56.400 0.001 0.000 0.824 140 E CB -0.877 28.825 29.700 0.003 0.000 0.756 140 E HN 0.363 8.723 8.360 -0.000 0.000 0.477 141 E N 0.712 120.917 120.200 0.008 0.000 2.152 141 E HA -0.045 3.736 4.350 -0.947 0.000 0.192 141 E C 2.359 178.968 176.600 0.015 0.000 0.983 141 E CA 0.793 57.202 56.400 0.015 0.000 0.818 141 E CB -0.111 29.602 29.700 0.022 0.000 0.758 141 E HN 0.341 8.701 8.360 -0.000 0.000 0.467 142 I N 0.961 121.535 120.570 0.007 0.000 2.142 142 I HA -0.288 3.314 4.170 -0.947 0.000 0.240 142 I C 2.677 178.796 176.117 0.004 0.000 1.078 142 I CA 1.041 62.342 61.300 0.001 0.000 1.343 142 I CB -0.214 37.778 38.000 -0.014 0.000 1.046 142 I HN 0.011 8.221 8.210 -0.000 0.000 0.405 143 R N 1.835 122.334 120.500 -0.001 0.000 2.083 143 R HA -0.166 3.606 4.340 -0.947 0.000 0.237 143 R C 2.144 178.448 176.300 0.006 0.000 1.137 143 R CA 2.084 58.184 56.100 0.000 0.000 0.951 143 R CB -0.811 29.488 30.300 -0.003 0.000 0.851 143 R HN 0.364 8.634 8.270 -0.000 0.000 0.434 144 A N -0.259 122.566 122.820 0.008 0.000 2.015 144 A HA 0.074 3.826 4.320 -0.947 0.000 0.219 144 A C 2.157 179.748 177.584 0.011 0.000 1.163 144 A CA 1.498 53.540 52.037 0.007 0.000 0.646 144 A CB -0.662 18.343 19.000 0.008 0.000 0.806 144 A HN 0.497 8.647 8.150 -0.000 0.000 0.448 145 A N -1.197 121.638 122.820 0.025 0.000 2.218 145 A HA 0.362 4.114 4.320 -0.947 0.000 0.209 145 A C 0.935 178.562 177.584 0.073 0.000 1.168 145 A CA -0.061 52.005 52.037 0.047 0.000 0.804 145 A CB -0.257 18.781 19.000 0.064 0.000 0.834 145 A HN 0.390 8.540 8.150 -0.000 0.000 0.482 146 M N 0.985 120.614 119.600 0.048 0.000 2.239 146 M HA 0.269 4.181 4.480 -0.947 0.000 0.348 146 M C 0.225 176.524 176.300 -0.002 0.000 1.239 146 M CA 0.805 56.138 55.300 0.055 0.000 1.114 146 M CB -0.146 32.473 32.600 0.031 0.000 1.641 146 M HN 0.258 8.548 8.290 -0.000 0.000 0.453 147 R N 2.791 123.281 120.500 -0.018 0.000 2.919 147 R HA 0.429 4.201 4.340 -0.947 0.000 0.260 147 R C -1.724 174.557 176.300 -0.033 0.000 1.067 147 R CA -1.683 54.361 56.100 -0.094 0.000 1.003 147 R CB 0.454 30.583 30.300 -0.285 0.000 1.192 147 R HN 0.271 8.541 8.270 -0.000 0.000 0.488 148 P HA -0.153 4.267 4.420 -0.000 0.000 0.219 148 P C -0.064 177.238 177.300 0.003 0.000 1.146 148 P CA 1.300 64.392 63.100 -0.013 0.000 0.808 148 P CB 0.303 31.991 31.700 -0.020 0.000 0.779 149 E N -1.999 118.199 120.200 -0.003 0.000 2.489 149 E HA 0.029 3.811 4.350 -0.947 0.000 0.193 149 E C 0.188 176.845 176.600 0.095 0.000 1.057 149 E CA 0.274 56.694 56.400 0.034 0.000 0.866 149 E CB -0.855 28.859 29.700 0.022 0.000 0.916 149 E HN 0.121 8.481 8.360 -0.000 0.000 0.500 150 T N 1.996 116.624 114.554 0.124 0.000 2.784 150 T HA 0.071 3.853 4.350 -0.947 0.000 0.291 150 T C 0.927 175.669 174.700 0.071 0.000 0.942 150 T CA -0.065 62.135 62.100 0.167 0.000 1.161 150 T CB 0.727 69.719 68.868 0.206 0.000 0.885 150 T HN -0.038 8.202 8.240 -0.000 0.000 0.534 151 K N 1.960 122.384 120.400 0.040 0.000 2.335 151 K HA 0.254 4.006 4.320 -0.947 0.000 0.195 151 K C 0.305 176.909 176.600 0.007 0.000 1.058 151 K CA 0.393 56.694 56.287 0.024 0.000 0.988 151 K CB 0.739 33.253 32.500 0.025 0.000 0.880 151 K HN 0.378 8.628 8.250 -0.000 0.000 0.513 152 V N 1.433 121.338 119.914 -0.015 0.000 2.808 152 V HA 0.301 3.853 4.120 -0.947 0.000 0.308 152 V C -0.789 175.284 176.094 -0.035 0.000 1.099 152 V CA -1.015 61.274 62.300 -0.018 0.000 0.920 152 V CB 2.659 34.478 31.823 -0.007 0.000 1.014 152 V HN -0.264 7.926 8.190 -0.000 0.000 0.425 153 V N 4.062 123.964 119.914 -0.020 0.000 2.459 153 V HA 0.487 4.038 4.120 -0.947 0.000 0.295 153 V C -1.165 174.948 176.094 0.030 0.000 1.029 153 V CA -0.685 61.602 62.300 -0.022 0.000 0.874 153 V CB 1.641 33.433 31.823 -0.052 0.000 0.985 153 V HN 0.796 8.986 8.190 -0.000 0.000 0.438 154 Y N 6.600 126.847 120.300 -0.088 0.000 2.350 154 Y HA 0.800 4.781 4.550 -0.948 0.000 0.338 154 Y C -0.349 175.527 175.900 -0.041 0.000 0.961 154 Y CA -0.858 57.206 58.100 -0.060 0.000 1.100 154 Y CB 1.486 39.917 38.460 -0.047 0.000 1.179 154 Y HN 0.679 8.959 8.280 -0.000 0.000 0.454 155 I N 1.617 121.855 120.570 -0.552 0.000 2.994 155 I HA 0.677 4.279 4.170 -0.947 0.000 0.306 155 I C -1.591 174.243 176.117 -0.471 0.000 1.195 155 I CA -1.063 60.020 61.300 -0.361 0.000 1.001 155 I CB 2.800 40.682 38.000 -0.195 0.000 1.244 155 I HN 0.526 8.736 8.210 -0.000 0.000 0.437 156 E N 1.473 121.516 120.200 -0.261 0.000 2.238 156 E HA 0.621 4.403 4.350 -0.947 0.000 0.267 156 E C -1.296 175.204 176.600 -0.168 0.000 0.887 156 E CA -0.828 55.437 56.400 -0.226 0.000 0.769 156 E CB 2.553 32.145 29.700 -0.180 0.000 1.187 156 E HN 0.692 9.052 8.360 -0.000 0.000 0.416 157 T N 2.889 117.352 114.554 -0.152 0.000 3.295 157 T HA 0.340 4.121 4.350 -0.947 0.000 0.331 157 T C -2.868 171.803 174.700 -0.048 0.000 1.142 157 T CA -1.727 60.314 62.100 -0.098 0.000 1.078 157 T CB 1.325 70.148 68.868 -0.075 0.000 1.150 157 T HN 0.086 8.326 8.240 -0.000 0.000 0.465 158 P HA 0.497 4.917 4.420 -0.000 0.000 0.271 158 P C -1.322 175.875 177.300 -0.172 0.000 1.233 158 P CA -0.362 62.736 63.100 -0.003 0.000 0.789 158 P CB 0.476 32.261 31.700 0.143 0.000 0.951 159 A N 1.579 124.327 122.820 -0.120 0.000 2.355 159 A HA 0.493 4.245 4.320 -0.947 0.000 0.324 159 A C -0.153 177.362 177.584 -0.116 0.000 1.117 159 A CA -0.631 51.290 52.037 -0.194 0.000 0.785 159 A CB 0.450 19.394 19.000 -0.094 0.000 1.254 159 A HN 0.437 8.587 8.150 -0.000 0.000 0.453 160 N N 1.265 119.882 118.700 -0.138 0.000 2.415 160 N HA 0.292 4.463 4.740 -0.947 0.000 0.248 160 N C -1.962 173.528 175.510 -0.034 0.000 1.271 160 N CA -1.095 51.957 53.050 0.004 0.000 0.913 160 N CB 0.576 39.105 38.487 0.069 0.000 1.129 160 N HN 0.360 8.740 8.380 -0.000 0.000 0.444 161 P HA 0.134 4.554 4.420 -0.000 0.000 0.275 161 P C 0.538 177.795 177.300 -0.071 0.000 1.310 161 P CA 0.373 63.455 63.100 -0.030 0.000 0.904 161 P CB 0.564 32.209 31.700 -0.092 0.000 1.381 162 T N -0.259 114.206 114.554 -0.148 0.000 3.129 162 T HA 0.226 4.007 4.350 -0.947 0.000 0.267 162 T C 0.640 175.330 174.700 -0.016 0.000 1.018 162 T CA -0.236 61.669 62.100 -0.325 0.000 0.903 162 T CB -0.872 67.644 68.868 -0.588 0.000 1.067 162 T HN -0.120 8.120 8.240 -0.000 0.000 0.549 163 L N 2.193 123.481 121.223 0.107 0.000 3.678 163 L HA -0.178 3.594 4.340 -0.947 0.000 0.425 163 L C 0.649 177.681 176.870 0.269 0.000 1.240 163 L CA 0.101 55.076 54.840 0.226 0.000 0.876 163 L CB -2.798 39.467 42.059 0.343 0.000 1.766 163 L HN 0.518 8.748 8.230 -0.000 0.000 0.917 164 S N -0.530 115.251 115.700 0.134 0.000 2.600 164 S HA 0.705 4.607 4.470 -0.947 0.000 0.265 164 S C 0.106 174.779 174.600 0.122 0.000 1.325 164 S CA -0.845 57.440 58.200 0.141 0.000 1.002 164 S CB 1.965 65.190 63.200 0.041 0.000 0.921 164 S HN 0.325 8.635 8.310 -0.000 0.000 0.554 165 L N 0.594 121.893 121.223 0.127 0.000 2.313 165 L HA 0.755 4.527 4.340 -0.947 0.000 0.268 165 L C -0.894 175.986 176.870 0.016 0.000 1.010 165 L CA -1.268 53.602 54.840 0.052 0.000 0.814 165 L CB 1.779 43.860 42.059 0.037 0.000 1.304 165 L HN 0.467 8.697 8.230 -0.000 0.000 0.441 166 V N -0.228 119.675 119.914 -0.018 0.000 2.638 166 V HA 0.190 3.742 4.120 -0.947 0.000 0.306 166 V C -0.769 175.299 176.094 -0.043 0.000 1.052 166 V CA -0.622 61.659 62.300 -0.031 0.000 0.885 166 V CB 1.995 33.786 31.823 -0.052 0.000 0.999 166 V HN 0.648 8.838 8.190 -0.000 0.000 0.424 167 D N 3.807 124.184 120.400 -0.038 0.000 2.416 167 D HA 0.226 4.297 4.640 -0.947 0.000 0.240 167 D C 1.084 177.349 176.300 -0.057 0.000 1.250 167 D CA 0.178 54.152 54.000 -0.044 0.000 0.967 167 D CB 0.646 41.427 40.800 -0.033 0.000 1.059 167 D HN 0.485 8.855 8.370 -0.000 0.000 0.512 168 I N 2.320 122.851 120.570 -0.065 0.000 2.163 168 I HA -0.241 3.360 4.170 -0.947 0.000 0.243 168 I C 2.281 178.354 176.117 -0.073 0.000 1.085 168 I CA 0.941 62.196 61.300 -0.075 0.000 1.347 168 I CB -0.086 37.870 38.000 -0.073 0.000 1.044 168 I HN 0.464 8.674 8.210 -0.000 0.000 0.408 169 E N 0.485 120.651 120.200 -0.057 0.000 2.085 169 E HA -0.218 3.563 4.350 -0.947 0.000 0.194 169 E C 2.075 178.644 176.600 -0.053 0.000 0.994 169 E CA 1.914 58.286 56.400 -0.047 0.000 0.801 169 E CB 0.077 29.756 29.700 -0.035 0.000 0.743 169 E HN 0.413 8.773 8.360 -0.000 0.000 0.453 170 T N 0.111 114.634 114.554 -0.051 0.000 2.777 170 T HA -0.096 3.685 4.350 -0.947 0.000 0.266 170 T C 1.892 176.552 174.700 -0.067 0.000 1.040 170 T CA 1.183 63.254 62.100 -0.047 0.000 1.141 170 T CB -0.088 68.758 68.868 -0.036 0.000 0.868 170 T HN 0.024 8.264 8.240 -0.000 0.000 0.444 171 V N 1.777 121.643 119.914 -0.081 0.000 2.427 171 V HA -0.140 3.412 4.120 -0.947 0.000 0.248 171 V C 2.878 178.870 176.094 -0.171 0.000 1.051 171 V CA 1.551 63.789 62.300 -0.103 0.000 1.048 171 V CB -1.220 30.546 31.823 -0.095 0.000 0.666 171 V HN 0.509 8.699 8.190 -0.000 0.000 0.456 172 A N 0.751 123.449 122.820 -0.204 0.000 1.883 172 A HA -0.158 3.593 4.320 -0.947 0.000 0.217 172 A C 2.447 179.758 177.584 -0.455 0.000 1.186 172 A CA 2.164 53.965 52.037 -0.393 0.000 0.624 172 A CB -1.332 17.529 19.000 -0.232 0.000 0.822 172 A HN 0.527 8.677 8.150 -0.000 0.000 0.444 173 G N -0.129 108.569 108.800 -0.170 0.000 2.440 173 G HA2 -0.202 3.190 3.960 -0.947 0.000 0.218 173 G HA3 -0.202 3.190 3.960 -0.947 0.000 0.218 173 G C 1.542 176.405 174.900 -0.061 0.000 1.154 173 G CA 1.151 46.216 45.100 -0.058 0.000 0.767 173 G HN 0.493 8.783 8.290 -0.000 0.000 0.552 174 I N 1.329 121.848 120.570 -0.083 0.000 2.142 174 I HA -0.178 3.424 4.170 -0.947 0.000 0.240 174 I C 3.336 179.414 176.117 -0.064 0.000 1.078 174 I CA 1.013 62.279 61.300 -0.057 0.000 1.343 174 I CB -0.317 37.652 38.000 -0.052 0.000 1.046 174 I HN 0.249 8.459 8.210 -0.000 0.000 0.405 175 A N 0.356 123.096 122.820 -0.135 0.000 1.883 175 A HA -0.279 3.473 4.320 -0.947 0.000 0.217 175 A C 2.097 179.665 177.584 -0.026 0.000 1.186 175 A CA 1.991 53.958 52.037 -0.117 0.000 0.624 175 A CB -1.363 17.515 19.000 -0.203 0.000 0.822 175 A HN 0.516 8.666 8.150 -0.000 0.000 0.444 176 H N -1.593 117.468 119.070 -0.016 0.000 2.387 176 H HA -0.135 3.853 4.556 -0.948 0.000 0.299 176 H C 2.302 177.624 175.328 -0.009 0.000 1.090 176 H CA 1.345 57.384 56.048 -0.014 0.000 1.332 176 H CB 0.049 29.802 29.762 -0.016 0.000 1.386 176 H HN 0.670 8.950 8.280 -0.000 0.000 0.516 177 Q N 0.556 120.421 119.800 0.107 0.000 2.170 177 Q HA -0.143 3.628 4.340 -0.947 0.000 0.203 177 Q C 1.357 177.382 176.000 0.042 0.000 0.976 177 Q CA 1.099 56.938 55.803 0.058 0.000 0.858 177 Q CB 0.371 29.129 28.738 0.033 0.000 0.907 177 Q HN 0.379 8.649 8.270 -0.000 0.000 0.433 178 Q N -1.185 118.638 119.800 0.038 0.000 2.246 178 Q HA 0.192 3.964 4.340 -0.947 0.000 0.202 178 Q C 0.536 176.558 176.000 0.037 0.000 0.883 178 Q CA 0.648 56.468 55.803 0.029 0.000 0.952 178 Q CB 1.095 29.844 28.738 0.019 0.000 1.078 178 Q HN 0.544 8.814 8.270 -0.000 0.000 0.493 179 G N 0.626 109.457 108.800 0.053 0.000 2.143 179 G HA2 -0.252 3.140 3.960 -0.947 0.000 0.248 179 G HA3 -0.252 3.140 3.960 -0.947 0.000 0.248 179 G C 0.218 175.153 174.900 0.057 0.000 0.991 179 G CA 0.288 45.418 45.100 0.050 0.000 0.689 179 G HN 0.573 8.863 8.290 -0.000 0.000 0.522 180 A N -0.692 122.170 122.820 0.070 0.000 2.299 180 A HA 0.903 4.655 4.320 -0.947 0.000 0.332 180 A C 0.302 177.942 177.584 0.094 0.000 1.131 180 A CA -0.691 51.380 52.037 0.056 0.000 0.844 180 A CB 1.029 20.045 19.000 0.027 0.000 1.251 180 A HN 0.739 8.889 8.150 -0.000 0.000 0.486 181 L N 0.559 121.811 121.223 0.049 0.000 2.375 181 L HA 0.428 4.199 4.340 -0.947 0.000 0.271 181 L C -0.484 176.384 176.870 -0.003 0.000 1.107 181 L CA -0.663 54.204 54.840 0.045 0.000 0.806 181 L CB 1.217 43.255 42.059 -0.036 0.000 1.146 181 L HN 0.638 8.868 8.230 -0.000 0.000 0.447 182 L N 3.200 124.415 121.223 -0.013 0.000 2.287 182 L HA 0.511 4.283 4.340 -0.947 0.000 0.287 182 L C -0.663 176.165 176.870 -0.070 0.000 1.022 182 L CA -0.136 54.659 54.840 -0.075 0.000 0.814 182 L CB 1.548 43.518 42.059 -0.148 0.000 1.217 182 L HN 0.220 8.450 8.230 -0.000 0.000 0.420 183 V N 6.021 125.895 119.914 -0.066 0.000 2.417 183 V HA 0.562 4.114 4.120 -0.947 0.000 0.291 183 V C -0.405 175.565 176.094 -0.206 0.000 1.024 183 V CA -0.627 61.632 62.300 -0.069 0.000 0.861 183 V CB 1.797 33.671 31.823 0.086 0.000 0.985 183 V HN 0.531 8.721 8.190 -0.000 0.000 0.436 184 V N 3.463 123.253 119.914 -0.206 0.000 2.487 184 V HA 0.386 3.938 4.120 -0.947 0.000 0.298 184 V C -0.379 175.547 176.094 -0.281 0.000 1.028 184 V CA -0.662 61.467 62.300 -0.285 0.000 0.860 184 V CB 2.023 33.732 31.823 -0.190 0.000 0.991 184 V HN 0.875 9.065 8.190 -0.000 0.000 0.427 185 D N 3.692 123.878 120.400 -0.357 0.000 2.336 185 D HA 0.107 4.178 4.640 -0.947 0.000 0.249 185 D C 0.428 176.600 176.300 -0.214 0.000 1.213 185 D CA 0.121 53.977 54.000 -0.240 0.000 0.870 185 D CB 0.843 41.545 40.800 -0.163 0.000 1.076 185 D HN 0.534 8.904 8.370 -0.000 0.000 0.483 186 N N 2.163 120.677 118.700 -0.309 0.000 2.251 186 N HA 0.029 4.200 4.740 -0.947 0.000 0.217 186 N C 1.017 176.556 175.510 0.048 0.000 1.124 186 N CA -0.018 52.913 53.050 -0.198 0.000 0.843 186 N CB 0.379 38.710 38.487 -0.259 0.000 1.024 186 N HN 0.235 8.615 8.380 -0.000 0.000 0.501 187 T N -0.128 114.493 114.554 0.111 0.000 2.665 187 T HA -0.135 3.647 4.350 -0.947 0.000 0.268 187 T C 1.172 176.170 174.700 0.497 0.000 1.035 187 T CA 1.199 63.523 62.100 0.373 0.000 1.151 187 T CB -0.333 68.695 68.868 0.267 0.000 0.862 187 T HN 0.205 8.445 8.240 -0.000 0.000 0.438 188 F N 0.693 120.744 119.950 0.169 0.000 2.216 188 F HA 0.009 3.968 4.527 -0.947 0.000 0.300 188 F C 2.218 178.117 175.800 0.164 0.000 1.085 188 F CA 0.724 58.853 58.000 0.215 0.000 1.326 188 F CB -0.419 38.663 39.000 0.136 0.000 1.027 188 F HN 0.133 8.433 8.300 -0.000 0.000 0.497 189 M N -0.916 118.847 119.600 0.273 0.000 2.552 189 M HA 0.134 4.046 4.480 -0.947 0.000 0.264 189 M C 0.799 177.142 176.300 0.073 0.000 1.159 189 M CA 1.039 56.398 55.300 0.097 0.000 1.176 189 M CB -1.243 31.406 32.600 0.080 0.000 1.327 189 M HN 0.156 8.446 8.290 -0.000 0.000 0.481 190 S N -0.082 115.751 115.700 0.222 0.000 3.663 190 S HA -0.071 3.830 4.470 -0.947 0.000 0.779 190 S C -2.363 172.369 174.600 0.219 0.000 1.254 190 S CA -0.047 58.280 58.200 0.213 0.000 1.164 190 S CB -1.719 61.551 63.200 0.117 0.000 0.532 190 S HN 0.134 8.444 8.310 -0.000 0.000 0.505 191 P HA -0.001 4.419 4.420 -0.000 0.000 0.225 191 P C 1.252 178.673 177.300 0.202 0.000 1.148 191 P CA 1.492 64.747 63.100 0.258 0.000 0.779 191 P CB -0.218 31.688 31.700 0.343 0.000 0.780 192 Y N -0.539 119.837 120.300 0.126 0.000 2.352 192 Y HA -0.172 3.810 4.550 -0.946 0.000 0.292 192 Y C 1.792 177.599 175.900 -0.154 0.000 1.136 192 Y CA 1.378 59.475 58.100 -0.004 0.000 1.227 192 Y CB -0.422 38.108 38.460 0.116 0.000 0.991 192 Y HN -0.026 8.254 8.280 -0.000 0.000 0.545 193 C N -0.777 118.495 119.300 -0.047 0.000 3.097 193 C HA 0.278 4.170 4.460 -0.947 0.000 0.335 193 C C 0.231 175.150 174.990 -0.119 0.000 1.283 193 C CA -0.147 58.802 59.018 -0.115 0.000 1.778 193 C CB -0.261 27.460 27.740 -0.031 0.000 2.365 193 C HN 0.430 8.660 8.230 -0.000 0.000 0.627 194 Q N 0.558 120.318 119.800 -0.066 0.000 2.320 194 Q HA 0.325 4.097 4.340 -0.947 0.000 0.272 194 Q C -1.902 174.086 176.000 -0.019 0.000 1.023 194 Q CA -0.044 55.726 55.803 -0.055 0.000 0.855 194 Q CB 1.218 29.941 28.738 -0.025 0.000 1.367 194 Q HN 0.425 8.695 8.270 -0.000 0.000 0.406 195 Q N 4.064 123.843 119.800 -0.037 0.000 2.932 195 Q HA 0.252 4.023 4.340 -0.947 0.000 0.248 195 Q C -2.128 173.868 176.000 -0.006 0.000 0.982 195 Q CA -1.719 54.084 55.803 -0.001 0.000 0.730 195 Q CB 1.706 30.434 28.738 -0.015 0.000 1.249 195 Q HN 0.464 8.734 8.270 -0.000 0.000 0.476 196 P HA -0.195 4.225 4.420 -0.000 0.000 0.216 196 P C 0.949 178.243 177.300 -0.009 0.000 1.150 196 P CA 1.161 64.245 63.100 -0.026 0.000 0.837 196 P CB 0.325 31.996 31.700 -0.048 0.000 0.786 197 L N -0.949 120.281 121.223 0.012 0.000 2.131 197 L HA -0.186 3.586 4.340 -0.947 0.000 0.210 197 L C 2.404 179.287 176.870 0.021 0.000 1.092 197 L CA 1.254 56.108 54.840 0.024 0.000 0.759 197 L CB -0.946 41.138 42.059 0.041 0.000 0.903 197 L HN 0.028 8.258 8.230 -0.000 0.000 0.435 198 Q N 0.003 119.811 119.800 0.013 0.000 2.364 198 Q HA -0.034 3.737 4.340 -0.947 0.000 0.207 198 Q C 1.929 177.928 176.000 -0.003 0.000 0.970 198 Q CA 1.025 56.831 55.803 0.005 0.000 0.888 198 Q CB 0.133 28.867 28.738 -0.007 0.000 0.951 198 Q HN 0.559 8.829 8.270 -0.000 0.000 0.469 199 L N -1.367 119.852 121.223 -0.007 0.000 2.667 199 L HA 0.245 4.017 4.340 -0.947 0.000 0.232 199 L C 1.031 177.903 176.870 0.002 0.000 1.138 199 L CA 0.422 55.254 54.840 -0.013 0.000 0.921 199 L CB 0.421 42.461 42.059 -0.032 0.000 1.180 199 L HN 0.280 8.510 8.230 -0.000 0.000 0.487 200 G N -0.260 108.557 108.800 0.029 0.000 2.211 200 G HA2 -0.199 3.192 3.960 -0.947 0.000 0.201 200 G HA3 -0.199 3.192 3.960 -0.947 0.000 0.201 200 G C 0.459 175.432 174.900 0.121 0.000 0.997 200 G CA -0.184 44.971 45.100 0.091 0.000 0.652 200 G HN 0.395 8.685 8.290 -0.000 0.000 0.500 201 A N 0.376 123.216 122.820 0.033 0.000 2.466 201 A HA 0.516 4.267 4.320 -0.947 0.000 0.238 201 A C 1.125 178.738 177.584 0.047 0.000 1.074 201 A CA 1.074 53.118 52.037 0.012 0.000 0.774 201 A CB 0.256 19.234 19.000 -0.037 0.000 1.015 201 A HN 0.240 8.390 8.150 -0.000 0.000 0.498 202 D N -0.032 120.388 120.400 0.034 0.000 2.323 202 D HA 0.185 4.257 4.640 -0.947 0.000 0.218 202 D C 0.045 176.309 176.300 -0.061 0.000 0.973 202 D CA 1.202 55.201 54.000 -0.003 0.000 0.890 202 D CB 0.280 41.070 40.800 -0.016 0.000 1.011 202 D HN 0.508 8.878 8.370 -0.000 0.000 0.499 203 I N 0.985 121.505 120.570 -0.084 0.000 2.656 203 I HA 0.213 3.814 4.170 -0.947 0.000 0.292 203 I C -0.939 175.154 176.117 -0.040 0.000 1.144 203 I CA -0.796 60.454 61.300 -0.083 0.000 1.038 203 I CB 3.305 41.169 38.000 -0.226 0.000 1.244 203 I HN -0.377 7.833 8.210 -0.000 0.000 0.420 204 V N 5.828 125.744 119.914 0.004 0.000 2.555 204 V HA 0.590 4.141 4.120 -0.947 0.000 0.302 204 V C -0.348 175.736 176.094 -0.017 0.000 1.038 204 V CA -0.677 61.599 62.300 -0.039 0.000 0.887 204 V CB 2.248 34.060 31.823 -0.017 0.000 0.991 204 V HN 0.510 8.700 8.190 -0.000 0.000 0.434 205 V N 1.686 121.541 119.914 -0.098 0.000 2.769 205 V HA 0.725 4.276 4.120 -0.947 0.000 0.312 205 V C -0.798 175.169 176.094 -0.212 0.000 1.061 205 V CA -0.492 61.785 62.300 -0.037 0.000 0.931 205 V CB 2.098 33.958 31.823 0.061 0.000 1.010 205 V HN 0.879 9.069 8.190 -0.000 0.000 0.433 206 H N 1.467 120.577 119.070 0.065 0.000 2.768 206 H HA 0.502 4.490 4.556 -0.946 0.000 0.371 206 H C -0.635 174.716 175.328 0.037 0.000 1.151 206 H CA -0.440 55.643 56.048 0.060 0.000 1.165 206 H CB 2.302 32.105 29.762 0.068 0.000 1.722 206 H HN 0.831 9.111 8.280 -0.000 0.000 0.543 207 S N 1.752 117.540 115.700 0.147 0.000 2.400 207 S HA 0.085 3.987 4.470 -0.947 0.000 0.295 207 S C 1.433 176.090 174.600 0.094 0.000 1.113 207 S CA -0.642 57.601 58.200 0.072 0.000 1.064 207 S CB -0.214 62.974 63.200 -0.020 0.000 0.990 207 S HN 0.504 8.814 8.310 -0.000 0.000 0.502 208 V N 3.418 123.374 119.914 0.069 0.000 3.305 208 V HA 0.083 3.635 4.120 -0.947 0.000 0.269 208 V C 1.172 177.271 176.094 0.008 0.000 1.157 208 V CA 0.691 63.010 62.300 0.031 0.000 1.157 208 V CB -1.850 29.976 31.823 0.006 0.000 0.772 208 V HN 0.765 8.955 8.190 -0.000 0.000 0.498 212 I N 0.912 121.547 120.570 0.108 0.000 2.142 212 I HA -0.308 3.293 4.170 -0.947 0.000 0.240 212 I C 2.176 178.308 176.117 0.024 0.000 1.078 212 I CA 2.421 63.736 61.300 0.024 0.000 1.343 212 I CB -0.176 37.782 38.000 -0.071 0.000 1.046 212 I HN 0.295 8.505 8.210 -0.000 0.000 0.405 213 N N 0.447 119.159 118.700 0.021 0.000 2.109 213 N HA -0.105 4.067 4.740 -0.947 0.000 0.188 213 N C 1.493 177.096 175.510 0.156 0.000 1.034 213 N CA 1.968 55.042 53.050 0.039 0.000 0.846 213 N CB -0.073 38.419 38.487 0.009 0.000 1.010 213 N HN 0.369 8.749 8.380 -0.000 0.000 0.425 214 G N -1.527 107.319 108.800 0.077 0.000 2.212 214 G HA2 -0.306 3.086 3.960 -0.947 0.000 0.266 214 G HA3 -0.306 3.086 3.960 -0.947 0.000 0.266 214 G C 0.417 175.236 174.900 -0.134 0.000 0.978 214 G CA 1.010 46.115 45.100 0.009 0.000 0.632 214 G HN 0.615 8.905 8.290 -0.000 0.000 0.537 215 H N -0.446 118.605 119.070 -0.033 0.000 2.672 215 H HA 0.456 4.448 4.556 -0.940 0.000 0.277 215 H C 1.829 177.141 175.328 -0.026 0.000 1.074 215 H CA 0.526 56.557 56.048 -0.027 0.000 1.173 215 H CB 0.569 30.307 29.762 -0.040 0.000 1.558 215 H HN 1.197 9.477 8.280 -0.000 0.000 0.539 216 G N 1.968 110.792 108.800 0.039 0.000 2.249 216 G HA2 -0.312 3.080 3.960 -0.947 0.000 0.273 216 G HA3 -0.312 3.080 3.960 -0.947 0.000 0.273 216 G C 0.205 175.126 174.900 0.034 0.000 1.036 216 G CA 0.889 45.996 45.100 0.013 0.000 0.824 216 G HN 0.626 8.916 8.290 -0.000 0.000 0.504 217 D N -2.101 118.325 120.400 0.043 0.000 2.562 217 D HA 0.343 4.415 4.640 -0.947 0.000 0.246 217 D C 0.192 176.511 176.300 0.032 0.000 1.347 217 D CA -0.022 54.004 54.000 0.045 0.000 0.800 217 D CB 0.435 41.269 40.800 0.056 0.000 1.111 217 D HN 0.439 8.809 8.370 -0.000 0.000 0.508 218 V N 1.498 121.422 119.914 0.017 0.000 2.623 218 V HA 0.371 3.922 4.120 -0.947 0.000 0.304 218 V C -0.768 175.334 176.094 0.014 0.000 1.054 218 V CA -0.817 61.488 62.300 0.008 0.000 0.882 218 V CB 2.311 34.120 31.823 -0.024 0.000 1.002 218 V HN 0.073 8.263 8.190 -0.000 0.000 0.424 219 I N 4.025 124.610 120.570 0.025 0.000 2.331 219 I HA 0.817 4.419 4.170 -0.947 0.000 0.292 219 I C 0.682 176.813 176.117 0.023 0.000 0.998 219 I CA 0.323 61.638 61.300 0.025 0.000 1.267 219 I CB 0.980 39.001 38.000 0.035 0.000 1.386 219 I HN 0.814 9.024 8.210 -0.000 0.000 0.476 220 G N 3.520 112.332 108.800 0.019 0.000 2.547 220 G HA2 0.652 4.044 3.960 -0.947 0.000 0.291 220 G HA3 0.652 4.044 3.960 -0.947 0.000 0.291 220 G C -1.227 173.690 174.900 0.028 0.000 1.471 220 G CA -0.441 44.672 45.100 0.022 0.000 0.798 220 G HN 0.833 9.123 8.290 -0.000 0.000 0.504 221 G N -1.373 107.448 108.800 0.036 0.000 2.733 221 G HA2 0.804 4.195 3.960 -0.947 0.000 0.288 221 G HA3 0.804 4.195 3.960 -0.947 0.000 0.288 221 G C -1.841 173.100 174.900 0.068 0.000 1.373 221 G CA -0.676 44.458 45.100 0.058 0.000 0.895 221 G HN 1.207 9.497 8.290 -0.000 0.000 0.479 222 I N -0.811 119.824 120.570 0.109 0.000 2.827 222 I HA 0.662 4.264 4.170 -0.947 0.000 0.298 222 I C -1.379 174.824 176.117 0.144 0.000 1.235 222 I CA -0.958 60.409 61.300 0.112 0.000 1.021 222 I CB 2.233 40.302 38.000 0.114 0.000 1.259 222 I HN 0.435 8.645 8.210 -0.000 0.000 0.427 223 I N 6.652 127.297 120.570 0.124 0.000 2.509 223 I HA 0.624 4.226 4.170 -0.947 0.000 0.293 223 I C -1.125 175.088 176.117 0.159 0.000 1.020 223 I CA -0.958 60.434 61.300 0.154 0.000 1.088 223 I CB 1.915 40.015 38.000 0.167 0.000 1.267 223 I HN 0.148 8.358 8.210 -0.000 0.000 0.430 224 V N 4.150 124.169 119.914 0.175 0.000 2.656 224 V HA 0.981 4.533 4.120 -0.947 0.000 0.307 224 V C 0.225 176.422 176.094 0.171 0.000 1.051 224 V CA -0.265 62.131 62.300 0.160 0.000 0.893 224 V CB 1.615 33.527 31.823 0.148 0.000 0.999 224 V HN 1.049 9.239 8.190 -0.000 0.000 0.426 225 G N 2.972 111.881 108.800 0.182 0.000 2.427 225 G HA2 0.351 3.743 3.960 -0.947 0.000 0.306 225 G HA3 0.351 3.743 3.960 -0.947 0.000 0.306 225 G C -1.552 173.454 174.900 0.177 0.000 1.280 225 G CA -0.901 44.311 45.100 0.186 0.000 0.837 225 G HN 0.405 8.695 8.290 -0.000 0.000 0.482 226 K N 0.203 120.709 120.400 0.177 0.000 2.414 226 K HA 0.105 3.857 4.320 -0.947 0.000 0.272 226 K C 1.283 177.977 176.600 0.157 0.000 0.993 226 K CA -0.260 56.112 56.287 0.142 0.000 0.964 226 K CB 1.583 34.155 32.500 0.121 0.000 0.925 226 K HN 0.598 8.848 8.250 -0.000 0.000 0.487 227 Q N 2.406 122.266 119.800 0.099 0.000 2.096 227 Q HA -0.198 3.574 4.340 -0.947 0.000 0.204 227 Q C 1.277 177.324 176.000 0.077 0.000 0.982 227 Q CA 1.906 57.754 55.803 0.074 0.000 0.850 227 Q CB 0.132 28.902 28.738 0.053 0.000 0.901 227 Q HN 0.597 8.867 8.270 -0.000 0.000 0.422 228 E N -1.112 119.145 120.200 0.094 0.000 2.110 228 E HA -0.173 3.608 4.350 -0.947 0.000 0.193 228 E C 1.691 178.364 176.600 0.122 0.000 0.988 228 E CA 1.071 57.527 56.400 0.093 0.000 0.804 228 E CB -0.248 29.504 29.700 0.087 0.000 0.745 228 E HN 0.433 8.793 8.360 -0.000 0.000 0.458 229 F N 1.578 121.549 119.950 0.035 0.000 2.128 229 F HA -0.144 3.815 4.527 -0.947 0.000 0.295 229 F C 2.009 177.831 175.800 0.036 0.000 1.100 229 F CA 0.913 58.934 58.000 0.036 0.000 1.260 229 F CB -0.119 38.901 39.000 0.033 0.000 1.009 229 F HN -0.115 8.185 8.300 -0.000 0.000 0.476 230 I N 0.978 121.414 120.570 -0.223 0.000 2.264 230 I HA -0.282 3.319 4.170 -0.947 0.000 0.248 230 I C 1.913 177.858 176.117 -0.287 0.000 1.111 230 I CA 1.494 62.590 61.300 -0.341 0.000 1.382 230 I CB -1.414 36.545 38.000 -0.068 0.000 1.060 230 I HN 0.184 8.394 8.210 -0.000 0.000 0.418 231 D N 0.430 120.761 120.400 -0.115 0.000 2.144 231 D HA -0.172 3.900 4.640 -0.947 0.000 0.199 231 D C 2.280 178.594 176.300 0.023 0.000 0.984 231 D CA 0.960 54.974 54.000 0.024 0.000 0.834 231 D CB -0.101 40.781 40.800 0.137 0.000 0.955 231 D HN 0.351 8.721 8.370 -0.000 0.000 0.465 232 Q N 0.224 119.971 119.800 -0.088 0.000 2.083 232 Q HA 0.032 3.803 4.340 -0.947 0.000 0.198 232 Q C 2.241 178.130 176.000 -0.184 0.000 0.969 232 Q CA 1.019 56.777 55.803 -0.076 0.000 0.838 232 Q CB -0.472 28.237 28.738 -0.049 0.000 0.900 232 Q HN 0.252 8.522 8.270 -0.000 0.000 0.436 233 A N 1.333 123.891 122.820 -0.436 0.000 1.972 233 A HA -0.208 3.544 4.320 -0.947 0.000 0.219 233 A C 2.179 179.608 177.584 -0.257 0.000 1.169 233 A CA 1.645 53.443 52.037 -0.399 0.000 0.635 233 A CB -0.411 18.207 19.000 -0.636 0.000 0.810 233 A HN 0.256 8.406 8.150 -0.000 0.000 0.446 234 R N -1.833 118.484 120.500 -0.304 0.000 2.057 234 R HA 0.019 3.791 4.340 -0.947 0.000 0.224 234 R C 1.373 177.450 176.300 -0.373 0.000 1.136 234 R CA 1.359 57.218 56.100 -0.402 0.000 0.968 234 R CB -0.270 29.639 30.300 -0.651 0.000 0.863 234 R HN 0.423 8.693 8.270 -0.000 0.000 0.433 235 F N -0.121 119.787 119.950 -0.071 0.000 2.780 235 F HA 0.078 4.038 4.527 -0.946 0.000 0.299 235 F C 1.607 177.387 175.800 -0.033 0.000 1.146 235 F CA 0.149 58.123 58.000 -0.045 0.000 1.428 235 F CB 0.583 39.555 39.000 -0.047 0.000 1.115 235 F HN -0.110 8.190 8.300 -0.000 0.000 0.583 236 V N -1.720 118.242 119.914 0.079 0.000 3.054 236 V HA 0.222 3.774 4.120 -0.947 0.000 0.227 236 V C 2.436 178.533 176.094 0.005 0.000 1.252 236 V CA 1.000 63.327 62.300 0.045 0.000 1.279 236 V CB -0.900 30.945 31.823 0.037 0.000 1.118 236 V HN 0.192 8.382 8.190 -0.000 0.000 0.504 237 G N 0.110 108.892 108.800 -0.029 0.000 2.459 237 G HA2 -0.234 3.157 3.960 -0.947 0.000 0.217 237 G HA3 -0.234 3.157 3.960 -0.947 0.000 0.217 237 G C 1.579 176.459 174.900 -0.033 0.000 1.183 237 G CA 1.417 46.497 45.100 -0.033 0.000 0.776 237 G HN 0.342 8.632 8.290 -0.000 0.000 0.552 238 L N -0.125 121.064 121.223 -0.057 0.000 2.068 238 L HA 0.146 3.917 4.340 -0.947 0.000 0.204 238 L C 2.878 179.740 176.870 -0.014 0.000 1.076 238 L CA 1.523 56.336 54.840 -0.045 0.000 0.753 238 L CB -0.252 41.758 42.059 -0.080 0.000 0.910 238 L HN 0.257 8.487 8.230 -0.000 0.000 0.439 239 K N -0.583 119.812 120.400 -0.009 0.000 2.057 239 K HA -0.201 3.551 4.320 -0.947 0.000 0.207 239 K C 1.205 177.836 176.600 0.050 0.000 1.049 239 K CA 2.049 58.360 56.287 0.041 0.000 0.931 239 K CB 0.126 32.675 32.500 0.082 0.000 0.714 239 K HN 0.340 8.590 8.250 -0.000 0.000 0.440 240 D N -0.636 119.785 120.400 0.036 0.000 2.463 240 D HA 0.102 4.174 4.640 -0.947 0.000 0.237 240 D C 1.875 178.184 176.300 0.015 0.000 1.013 240 D CA 0.560 54.579 54.000 0.032 0.000 0.910 240 D CB 0.305 41.124 40.800 0.031 0.000 1.080 240 D HN 0.205 8.575 8.370 -0.000 0.000 0.498 241 I N 0.623 121.195 120.570 0.003 0.000 2.522 241 I HA -0.090 3.512 4.170 -0.947 0.000 0.240 241 I C 2.353 178.467 176.117 -0.006 0.000 1.078 241 I CA 1.321 62.613 61.300 -0.013 0.000 1.422 241 I CB -0.282 37.702 38.000 -0.027 0.000 1.188 241 I HN -0.014 8.196 8.210 -0.000 0.000 0.442 242 T N -1.816 112.735 114.554 -0.004 0.000 3.031 242 T HA 0.172 3.953 4.350 -0.947 0.000 0.254 242 T C 1.702 176.410 174.700 0.013 0.000 1.060 242 T CA 0.647 62.747 62.100 0.001 0.000 1.135 242 T CB 0.104 68.964 68.868 -0.013 0.000 0.896 242 T HN 0.536 8.776 8.240 -0.000 0.000 0.472 243 G N 1.323 110.132 108.800 0.016 0.000 2.187 243 G HA2 -0.156 3.236 3.960 -0.947 0.000 0.261 243 G HA3 -0.156 3.236 3.960 -0.947 0.000 0.261 243 G C 0.599 175.513 174.900 0.023 0.000 1.000 243 G CA 0.048 45.165 45.100 0.029 0.000 0.718 243 G HN 1.114 9.404 8.290 -0.000 0.000 0.519 244 G N 0.122 108.927 108.800 0.010 0.000 3.401 244 G HA2 0.439 3.831 3.960 -0.947 0.000 0.251 244 G HA3 0.439 3.831 3.960 -0.947 0.000 0.251 244 G C 0.956 175.860 174.900 0.006 0.000 0.960 244 G CA 0.401 45.506 45.100 0.009 0.000 1.900 244 G HN 1.397 9.687 8.290 -0.000 0.000 0.645 245 C N -0.133 119.174 119.300 0.011 0.000 2.595 245 C HA 0.743 4.635 4.460 -0.947 0.000 0.384 245 C C 0.703 175.702 174.990 0.014 0.000 1.289 245 C CA -1.464 57.557 59.018 0.006 0.000 2.372 245 C CB 0.552 28.295 27.740 0.005 0.000 2.593 245 C HN 0.514 8.744 8.230 -0.000 0.000 0.639 246 M N 2.860 122.469 119.600 0.015 0.000 2.233 246 M HA 0.316 4.228 4.480 -0.947 0.000 0.355 246 M C 0.512 176.834 176.300 0.037 0.000 1.191 246 M CA 0.280 55.597 55.300 0.027 0.000 1.101 246 M CB 1.160 33.775 32.600 0.026 0.000 1.592 246 M HN 1.017 9.307 8.290 -0.000 0.000 0.461 247 S N 4.879 120.612 115.700 0.055 0.000 2.562 247 S HA 0.232 4.134 4.470 -0.947 0.000 0.281 247 S C -1.937 172.724 174.600 0.101 0.000 1.333 247 S CA -1.156 57.090 58.200 0.076 0.000 1.052 247 S CB 0.712 63.978 63.200 0.111 0.000 0.884 247 S HN 0.620 8.930 8.310 -0.000 0.000 0.506 248 P HA -0.083 4.337 4.420 -0.000 0.000 0.216 248 P C 1.111 178.529 177.300 0.197 0.000 1.150 248 P CA 0.856 64.035 63.100 0.133 0.000 0.837 248 P CB -0.036 31.734 31.700 0.116 0.000 0.786 249 F N 0.854 120.833 119.950 0.049 0.000 2.134 249 F HA -0.180 4.290 4.527 -0.095 0.000 0.299 249 F C 1.743 177.636 175.800 0.154 0.000 1.097 249 F CA 1.591 59.638 58.000 0.078 0.000 1.264 249 F CB -1.003 38.004 39.000 0.012 0.000 1.001 249 F HN -0.175 8.125 8.300 -0.000 0.000 0.479 250 N N 0.517 119.249 118.700 0.054 0.000 2.166 250 N HA -0.131 4.040 4.740 -0.947 0.000 0.186 250 N C 1.953 177.434 175.510 -0.047 0.000 1.019 250 N CA 1.520 54.539 53.050 -0.051 0.000 0.856 250 N CB -0.707 37.799 38.487 0.033 0.000 0.993 250 N HN 0.402 8.782 8.380 -0.000 0.000 0.426 251 A N -0.705 122.132 122.820 0.028 0.000 1.930 251 A HA -0.135 3.616 4.320 -0.947 0.000 0.217 251 A C 2.130 179.731 177.584 0.029 0.000 1.175 251 A CA 1.129 53.184 52.037 0.031 0.000 0.627 251 A CB -1.102 17.939 19.000 0.068 0.000 0.815 251 A HN 0.558 8.708 8.150 -0.000 0.000 0.443 252 W N 0.592 121.815 121.300 -0.129 0.000 2.381 252 W HA -0.115 4.009 4.660 -0.894 0.000 0.301 252 W C 1.763 178.147 176.519 -0.226 0.000 1.205 252 W CA 1.775 59.032 57.345 -0.146 0.000 1.285 252 W CB -0.241 29.148 29.460 -0.119 0.000 1.133 252 W HN 0.243 8.423 8.180 -0.000 0.000 0.521 253 L N -0.307 120.789 121.223 -0.212 0.000 2.046 253 L HA -0.242 3.530 4.340 -0.947 0.000 0.208 253 L C 2.395 179.062 176.870 -0.339 0.000 1.077 253 L CA 1.867 56.476 54.840 -0.385 0.000 0.747 253 L CB -1.274 40.560 42.059 -0.375 0.000 0.896 253 L HN -0.071 8.159 8.230 -0.000 0.000 0.432 254 T N 0.185 114.607 114.554 -0.220 0.000 2.777 254 T HA -0.149 3.633 4.350 -0.947 0.000 0.266 254 T C 1.987 176.570 174.700 -0.194 0.000 1.040 254 T CA 1.068 63.072 62.100 -0.160 0.000 1.141 254 T CB -0.253 68.561 68.868 -0.090 0.000 0.868 254 T HN 0.170 8.410 8.240 -0.000 0.000 0.444 255 L N 0.507 121.593 121.223 -0.228 0.000 2.042 255 L HA -0.138 3.634 4.340 -0.947 0.000 0.210 255 L C 2.905 179.568 176.870 -0.344 0.000 1.076 255 L CA 1.451 56.140 54.840 -0.251 0.000 0.749 255 L CB -0.447 41.464 42.059 -0.247 0.000 0.893 255 L HN 0.163 8.393 8.230 -0.000 0.000 0.432 256 R N -0.051 120.139 120.500 -0.518 0.000 2.066 256 R HA -0.135 3.637 4.340 -0.947 0.000 0.232 256 R C 2.256 178.322 176.300 -0.391 0.000 1.131 256 R CA 1.469 57.236 56.100 -0.555 0.000 0.955 256 R CB -0.480 29.338 30.300 -0.804 0.000 0.851 256 R HN 0.406 8.676 8.270 -0.000 0.000 0.432 257 G N -0.075 108.517 108.800 -0.346 0.000 2.418 257 G HA2 -0.226 3.166 3.960 -0.947 0.000 0.217 257 G HA3 -0.226 3.166 3.960 -0.947 0.000 0.217 257 G C 1.313 176.181 174.900 -0.054 0.000 1.158 257 G CA 0.652 45.636 45.100 -0.195 0.000 0.771 257 G HN 0.294 8.584 8.290 -0.000 0.000 0.545 258 V N 0.462 120.315 119.914 -0.101 0.000 2.913 258 V HA -0.029 3.523 4.120 -0.947 0.000 0.260 258 V C 2.625 178.659 176.094 -0.100 0.000 1.098 258 V CA 1.530 63.783 62.300 -0.077 0.000 1.121 258 V CB -0.311 31.458 31.823 -0.090 0.000 0.714 258 V HN 0.195 8.385 8.190 -0.000 0.000 0.487 259 K N 0.684 121.001 120.400 -0.139 0.000 2.113 259 K HA -0.145 3.606 4.320 -0.947 0.000 0.208 259 K C 1.792 178.325 176.600 -0.112 0.000 1.047 259 K CA 1.984 58.182 56.287 -0.149 0.000 0.928 259 K CB -0.818 31.573 32.500 -0.181 0.000 0.716 259 K HN 0.743 8.993 8.250 -0.000 0.000 0.446 260 T N -1.256 113.255 114.554 -0.071 0.000 3.186 260 T HA 0.111 3.893 4.350 -0.947 0.000 0.257 260 T C 1.538 176.194 174.700 -0.073 0.000 1.029 260 T CA -0.264 61.802 62.100 -0.056 0.000 0.916 260 T CB 0.047 68.911 68.868 -0.007 0.000 1.041 260 T HN -0.055 8.185 8.240 -0.000 0.000 0.562 261 L N 2.385 123.561 121.223 -0.079 0.000 2.012 261 L HA 0.149 3.921 4.340 -0.947 0.000 0.210 261 L C 2.440 179.137 176.870 -0.288 0.000 1.073 261 L CA 2.302 57.084 54.840 -0.096 0.000 0.748 261 L CB -1.152 40.881 42.059 -0.045 0.000 0.891 261 L HN 0.369 8.599 8.230 -0.000 0.000 0.431 262 G N 0.209 108.777 108.800 -0.387 0.000 2.433 262 G HA2 -0.281 3.110 3.960 -0.947 0.000 0.216 262 G HA3 -0.281 3.110 3.960 -0.947 0.000 0.216 262 G C 1.555 176.124 174.900 -0.552 0.000 1.186 262 G CA 1.267 45.871 45.100 -0.828 0.000 0.779 262 G HN 0.678 8.968 8.290 -0.000 0.000 0.543 263 I N -1.773 118.646 120.570 -0.251 0.000 2.394 263 I HA 0.044 3.646 4.170 -0.947 0.000 0.251 263 I C 2.697 178.724 176.117 -0.150 0.000 1.136 263 I CA 0.893 62.101 61.300 -0.152 0.000 1.425 263 I CB -0.307 37.638 38.000 -0.093 0.000 1.079 263 I HN -0.002 8.208 8.210 -0.000 0.000 0.425 264 R N 0.476 120.887 120.500 -0.148 0.000 2.062 264 R HA -0.043 3.729 4.340 -0.947 0.000 0.231 264 R C 2.401 178.680 176.300 -0.035 0.000 1.136 264 R CA 1.576 57.603 56.100 -0.121 0.000 0.948 264 R CB -0.327 29.965 30.300 -0.014 0.000 0.845 264 R HN 0.314 8.584 8.270 -0.000 0.000 0.430 265 M N 0.896 120.467 119.600 -0.048 0.000 2.108 265 M HA -0.148 3.764 4.480 -0.947 0.000 0.261 265 M C 1.935 178.260 176.300 0.042 0.000 1.066 265 M CA 1.544 56.845 55.300 0.003 0.000 1.107 265 M CB -0.869 31.685 32.600 -0.076 0.000 1.356 265 M HN 0.063 8.353 8.290 -0.000 0.000 0.406 266 E N -0.140 120.050 120.200 -0.016 0.000 2.070 266 E HA -0.229 3.553 4.350 -0.947 0.000 0.197 266 E C 2.174 178.792 176.600 0.030 0.000 1.004 266 E CA 1.355 57.788 56.400 0.056 0.000 0.805 266 E CB -0.413 29.312 29.700 0.042 0.000 0.744 266 E HN 0.332 8.692 8.360 -0.000 0.000 0.451 267 R N 0.294 120.772 120.500 -0.036 0.000 2.073 267 R HA -0.073 3.698 4.340 -0.947 0.000 0.229 267 R C 2.279 178.558 176.300 -0.035 0.000 1.120 267 R CA 1.281 57.342 56.100 -0.065 0.000 0.967 267 R CB -0.551 29.663 30.300 -0.143 0.000 0.862 267 R HN 0.264 8.534 8.270 -0.000 0.000 0.436 268 H N -0.693 118.385 119.070 0.014 0.000 2.319 268 H HA -0.163 3.824 4.556 -0.949 0.000 0.297 268 H C 2.053 177.415 175.328 0.056 0.000 1.097 268 H CA 2.021 58.096 56.048 0.044 0.000 1.285 268 H CB -0.460 29.341 29.762 0.065 0.000 1.368 268 H HN 0.286 8.566 8.280 -0.000 0.000 0.495 269 C N 0.289 119.703 119.300 0.191 0.000 2.475 269 C HA -0.036 3.856 4.460 -0.947 0.000 0.279 269 C C 2.725 177.804 174.990 0.149 0.000 1.322 269 C CA 0.491 59.618 59.018 0.182 0.000 1.734 269 C CB -0.390 27.442 27.740 0.153 0.000 2.005 269 C HN 0.635 8.865 8.230 -0.000 0.000 0.495 270 E N 1.549 121.808 120.200 0.098 0.000 2.051 270 E HA -0.210 3.572 4.350 -0.947 0.000 0.192 270 E C 1.718 178.346 176.600 0.047 0.000 0.991 270 E CA 1.368 57.809 56.400 0.068 0.000 0.799 270 E CB -0.113 29.611 29.700 0.041 0.000 0.748 270 E HN 0.530 8.890 8.360 -0.000 0.000 0.449 271 N N 0.609 119.332 118.700 0.037 0.000 2.120 271 N HA -0.138 4.034 4.740 -0.947 0.000 0.188 271 N C 1.660 177.167 175.510 -0.004 0.000 1.024 271 N CA 1.458 54.516 53.050 0.014 0.000 0.852 271 N CB -0.563 37.934 38.487 0.015 0.000 1.003 271 N HN 0.284 8.664 8.380 -0.000 0.000 0.424 272 A N 0.834 123.660 122.820 0.011 0.000 1.902 272 A HA -0.083 3.669 4.320 -0.947 0.000 0.217 272 A C 2.205 179.606 177.584 -0.305 0.000 1.181 272 A CA 0.956 52.921 52.037 -0.120 0.000 0.623 272 A CB -0.705 18.274 19.000 -0.034 0.000 0.818 272 A HN 0.238 8.388 8.150 -0.000 0.000 0.443 273 L N -0.096 121.071 121.223 -0.094 0.000 2.046 273 L HA -0.137 3.634 4.340 -0.947 0.000 0.208 273 L C 2.194 179.044 176.870 -0.033 0.000 1.077 273 L CA 2.251 57.084 54.840 -0.011 0.000 0.747 273 L CB -0.552 41.609 42.059 0.170 0.000 0.896 273 L HN 0.358 8.588 8.230 -0.000 0.000 0.432 274 K N -0.543 119.848 120.400 -0.014 0.000 2.057 274 K HA -0.130 3.622 4.320 -0.947 0.000 0.207 274 K C 2.078 178.681 176.600 0.005 0.000 1.049 274 K CA 1.912 58.200 56.287 0.001 0.000 0.931 274 K CB -0.297 32.200 32.500 -0.006 0.000 0.714 274 K HN 0.348 8.598 8.250 -0.000 0.000 0.440 275 I N 0.853 121.401 120.570 -0.037 0.000 2.315 275 I HA -0.232 3.370 4.170 -0.947 0.000 0.248 275 I C 2.465 178.578 176.117 -0.007 0.000 1.117 275 I CA 0.866 62.166 61.300 -0.000 0.000 1.404 275 I CB -0.308 37.667 38.000 -0.042 0.000 1.071 275 I HN 0.144 8.354 8.210 -0.000 0.000 0.419 276 A N 0.974 123.702 122.820 -0.154 0.000 1.902 276 A HA -0.203 3.549 4.320 -0.947 0.000 0.217 276 A C 2.396 179.946 177.584 -0.057 0.000 1.181 276 A CA 1.513 53.447 52.037 -0.173 0.000 0.623 276 A CB -0.535 18.233 19.000 -0.388 0.000 0.818 276 A HN 0.312 8.462 8.150 -0.000 0.000 0.443 277 R N -1.886 118.609 120.500 -0.008 0.000 2.092 277 R HA -0.077 3.695 4.340 -0.947 0.000 0.231 277 R C 2.010 178.326 176.300 0.026 0.000 1.119 277 R CA 1.453 57.563 56.100 0.018 0.000 0.970 277 R CB -0.495 29.829 30.300 0.039 0.000 0.864 277 R HN 0.639 8.909 8.270 -0.000 0.000 0.440 278 F N 1.634 121.544 119.950 -0.066 0.000 2.102 278 F HA -0.162 3.796 4.527 -0.947 0.000 0.298 278 F C 1.774 177.541 175.800 -0.056 0.000 1.105 278 F CA 1.436 59.404 58.000 -0.054 0.000 1.239 278 F CB -0.342 38.622 39.000 -0.059 0.000 0.991 278 F HN -0.122 8.178 8.300 -0.000 0.000 0.474 279 L N 0.287 121.276 121.223 -0.391 0.000 2.046 279 L HA -0.206 3.566 4.340 -0.947 0.000 0.208 279 L C 2.545 179.211 176.870 -0.341 0.000 1.077 279 L CA 1.917 56.433 54.840 -0.539 0.000 0.747 279 L CB -0.850 40.942 42.059 -0.446 0.000 0.896 279 L HN 0.271 8.501 8.230 -0.000 0.000 0.432 280 E N 0.111 120.188 120.200 -0.204 0.000 2.268 280 E HA -0.157 3.625 4.350 -0.947 0.000 0.195 280 E C 1.943 178.463 176.600 -0.134 0.000 0.995 280 E CA 0.878 57.197 56.400 -0.134 0.000 0.836 280 E CB 0.011 29.665 29.700 -0.076 0.000 0.763 280 E HN 0.470 8.830 8.360 -0.000 0.000 0.491 281 G N -0.752 107.945 108.800 -0.172 0.000 3.042 281 G HA2 -0.098 3.293 3.960 -0.947 0.000 0.212 281 G HA3 -0.098 3.293 3.960 -0.947 0.000 0.212 281 G C 0.256 175.041 174.900 -0.192 0.000 1.166 281 G CA -0.285 44.725 45.100 -0.149 0.000 0.767 281 G HN 0.198 8.488 8.290 -0.000 0.000 0.546 282 H N 1.611 120.471 119.070 -0.349 0.000 2.652 282 H HA 0.232 4.220 4.556 -0.947 0.000 0.298 282 H C -1.469 173.741 175.328 -0.198 0.000 1.076 282 H CA -1.876 53.969 56.048 -0.339 0.000 1.360 282 H CB 2.372 31.806 29.762 -0.547 0.000 1.421 282 H HN 0.003 8.283 8.280 -0.000 0.000 0.464 283 P HA -0.051 4.369 4.420 -0.000 0.000 0.230 283 P C 0.844 178.200 177.300 0.093 0.000 1.158 283 P CA 0.560 63.653 63.100 -0.011 0.000 0.769 283 P CB 0.528 32.182 31.700 -0.076 0.000 0.807 284 S N -0.735 115.149 115.700 0.306 0.000 2.575 284 S HA 0.131 4.033 4.470 -0.947 0.000 0.215 284 S C 0.890 175.514 174.600 0.040 0.000 0.966 284 S CA 0.018 58.313 58.200 0.158 0.000 0.911 284 S CB -0.030 63.268 63.200 0.164 0.000 0.780 284 S HN 0.016 8.326 8.310 -0.000 0.000 0.514 285 I N 2.802 123.385 120.570 0.021 0.000 2.330 285 I HA 0.188 3.790 4.170 -0.947 0.000 0.289 285 I C 1.644 177.762 176.117 0.000 0.000 1.001 285 I CA -0.105 61.187 61.300 -0.013 0.000 1.193 285 I CB 0.823 38.752 38.000 -0.118 0.000 1.345 285 I HN 0.134 8.344 8.210 -0.000 0.000 0.461 286 T N 4.209 118.777 114.554 0.023 0.000 2.851 286 T HA 0.127 3.909 4.350 -0.947 0.000 0.262 286 T C 0.977 175.656 174.700 -0.035 0.000 1.043 286 T CA 0.572 62.674 62.100 0.003 0.000 1.140 286 T CB 0.297 69.178 68.868 0.022 0.000 0.872 286 T HN 0.394 8.634 8.240 -0.000 0.000 0.446 287 R N 0.201 120.673 120.500 -0.047 0.000 2.725 287 R HA 0.729 4.500 4.340 -0.947 0.000 0.277 287 R C -1.785 174.375 176.300 -0.234 0.000 0.987 287 R CA -0.748 55.226 56.100 -0.210 0.000 0.901 287 R CB 2.454 32.558 30.300 -0.327 0.000 1.207 287 R HN 0.161 8.431 8.270 -0.000 0.000 0.463 288 V N 3.022 122.725 119.914 -0.351 0.000 2.577 288 V HA 0.422 3.973 4.120 -0.947 0.000 0.303 288 V C -1.294 174.638 176.094 -0.270 0.000 1.042 288 V CA -0.882 61.311 62.300 -0.178 0.000 0.872 288 V CB 1.717 33.510 31.823 -0.049 0.000 0.998 288 V HN 0.565 8.755 8.190 -0.000 0.000 0.423 289 Y N 4.966 125.401 120.300 0.226 0.000 2.417 289 Y HA 0.687 4.668 4.550 -0.948 0.000 0.336 289 Y C -0.558 175.579 175.900 0.394 0.000 0.961 289 Y CA -0.631 57.614 58.100 0.243 0.000 1.215 289 Y CB 1.066 39.633 38.460 0.179 0.000 1.120 289 Y HN 0.654 8.934 8.280 -0.000 0.000 0.499 290 Y N 5.231 125.754 120.300 0.371 0.000 2.390 290 Y HA 0.365 4.346 4.550 -0.948 0.000 0.324 290 Y C -2.523 173.562 175.900 0.308 0.000 1.151 290 Y CA -3.018 55.266 58.100 0.307 0.000 1.053 290 Y CB 2.402 40.983 38.460 0.201 0.000 1.277 290 Y HN 0.234 8.514 8.280 -0.000 0.000 0.432 291 P HA -0.019 4.401 4.420 -0.000 0.000 0.223 291 P C 1.180 178.312 177.300 -0.280 0.000 1.144 291 P CA 1.950 64.754 63.100 -0.493 0.000 0.783 291 P CB 0.315 31.711 31.700 -0.505 0.000 0.771 292 G N -1.362 107.147 108.800 -0.486 0.000 2.813 292 G HA2 0.047 3.439 3.960 -0.947 0.000 0.209 292 G HA3 0.047 3.439 3.960 -0.947 0.000 0.209 292 G C 0.338 175.400 174.900 0.271 0.000 1.150 292 G CA -0.057 45.067 45.100 0.039 0.000 0.785 292 G HN 0.212 8.502 8.290 -0.000 0.000 0.535 293 L N 0.851 122.221 121.223 0.246 0.000 2.312 293 L HA 0.241 4.013 4.340 -0.947 0.000 0.281 293 L C 1.511 178.269 176.870 -0.186 0.000 1.070 293 L CA -0.599 54.294 54.840 0.089 0.000 0.805 293 L CB 1.779 43.926 42.059 0.146 0.000 1.174 293 L HN -0.043 8.187 8.230 -0.000 0.000 0.434 294 S N 0.357 115.772 115.700 -0.474 0.000 2.419 294 S HA -0.148 3.754 4.470 -0.947 0.000 0.233 294 S C 1.862 176.248 174.600 -0.357 0.000 1.016 294 S CA 1.509 59.190 58.200 -0.865 0.000 0.974 294 S CB -0.068 62.796 63.200 -0.560 0.000 0.786 294 S HN 0.885 9.195 8.310 -0.000 0.000 0.492 295 S N 0.606 116.219 115.700 -0.144 0.000 2.515 295 S HA -0.047 3.855 4.470 -0.947 0.000 0.231 295 S C 0.649 175.275 174.600 0.044 0.000 0.987 295 S CA 0.040 58.214 58.200 -0.043 0.000 0.936 295 S CB -0.571 62.603 63.200 -0.043 0.000 0.766 295 S HN 0.604 8.914 8.310 -0.000 0.000 0.528 296 H N 3.741 122.820 119.070 0.016 0.000 3.004 296 H HA 0.132 4.119 4.556 -0.947 0.000 0.316 296 H C -1.805 173.595 175.328 0.121 0.000 1.014 296 H CA -1.160 54.953 56.048 0.107 0.000 1.454 296 H CB 1.003 30.866 29.762 0.169 0.000 1.472 296 H HN 0.049 8.329 8.280 -0.000 0.000 0.571 297 P HA -0.150 4.270 4.420 -0.000 0.000 0.217 297 P C 0.133 177.564 177.300 0.218 0.000 1.148 297 P CA 1.627 64.778 63.100 0.084 0.000 0.834 297 P CB 0.250 31.935 31.700 -0.026 0.000 0.783 298 Q N -2.967 117.102 119.800 0.450 0.000 2.211 298 Q HA 0.121 3.893 4.340 -0.947 0.000 0.301 298 Q C 0.673 176.797 176.000 0.207 0.000 0.884 298 Q CA -0.428 55.544 55.803 0.281 0.000 1.115 298 Q CB -0.147 28.727 28.738 0.226 0.000 1.217 298 Q HN 0.174 8.444 8.270 -0.000 0.000 0.451 299 Y N 1.878 122.258 120.300 0.133 0.000 2.081 299 Y HA -0.296 3.685 4.550 -0.947 0.000 0.280 299 Y C 1.877 177.758 175.900 -0.032 0.000 1.163 299 Y CA 1.989 60.093 58.100 0.006 0.000 1.135 299 Y CB 0.457 38.947 38.460 0.049 0.000 0.970 299 Y HN 0.166 8.446 8.280 -0.000 0.000 0.498 300 E N -0.020 120.148 120.200 -0.052 0.000 2.106 300 E HA -0.190 3.592 4.350 -0.947 0.000 0.192 300 E C 2.244 178.747 176.600 -0.161 0.000 0.984 300 E CA 1.185 57.495 56.400 -0.149 0.000 0.806 300 E CB -0.824 28.869 29.700 -0.010 0.000 0.750 300 E HN 0.511 8.871 8.360 -0.000 0.000 0.458 301 L N 1.030 122.197 121.223 -0.093 0.000 2.042 301 L HA -0.074 3.698 4.340 -0.947 0.000 0.210 301 L C 2.157 178.938 176.870 -0.148 0.000 1.076 301 L CA 2.419 57.205 54.840 -0.091 0.000 0.749 301 L CB -1.035 40.999 42.059 -0.042 0.000 0.893 301 L HN 0.125 8.355 8.230 -0.000 0.000 0.432 302 G N -1.372 107.304 108.800 -0.207 0.000 2.440 302 G HA2 -0.256 3.135 3.960 -0.947 0.000 0.218 302 G HA3 -0.256 3.135 3.960 -0.947 0.000 0.218 302 G C 1.402 176.131 174.900 -0.286 0.000 1.154 302 G CA 0.625 45.568 45.100 -0.262 0.000 0.767 302 G HN 0.485 8.775 8.290 -0.000 0.000 0.552 303 Q N 0.090 119.665 119.800 -0.375 0.000 2.224 303 Q HA 0.021 3.792 4.340 -0.947 0.000 0.203 303 Q C 2.654 178.531 176.000 -0.206 0.000 0.970 303 Q CA 0.745 56.351 55.803 -0.330 0.000 0.865 303 Q CB -0.171 28.320 28.738 -0.412 0.000 0.922 303 Q HN 0.502 8.772 8.270 -0.000 0.000 0.445 304 R N -0.035 120.362 120.500 -0.173 0.000 2.127 304 R HA -0.023 3.749 4.340 -0.947 0.000 0.217 304 R C 2.104 178.334 176.300 -0.116 0.000 1.074 304 R CA 0.795 56.821 56.100 -0.124 0.000 0.991 304 R CB 0.085 30.327 30.300 -0.098 0.000 0.895 304 R HN 0.261 8.531 8.270 -0.000 0.000 0.450 305 Q N -0.270 119.456 119.800 -0.124 0.000 2.373 305 Q HA 0.155 3.927 4.340 -0.947 0.000 0.210 305 Q C -0.026 175.904 176.000 -0.116 0.000 0.913 305 Q CA 0.376 56.115 55.803 -0.107 0.000 0.911 305 Q CB 0.665 29.346 28.738 -0.097 0.000 1.040 305 Q HN 0.098 8.368 8.270 -0.000 0.000 0.521 306 M N 0.132 119.649 119.600 -0.137 0.000 2.393 306 M HA 0.229 4.140 4.480 -0.947 0.000 0.316 306 M C 0.575 176.785 176.300 -0.151 0.000 1.087 306 M CA -0.429 54.790 55.300 -0.136 0.000 0.937 306 M CB 2.112 34.632 32.600 -0.134 0.000 1.668 306 M HN 0.029 8.319 8.290 -0.000 0.000 0.438 307 S N 2.860 118.462 115.700 -0.164 0.000 2.470 307 S HA 0.237 4.139 4.470 -0.947 0.000 0.225 307 S C 0.438 174.959 174.600 -0.131 0.000 1.006 307 S CA 0.265 58.359 58.200 -0.178 0.000 0.934 307 S CB 0.084 63.122 63.200 -0.271 0.000 0.778 307 S HN 0.674 8.984 8.310 -0.000 0.000 0.517 308 L N 0.722 121.883 121.223 -0.104 0.000 2.424 308 L HA 0.444 4.216 4.340 -0.947 0.000 0.258 308 L C -2.219 174.607 176.870 -0.074 0.000 0.995 308 L CA -2.277 52.534 54.840 -0.049 0.000 0.821 308 L CB 2.561 44.630 42.059 0.016 0.000 1.383 308 L HN -0.211 8.019 8.230 -0.000 0.000 0.410 309 P HA 0.094 4.514 4.420 -0.000 0.000 0.245 309 P C 0.483 177.680 177.300 -0.173 0.000 1.212 309 P CA 0.635 63.604 63.100 -0.219 0.000 0.774 309 P CB 0.509 31.989 31.700 -0.366 0.000 0.999 310 G N -0.593 108.208 108.800 0.002 0.000 2.661 310 G HA2 0.031 3.423 3.960 -0.947 0.000 0.685 310 G HA3 0.031 3.423 3.960 -0.947 0.000 0.685 310 G C 0.480 175.505 174.900 0.207 0.000 1.298 310 G CA -0.543 44.583 45.100 0.043 0.000 0.855 310 G HN 0.229 8.519 8.290 -0.000 0.000 0.560 311 G N -0.954 107.916 108.800 0.117 0.000 3.277 311 G HA2 0.488 3.880 3.960 -0.947 0.000 0.243 311 G HA3 0.488 3.880 3.960 -0.947 0.000 0.243 311 G C 0.475 175.503 174.900 0.212 0.000 1.107 311 G CA 0.208 45.425 45.100 0.194 0.000 0.771 311 G HN 0.665 8.955 8.290 -0.000 0.000 0.544 312 I N 1.519 122.235 120.570 0.243 0.000 2.412 312 I HA 0.537 4.138 4.170 -0.947 0.000 0.296 312 I C -0.453 175.872 176.117 0.346 0.000 0.987 312 I CA -1.268 60.151 61.300 0.198 0.000 1.180 312 I CB 1.459 39.493 38.000 0.056 0.000 1.340 312 I HN -0.118 8.092 8.210 -0.000 0.000 0.455 313 I N 4.493 125.230 120.570 0.279 0.000 2.582 313 I HA 0.352 3.954 4.170 -0.947 0.000 0.292 313 I C -0.099 176.233 176.117 0.358 0.000 1.066 313 I CA -0.453 61.051 61.300 0.339 0.000 1.053 313 I CB 2.414 40.532 38.000 0.197 0.000 1.241 313 I HN 0.621 8.831 8.210 -0.000 0.000 0.421 314 S N 5.121 121.070 115.700 0.416 0.000 2.568 314 S HA 0.912 4.814 4.470 -0.947 0.000 0.302 314 S C -0.808 174.115 174.600 0.539 0.000 1.082 314 S CA -0.572 57.847 58.200 0.364 0.000 1.009 314 S CB 2.046 65.397 63.200 0.251 0.000 1.069 314 S HN 0.566 8.876 8.310 -0.000 0.000 0.500 315 F N -1.570 118.535 119.950 0.259 0.000 2.693 315 F HA 0.731 4.690 4.527 -0.948 0.000 0.309 315 F C -1.207 174.684 175.800 0.151 0.000 1.129 315 F CA -1.042 57.062 58.000 0.174 0.000 0.948 315 F CB 1.011 40.041 39.000 0.050 0.000 1.315 315 F HN 0.575 8.875 8.300 -0.000 0.000 0.447 316 E N 2.501 122.850 120.200 0.250 0.000 2.158 316 E HA 0.502 4.284 4.350 -0.947 0.000 0.271 316 E C -1.201 175.497 176.600 0.163 0.000 0.911 316 E CA -0.914 55.565 56.400 0.131 0.000 0.767 316 E CB 2.980 32.766 29.700 0.143 0.000 1.120 316 E HN 0.717 9.077 8.360 -0.000 0.000 0.405 317 I N 2.024 122.650 120.570 0.093 0.000 2.428 317 I HA 0.385 3.987 4.170 -0.947 0.000 0.296 317 I C -0.095 176.045 176.117 0.037 0.000 0.985 317 I CA -0.522 60.830 61.300 0.086 0.000 1.260 317 I CB 0.899 38.934 38.000 0.058 0.000 1.389 317 I HN 0.610 8.820 8.210 -0.000 0.000 0.484 318 A N 4.821 127.659 122.820 0.030 0.000 2.540 318 A HA 0.412 4.163 4.320 -0.947 0.000 0.239 318 A C 1.103 178.694 177.584 0.012 0.000 1.061 318 A CA 0.678 52.728 52.037 0.022 0.000 0.758 318 A CB -0.387 18.626 19.000 0.022 0.000 0.991 318 A HN 1.625 9.775 8.150 -0.000 0.000 0.502 319 G N 1.015 109.823 108.800 0.013 0.000 2.159 319 G HA2 0.224 3.616 3.960 -0.947 0.000 0.227 319 G HA3 0.224 3.616 3.960 -0.947 0.000 0.227 319 G C 1.687 176.594 174.900 0.012 0.000 0.986 319 G CA 0.603 45.709 45.100 0.009 0.000 0.651 319 G HN 2.958 11.248 8.290 -0.000 0.000 0.523 320 G N -0.287 108.524 108.800 0.019 0.000 2.582 320 G HA2 -0.254 3.137 3.960 -0.947 0.000 0.288 320 G HA3 -0.254 3.137 3.960 -0.947 0.000 0.288 320 G C 1.201 176.131 174.900 0.050 0.000 1.247 320 G CA 0.801 45.922 45.100 0.036 0.000 0.972 320 G HN 1.345 9.635 8.290 -0.000 0.000 0.557 321 L N -0.051 121.221 121.223 0.082 0.000 1.989 321 L HA -0.054 3.717 4.340 -0.947 0.000 0.211 321 L C 2.905 179.840 176.870 0.107 0.000 1.071 321 L CA 2.911 57.842 54.840 0.151 0.000 0.749 321 L CB -0.387 41.737 42.059 0.108 0.000 0.890 321 L HN 0.802 9.032 8.230 -0.000 0.000 0.431 322 E N 0.081 120.311 120.200 0.050 0.000 2.077 322 E HA -0.227 3.555 4.350 -0.947 0.000 0.193 322 E C 1.946 178.538 176.600 -0.013 0.000 0.989 322 E CA 1.653 58.068 56.400 0.025 0.000 0.800 322 E CB -0.216 29.495 29.700 0.018 0.000 0.746 322 E HN 0.509 8.869 8.360 -0.000 0.000 0.452 323 A N 0.175 122.978 122.820 -0.028 0.000 1.902 323 A HA -0.037 3.715 4.320 -0.947 0.000 0.217 323 A C 2.491 179.994 177.584 -0.135 0.000 1.181 323 A CA 1.804 53.807 52.037 -0.056 0.000 0.623 323 A CB -1.343 17.636 19.000 -0.036 0.000 0.818 323 A HN 0.421 8.571 8.150 -0.000 0.000 0.443 324 G N -0.751 107.898 108.800 -0.252 0.000 2.422 324 G HA2 -0.244 3.148 3.960 -0.947 0.000 0.218 324 G HA3 -0.244 3.148 3.960 -0.947 0.000 0.218 324 G C 1.750 176.272 174.900 -0.630 0.000 1.146 324 G CA 0.991 45.686 45.100 -0.675 0.000 0.769 324 G HN 0.545 8.835 8.290 -0.000 0.000 0.547 325 R N 0.322 120.658 120.500 -0.274 0.000 2.066 325 R HA 0.018 3.790 4.340 -0.947 0.000 0.232 325 R C 2.722 179.001 176.300 -0.036 0.000 1.131 325 R CA 0.982 57.066 56.100 -0.025 0.000 0.955 325 R CB -0.273 30.074 30.300 0.079 0.000 0.851 325 R HN 0.257 8.527 8.270 -0.000 0.000 0.432 326 R N 0.011 120.483 120.500 -0.046 0.000 2.091 326 R HA -0.147 3.625 4.340 -0.947 0.000 0.238 326 R C 2.418 178.698 176.300 -0.033 0.000 1.136 326 R CA 1.697 57.780 56.100 -0.029 0.000 0.959 326 R CB -0.354 29.929 30.300 -0.028 0.000 0.856 326 R HN 0.305 8.575 8.270 -0.000 0.000 0.437 327 M N 1.471 121.036 119.600 -0.059 0.000 2.067 327 M HA -0.150 3.761 4.480 -0.947 0.000 0.260 327 M C 2.253 178.551 176.300 -0.003 0.000 1.069 327 M CA 1.852 57.133 55.300 -0.031 0.000 1.117 327 M CB -0.380 32.197 32.600 -0.038 0.000 1.334 327 M HN 0.184 8.474 8.290 -0.000 0.000 0.407 328 I N -1.613 118.943 120.570 -0.023 0.000 2.493 328 I HA -0.203 3.399 4.170 -0.947 0.000 0.254 328 I C 1.128 177.266 176.117 0.034 0.000 1.160 328 I CA 1.367 62.680 61.300 0.021 0.000 1.445 328 I CB -1.028 36.993 38.000 0.035 0.000 1.086 328 I HN 0.197 8.407 8.210 -0.000 0.000 0.433 329 N N 1.022 119.737 118.700 0.024 0.000 2.521 329 N HA 0.010 4.181 4.740 -0.947 0.000 0.188 329 N C 1.314 176.844 175.510 0.034 0.000 1.146 329 N CA 0.629 53.697 53.050 0.030 0.000 0.893 329 N CB 0.286 38.788 38.487 0.025 0.000 0.975 329 N HN 0.386 8.766 8.380 -0.000 0.000 0.451 330 S N -0.521 115.201 115.700 0.036 0.000 2.540 330 S HA 0.104 4.006 4.470 -0.947 0.000 0.222 330 S C 0.715 175.374 174.600 0.099 0.000 1.008 330 S CA -0.472 57.759 58.200 0.051 0.000 0.939 330 S CB 0.639 63.844 63.200 0.009 0.000 0.865 330 S HN 0.183 8.493 8.310 -0.000 0.000 0.499 331 V N 1.024 120.988 119.914 0.083 0.000 2.811 331 V HA 0.391 3.942 4.120 -0.947 0.000 0.302 331 V C 0.491 176.630 176.094 0.074 0.000 1.063 331 V CA -0.014 62.341 62.300 0.091 0.000 1.088 331 V CB 0.860 32.730 31.823 0.077 0.000 0.982 331 V HN 0.244 8.434 8.190 -0.000 0.000 0.485 332 E N 1.835 122.071 120.200 0.059 0.000 2.453 332 E HA 0.156 3.938 4.350 -0.947 0.000 0.211 332 E C 1.048 177.655 176.600 0.012 0.000 0.897 332 E CA 0.127 56.544 56.400 0.028 0.000 1.063 332 E CB 0.829 30.529 29.700 -0.000 0.000 1.080 332 E HN 0.689 9.049 8.360 -0.000 0.000 0.512 333 L N 0.259 121.490 121.223 0.013 0.000 2.541 333 L HA 0.259 4.030 4.340 -0.947 0.000 0.187 333 L C 0.290 177.170 176.870 0.016 0.000 1.098 333 L CA 0.555 55.398 54.840 0.005 0.000 0.846 333 L CB 0.224 42.277 42.059 -0.009 0.000 1.151 333 L HN -0.018 8.212 8.230 -0.000 0.000 0.492 334 C N 1.877 121.194 119.300 0.028 0.000 2.597 334 C HA 0.181 4.073 4.460 -0.947 0.000 0.412 334 C C 0.556 175.569 174.990 0.038 0.000 1.348 334 C CA -0.590 58.452 59.018 0.038 0.000 1.769 334 C CB -1.491 26.284 27.740 0.059 0.000 2.641 334 C HN 0.270 8.500 8.230 -0.000 0.000 0.612 335 L N 3.430 124.674 121.223 0.034 0.000 2.307 335 L HA 0.375 4.147 4.340 -0.947 0.000 0.284 335 L C -0.335 176.557 176.870 0.037 0.000 1.023 335 L CA -0.716 54.143 54.840 0.031 0.000 0.810 335 L CB 0.838 42.911 42.059 0.023 0.000 1.231 335 L HN 0.435 8.665 8.230 -0.000 0.000 0.423 336 L N 3.863 125.110 121.223 0.039 0.000 2.456 336 L HA 0.512 4.284 4.340 -0.947 0.000 0.277 336 L C 0.300 177.192 176.870 0.037 0.000 1.124 336 L CA 0.792 55.658 54.840 0.043 0.000 0.880 336 L CB 0.226 42.311 42.059 0.044 0.000 1.192 336 L HN 0.765 8.995 8.230 -0.000 0.000 0.463 337 A N 2.428 125.271 122.820 0.038 0.000 2.586 337 A HA 0.625 4.377 4.320 -0.947 0.000 0.291 337 A C 0.144 177.752 177.584 0.039 0.000 1.062 337 A CA -0.073 51.984 52.037 0.034 0.000 0.666 337 A CB 1.067 20.082 19.000 0.025 0.000 1.281 337 A HN 0.534 8.684 8.150 -0.000 0.000 0.421 338 V N -1.682 118.257 119.914 0.043 0.000 3.483 338 V HA 0.392 3.944 4.120 -0.947 0.000 0.301 338 V C 0.710 176.844 176.094 0.067 0.000 1.389 338 V CA 1.016 63.353 62.300 0.061 0.000 1.101 338 V CB -0.325 31.539 31.823 0.068 0.000 0.971 338 V HN 0.899 9.089 8.190 -0.000 0.000 0.434 339 S N 1.109 116.828 115.700 0.033 0.000 2.719 339 S HA 0.896 4.797 4.470 -0.947 0.000 0.285 339 S C -0.505 174.064 174.600 -0.052 0.000 1.137 339 S CA -0.158 58.045 58.200 0.005 0.000 1.012 339 S CB 1.424 64.616 63.200 -0.013 0.000 1.134 339 S HN 0.770 9.080 8.310 -0.000 0.000 0.544 340 L N -2.461 118.679 121.223 -0.139 0.000 2.600 340 L HA 0.878 4.650 4.340 -0.947 0.000 0.257 340 L C 0.434 177.016 176.870 -0.480 0.000 1.048 340 L CA -0.135 54.544 54.840 -0.269 0.000 0.869 340 L CB 0.725 42.601 42.059 -0.305 0.000 1.482 340 L HN 0.893 9.123 8.230 -0.000 0.000 0.408 341 G N -0.620 107.732 108.800 -0.746 0.000 2.143 341 G HA2 -0.192 3.200 3.960 -0.947 0.000 0.248 341 G HA3 -0.192 3.200 3.960 -0.947 0.000 0.248 341 G C -0.216 174.365 174.900 -0.531 0.000 0.991 341 G CA 0.403 44.755 45.100 -1.247 0.000 0.689 341 G HN 0.834 9.124 8.290 -0.000 0.000 0.522 342 D N -0.809 119.428 120.400 -0.272 0.000 2.423 342 D HA 0.544 4.616 4.640 -0.947 0.000 0.255 342 D C 2.007 178.307 176.300 -0.001 0.000 1.174 342 D CA 0.432 54.361 54.000 -0.119 0.000 1.008 342 D CB 0.579 41.331 40.800 -0.081 0.000 1.101 342 D HN 0.202 8.572 8.370 -0.000 0.000 0.516 343 T N -2.739 111.786 114.554 -0.050 0.000 3.023 343 T HA 0.001 3.782 4.350 -0.947 0.000 0.266 343 T C 0.473 175.170 174.700 -0.005 0.000 1.093 343 T CA 0.371 62.446 62.100 -0.042 0.000 1.129 343 T CB -0.078 68.703 68.868 -0.145 0.000 0.899 343 T HN 0.178 8.418 8.240 -0.000 0.000 0.491 344 E N 1.939 122.137 120.200 -0.004 0.000 2.301 344 E HA 0.430 4.211 4.350 -0.947 0.000 0.275 344 E C -0.441 176.172 176.600 0.022 0.000 1.030 344 E CA -0.271 56.132 56.400 0.005 0.000 0.852 344 E CB 0.859 30.560 29.700 0.001 0.000 1.060 344 E HN 0.062 8.422 8.360 -0.000 0.000 0.401 345 T N 3.189 117.759 114.554 0.027 0.000 2.834 345 T HA 0.236 4.018 4.350 -0.947 0.000 0.298 345 T C -0.110 174.609 174.700 0.031 0.000 0.966 345 T CA -0.088 62.035 62.100 0.038 0.000 1.141 345 T CB -0.075 68.817 68.868 0.040 0.000 0.905 345 T HN 0.183 8.423 8.240 -0.000 0.000 0.535 346 L N 4.183 125.423 121.223 0.029 0.000 2.342 346 L HA 0.725 4.497 4.340 -0.947 0.000 0.271 346 L C -0.284 176.616 176.870 0.050 0.000 1.008 346 L CA -1.015 53.843 54.840 0.028 0.000 0.818 346 L CB 1.880 43.942 42.059 0.005 0.000 1.296 346 L HN 0.546 8.776 8.230 -0.000 0.000 0.427 347 I N 2.034 122.638 120.570 0.057 0.000 2.769 347 I HA 0.417 4.019 4.170 -0.947 0.000 0.298 347 I C -1.456 174.701 176.117 0.066 0.000 1.128 347 I CA -0.165 61.180 61.300 0.074 0.000 1.031 347 I CB 2.360 40.416 38.000 0.093 0.000 1.235 347 I HN 0.830 9.040 8.210 -0.000 0.000 0.423 348 Q N 5.646 125.485 119.800 0.066 0.000 2.435 348 Q HA 0.394 4.166 4.340 -0.947 0.000 0.282 348 Q C -1.691 174.368 176.000 0.098 0.000 1.020 348 Q CA -0.914 54.935 55.803 0.076 0.000 0.820 348 Q CB 1.789 30.568 28.738 0.068 0.000 1.436 348 Q HN 0.720 8.990 8.270 -0.000 0.000 0.395 349 H N 2.326 121.389 119.070 -0.011 0.000 2.675 349 H HA 0.256 4.243 4.556 -0.948 0.000 0.258 349 H C -2.189 173.138 175.328 -0.001 0.000 1.271 349 H CA -2.258 53.770 56.048 -0.034 0.000 1.462 349 H CB 1.492 31.234 29.762 -0.033 0.000 1.467 349 H HN 0.505 8.785 8.280 -0.000 0.000 0.501 350 P HA -0.200 4.220 4.420 -0.000 0.000 0.217 350 P C 1.412 178.606 177.300 -0.176 0.000 1.151 350 P CA 2.033 65.091 63.100 -0.071 0.000 0.849 350 P CB 0.188 31.825 31.700 -0.106 0.000 0.787 351 A N -0.319 122.227 122.820 -0.457 0.000 1.972 351 A HA -0.161 3.591 4.320 -0.947 0.000 0.219 351 A C 2.241 179.639 177.584 -0.311 0.000 1.169 351 A CA 2.276 54.096 52.037 -0.361 0.000 0.635 351 A CB -1.276 17.529 19.000 -0.326 0.000 0.810 351 A HN 0.373 8.523 8.150 -0.000 0.000 0.446 352 S N -2.634 112.773 115.700 -0.488 0.000 2.524 352 S HA 0.304 4.205 4.470 -0.947 0.000 0.215 352 S C 1.539 176.103 174.600 -0.061 0.000 0.986 352 S CA 0.558 58.671 58.200 -0.145 0.000 0.911 352 S CB -0.020 63.222 63.200 0.071 0.000 0.805 352 S HN 0.438 8.748 8.310 -0.000 0.000 0.501 353 M N 1.176 120.727 119.600 -0.081 0.000 2.999 353 M HA 0.150 4.061 4.480 -0.947 0.000 0.246 353 M C 2.070 178.353 176.300 -0.029 0.000 1.478 353 M CA 1.390 56.677 55.300 -0.020 0.000 1.243 353 M CB 0.370 32.977 32.600 0.012 0.000 1.213 353 M HN 0.501 8.791 8.290 -0.000 0.000 0.564 354 T N -3.915 110.629 114.554 -0.017 0.000 2.985 354 T HA 0.156 3.937 4.350 -0.947 0.000 0.254 354 T C 0.485 175.009 174.700 -0.293 0.000 1.021 354 T CA 0.313 62.353 62.100 -0.100 0.000 0.957 354 T CB -0.096 68.741 68.868 -0.051 0.000 1.047 354 T HN 0.303 8.543 8.240 -0.000 0.000 0.511 355 H N -0.051 118.962 119.070 -0.095 0.000 2.750 355 H HA 0.551 4.538 4.556 -0.947 0.000 0.252 355 H C 1.768 177.042 175.328 -0.089 0.000 1.176 355 H CA -0.083 55.910 56.048 -0.093 0.000 0.987 355 H CB 0.658 30.356 29.762 -0.106 0.000 1.810 355 H HN 0.206 8.486 8.280 -0.000 0.000 0.630 356 S N 1.346 117.039 115.700 -0.011 0.000 2.370 356 S HA -0.079 3.822 4.470 -0.947 0.000 0.226 356 S C -0.415 174.175 174.600 -0.016 0.000 1.033 356 S CA 1.400 59.587 58.200 -0.021 0.000 1.011 356 S CB -0.325 62.859 63.200 -0.027 0.000 0.852 356 S HN 0.389 8.699 8.310 -0.000 0.000 0.457 357 P HA 0.207 4.627 4.420 -0.000 0.000 0.235 357 P C -0.167 177.122 177.300 -0.018 0.000 1.177 357 P CA 0.088 63.173 63.100 -0.025 0.000 0.785 357 P CB 0.006 31.684 31.700 -0.038 0.000 0.885 358 V N 1.257 121.167 119.914 -0.006 0.000 2.655 358 V HA 0.226 3.777 4.120 -0.947 0.000 0.300 358 V C 0.950 177.045 176.094 0.002 0.000 1.044 358 V CA -0.904 61.401 62.300 0.009 0.000 1.095 358 V CB -0.055 31.807 31.823 0.065 0.000 0.952 358 V HN 0.138 8.328 8.190 -0.000 0.000 0.485 359 A N 7.029 129.845 122.820 -0.007 0.000 2.548 359 A HA 0.239 3.991 4.320 -0.947 0.000 0.247 359 A C -0.962 176.613 177.584 -0.015 0.000 1.067 359 A CA -0.648 51.383 52.037 -0.011 0.000 0.757 359 A CB -0.291 18.701 19.000 -0.013 0.000 0.996 359 A HN 0.771 8.921 8.150 -0.000 0.000 0.504 360 P HA -0.199 4.221 4.420 -0.000 0.000 0.216 360 P C 1.091 178.376 177.300 -0.025 0.000 1.154 360 P CA 1.466 64.555 63.100 -0.019 0.000 0.865 360 P CB 0.219 31.912 31.700 -0.012 0.000 0.789 361 E N -0.785 119.402 120.200 -0.021 0.000 2.285 361 E HA -0.109 3.672 4.350 -0.947 0.000 0.194 361 E C 1.791 178.373 176.600 -0.030 0.000 0.997 361 E CA 0.748 57.135 56.400 -0.022 0.000 0.845 361 E CB -0.363 29.327 29.700 -0.016 0.000 0.782 361 E HN 0.398 8.758 8.360 -0.000 0.000 0.491 362 E N 0.665 120.847 120.200 -0.031 0.000 2.230 362 E HA -0.020 3.762 4.350 -0.947 0.000 0.192 362 E C 2.036 178.601 176.600 -0.057 0.000 0.987 362 E CA 0.238 56.614 56.400 -0.039 0.000 0.841 362 E CB 0.039 29.721 29.700 -0.030 0.000 0.783 362 E HN 0.240 8.600 8.360 -0.000 0.000 0.481 363 R N 0.449 120.914 120.500 -0.059 0.000 2.066 363 R HA 0.015 3.787 4.340 -0.947 0.000 0.232 363 R C 2.623 178.860 176.300 -0.105 0.000 1.131 363 R CA 0.668 56.709 56.100 -0.099 0.000 0.955 363 R CB -0.445 29.793 30.300 -0.103 0.000 0.851 363 R HN 0.126 8.396 8.270 -0.000 0.000 0.432 364 L N 1.248 122.427 121.223 -0.074 0.000 2.081 364 L HA -0.248 3.524 4.340 -0.947 0.000 0.212 364 L C 2.353 179.184 176.870 -0.065 0.000 1.080 364 L CA 1.601 56.404 54.840 -0.062 0.000 0.754 364 L CB -0.339 41.697 42.059 -0.039 0.000 0.893 364 L HN 0.213 8.443 8.230 -0.000 0.000 0.433 365 K N -0.228 120.134 120.400 -0.063 0.000 2.057 365 K HA -0.127 3.625 4.320 -0.947 0.000 0.207 365 K C 2.005 178.556 176.600 -0.083 0.000 1.049 365 K CA 1.361 57.611 56.287 -0.061 0.000 0.931 365 K CB -0.240 32.227 32.500 -0.054 0.000 0.714 365 K HN 0.285 8.535 8.250 -0.000 0.000 0.440 366 A N 0.398 123.152 122.820 -0.110 0.000 2.209 366 A HA 0.108 3.860 4.320 -0.947 0.000 0.212 366 A C 1.476 178.975 177.584 -0.141 0.000 1.158 366 A CA 1.079 53.032 52.037 -0.141 0.000 0.742 366 A CB -0.421 18.472 19.000 -0.178 0.000 0.790 366 A HN 0.467 8.617 8.150 -0.000 0.000 0.472 367 G N -1.301 107.424 108.800 -0.125 0.000 2.157 367 G HA2 -0.202 3.190 3.960 -0.947 0.000 0.239 367 G HA3 -0.202 3.190 3.960 -0.947 0.000 0.239 367 G C 0.101 174.908 174.900 -0.155 0.000 0.982 367 G CA 0.147 45.168 45.100 -0.131 0.000 0.650 367 G HN 0.476 8.766 8.290 -0.000 0.000 0.527 368 I N 3.195 123.663 120.570 -0.170 0.000 2.282 368 I HA 0.286 3.888 4.170 -0.947 0.000 0.290 368 I C 1.245 177.284 176.117 -0.130 0.000 1.090 368 I CA 0.029 61.214 61.300 -0.191 0.000 1.231 368 I CB 0.674 38.482 38.000 -0.321 0.000 1.434 368 I HN 0.290 8.500 8.210 -0.000 0.000 0.487 369 T N -0.033 114.472 114.554 -0.082 0.000 2.849 369 T HA 0.162 3.944 4.350 -0.947 0.000 0.284 369 T C 0.846 175.538 174.700 -0.013 0.000 1.004 369 T CA -0.723 61.357 62.100 -0.033 0.000 1.021 369 T CB 1.534 70.405 68.868 0.006 0.000 1.013 369 T HN 0.361 8.601 8.240 -0.000 0.000 0.527 370 D N 1.425 121.834 120.400 0.014 0.000 2.218 370 D HA 0.040 4.112 4.640 -0.947 0.000 0.204 370 D C 1.994 178.398 176.300 0.174 0.000 0.976 370 D CA 1.339 55.375 54.000 0.059 0.000 0.853 370 D CB -0.477 40.353 40.800 0.050 0.000 0.939 370 D HN 0.843 9.213 8.370 -0.000 0.000 0.481 371 G N -0.381 108.482 108.800 0.106 0.000 3.233 371 G HA2 0.126 3.518 3.960 -0.947 0.000 0.234 371 G HA3 0.126 3.518 3.960 -0.947 0.000 0.234 371 G C 0.266 175.186 174.900 0.033 0.000 1.137 371 G CA -0.337 44.808 45.100 0.074 0.000 0.763 371 G HN 0.112 8.402 8.290 -0.000 0.000 0.549 372 L N 2.120 123.380 121.223 0.062 0.000 2.360 372 L HA 0.393 4.165 4.340 -0.947 0.000 0.276 372 L C -0.642 176.201 176.870 -0.045 0.000 1.121 372 L CA -0.330 54.502 54.840 -0.012 0.000 0.845 372 L CB 0.462 42.505 42.059 -0.026 0.000 1.143 372 L HN -0.112 8.118 8.230 -0.000 0.000 0.452 373 I N 5.638 126.010 120.570 -0.330 0.000 2.474 373 I HA 0.454 4.055 4.170 -0.947 0.000 0.294 373 I C 0.015 175.934 176.117 -0.329 0.000 1.005 373 I CA -0.499 60.544 61.300 -0.427 0.000 1.113 373 I CB 1.535 38.948 38.000 -0.978 0.000 1.289 373 I HN 0.645 8.855 8.210 -0.000 0.000 0.436 374 R N 4.960 125.402 120.500 -0.097 0.000 2.393 374 R HA 0.676 4.448 4.340 -0.947 0.000 0.310 374 R C -1.709 174.639 176.300 0.079 0.000 0.968 374 R CA -0.731 55.385 56.100 0.027 0.000 0.867 374 R CB 1.678 32.020 30.300 0.071 0.000 1.124 374 R HN 0.482 8.752 8.270 -0.000 0.000 0.450 375 L N 2.741 124.055 121.223 0.153 0.000 2.356 375 L HA 0.363 4.134 4.340 -0.947 0.000 0.277 375 L C -0.971 175.967 176.870 0.114 0.000 0.996 375 L CA 0.051 54.990 54.840 0.165 0.000 0.822 375 L CB 2.104 44.328 42.059 0.275 0.000 1.256 375 L HN 0.566 8.796 8.230 -0.000 0.000 0.413 376 S N 4.391 120.128 115.700 0.062 0.000 2.423 376 S HA 0.522 4.424 4.470 -0.947 0.000 0.317 376 S C -0.530 174.101 174.600 0.052 0.000 1.065 376 S CA -0.588 57.620 58.200 0.014 0.000 1.111 376 S CB 0.302 63.460 63.200 -0.070 0.000 0.968 376 S HN 0.431 8.741 8.310 -0.000 0.000 0.474 377 V N 5.891 125.862 119.914 0.096 0.000 2.508 377 V HA 0.449 4.001 4.120 -0.947 0.000 0.281 377 V C 1.387 177.626 176.094 0.242 0.000 1.041 377 V CA 0.192 62.571 62.300 0.131 0.000 1.016 377 V CB 0.692 32.586 31.823 0.118 0.000 0.984 377 V HN 0.929 9.119 8.190 -0.000 0.000 0.478 378 G N 3.466 112.366 108.800 0.167 0.000 2.641 378 G HA2 0.487 3.878 3.960 -0.947 0.000 0.239 378 G HA3 0.487 3.878 3.960 -0.947 0.000 0.239 378 G C 0.353 175.263 174.900 0.017 0.000 1.402 378 G CA -0.742 44.459 45.100 0.168 0.000 1.046 378 G HN 0.610 8.900 8.290 -0.000 0.000 0.565 379 L N -0.003 121.172 121.223 -0.080 0.000 2.667 379 L HA 0.250 4.022 4.340 -0.947 0.000 0.232 379 L C 0.434 177.254 176.870 -0.084 0.000 1.138 379 L CA -0.060 54.690 54.840 -0.151 0.000 0.921 379 L CB -0.142 41.796 42.059 -0.202 0.000 1.180 379 L HN 0.361 8.591 8.230 -0.000 0.000 0.487 380 E N 0.272 120.442 120.200 -0.050 0.000 2.410 380 E HA 0.008 3.789 4.350 -0.947 0.000 0.255 380 E C -0.131 176.442 176.600 -0.045 0.000 1.194 380 E CA -0.066 56.309 56.400 -0.042 0.000 0.955 380 E CB 0.373 30.054 29.700 -0.030 0.000 0.988 380 E HN 0.019 8.379 8.360 -0.000 0.000 0.461 381 D N 2.502 122.876 120.400 -0.044 0.000 2.450 381 D HA -0.042 4.030 4.640 -0.947 0.000 0.247 381 D C -1.439 174.829 176.300 -0.053 0.000 1.162 381 D CA -0.813 53.159 54.000 -0.046 0.000 0.879 381 D CB 0.676 41.449 40.800 -0.045 0.000 1.163 381 D HN 0.242 8.612 8.370 -0.000 0.000 0.472 382 P HA -0.164 4.256 4.420 -0.000 0.000 0.218 382 P C 0.854 178.096 177.300 -0.097 0.000 1.148 382 P CA 1.136 64.198 63.100 -0.065 0.000 0.822 382 P CB 0.491 32.160 31.700 -0.052 0.000 0.784 383 E N 0.079 120.225 120.200 -0.090 0.000 2.110 383 E HA -0.160 3.621 4.350 -0.947 0.000 0.193 383 E C 1.825 178.354 176.600 -0.119 0.000 0.988 383 E CA 1.221 57.554 56.400 -0.111 0.000 0.804 383 E CB -0.727 28.924 29.700 -0.081 0.000 0.745 383 E HN 0.289 8.649 8.360 -0.000 0.000 0.458 384 D N 0.098 120.444 120.400 -0.090 0.000 2.123 384 D HA -0.073 3.999 4.640 -0.947 0.000 0.200 384 D C 1.980 178.227 176.300 -0.088 0.000 0.976 384 D CA 0.754 54.705 54.000 -0.082 0.000 0.831 384 D CB -0.075 40.689 40.800 -0.060 0.000 0.974 384 D HN 0.213 8.583 8.370 -0.000 0.000 0.469 385 I N 0.763 121.281 120.570 -0.086 0.000 2.252 385 I HA -0.205 3.397 4.170 -0.947 0.000 0.245 385 I C 2.447 178.482 176.117 -0.137 0.000 1.102 385 I CA 0.749 62.003 61.300 -0.077 0.000 1.385 385 I CB -0.231 37.737 38.000 -0.052 0.000 1.064 385 I HN -0.052 8.158 8.210 -0.000 0.000 0.414 386 I N 1.081 121.507 120.570 -0.239 0.000 2.226 386 I HA -0.291 3.311 4.170 -0.947 0.000 0.245 386 I C 2.240 178.097 176.117 -0.434 0.000 1.100 386 I CA 1.352 62.347 61.300 -0.507 0.000 1.374 386 I CB -0.508 37.090 38.000 -0.672 0.000 1.057 386 I HN 0.292 8.502 8.210 -0.000 0.000 0.413 387 N N 0.696 119.245 118.700 -0.252 0.000 2.120 387 N HA -0.223 3.949 4.740 -0.947 0.000 0.188 387 N C 1.528 177.008 175.510 -0.051 0.000 1.024 387 N CA 1.499 54.465 53.050 -0.139 0.000 0.852 387 N CB -0.506 37.917 38.487 -0.107 0.000 1.003 387 N HN 0.340 8.720 8.380 -0.000 0.000 0.424 388 D N 0.497 120.867 120.400 -0.050 0.000 2.097 388 D HA -0.034 4.038 4.640 -0.947 0.000 0.195 388 D C 2.072 178.417 176.300 0.075 0.000 0.989 388 D CA 0.685 54.695 54.000 0.017 0.000 0.827 388 D CB -0.133 40.667 40.800 0.001 0.000 0.966 388 D HN 0.148 8.518 8.370 -0.000 0.000 0.456 389 L N 0.373 121.615 121.223 0.031 0.000 2.017 389 L HA -0.124 3.648 4.340 -0.947 0.000 0.208 389 L C 2.594 179.548 176.870 0.140 0.000 1.073 389 L CA 1.224 56.115 54.840 0.085 0.000 0.745 389 L CB -0.584 41.526 42.059 0.086 0.000 0.894 389 L HN 0.143 8.373 8.230 -0.000 0.000 0.432 390 E N -0.146 120.149 120.200 0.159 0.000 2.110 390 E HA -0.291 3.490 4.350 -0.947 0.000 0.193 390 E C 2.063 178.788 176.600 0.208 0.000 0.988 390 E CA 1.628 58.206 56.400 0.297 0.000 0.804 390 E CB -0.026 29.837 29.700 0.272 0.000 0.745 390 E HN 0.535 8.895 8.360 -0.000 0.000 0.458 391 H N 0.080 119.189 119.070 0.066 0.000 2.321 391 H HA -0.017 3.971 4.556 -0.947 0.000 0.300 391 H C 1.827 177.183 175.328 0.047 0.000 1.087 391 H CA 2.458 58.535 56.048 0.048 0.000 1.319 391 H CB -0.207 29.568 29.762 0.021 0.000 1.379 391 H HN 0.190 8.470 8.280 -0.000 0.000 0.501 392 A N 0.362 123.224 122.820 0.071 0.000 1.898 392 A HA -0.050 3.701 4.320 -0.947 0.000 0.216 392 A C 2.561 180.132 177.584 -0.021 0.000 1.181 392 A CA 1.435 53.475 52.037 0.005 0.000 0.620 392 A CB -0.709 18.334 19.000 0.072 0.000 0.819 392 A HN 0.498 8.648 8.150 -0.000 0.000 0.442 393 I N -1.002 119.569 120.570 0.001 0.000 2.179 393 I HA -0.248 3.354 4.170 -0.947 0.000 0.242 393 I C 2.705 178.809 176.117 -0.021 0.000 1.088 393 I CA 1.638 62.910 61.300 -0.046 0.000 1.357 393 I CB -0.301 37.580 38.000 -0.199 0.000 1.051 393 I HN 0.353 8.563 8.210 -0.000 0.000 0.409 394 R N 1.355 121.868 120.500 0.022 0.000 2.091 394 R HA -0.207 3.564 4.340 -0.947 0.000 0.238 394 R C 2.260 178.541 176.300 -0.031 0.000 1.136 394 R CA 1.648 57.769 56.100 0.034 0.000 0.959 394 R CB -0.039 30.288 30.300 0.046 0.000 0.856 394 R HN 0.288 8.558 8.270 -0.000 0.000 0.437 395 K N -0.456 119.884 120.400 -0.100 0.000 2.057 395 K HA -0.063 3.689 4.320 -0.947 0.000 0.206 395 K C 2.004 178.570 176.600 -0.056 0.000 1.050 395 K CA 1.290 57.513 56.287 -0.107 0.000 0.935 395 K CB -0.066 32.329 32.500 -0.174 0.000 0.715 395 K HN 0.213 8.463 8.250 -0.000 0.000 0.439 396 A N 1.236 124.029 122.820 -0.046 0.000 2.066 396 A HA -0.061 3.690 4.320 -0.947 0.000 0.218 396 A C 1.360 178.932 177.584 -0.020 0.000 1.157 396 A CA 1.382 53.399 52.037 -0.033 0.000 0.670 396 A CB -0.427 18.551 19.000 -0.036 0.000 0.804 396 A HN 0.468 8.618 8.150 -0.000 0.000 0.453 397 T N 0.000 114.548 114.554 -0.011 0.000 3.816 397 T HA 0.000 3.782 4.350 -0.947 0.000 0.228 397 T CA 0.000 62.102 62.100 0.004 0.000 1.349 397 T CB 0.000 68.879 68.868 0.018 0.000 0.612 397 T HN 0.000 8.240 8.240 -0.000 0.000 0.658