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 1s5m_1_A DATA FIRST_RESID 1 DATA SEQUENCE SYQPTPEDRF TFGLWTVGWQ GRDPFGDATR PALDPVETVQ RLAELGAHGV DATA SEQUENCE TFHDDDLIPF GSSDTERESH IKRFRQALDA TGMTVPMATT NLFTHPVFKD DATA SEQUENCE GGFTANDRDV RRYALRKTIR NIDLAVELGA KTYVAWGGRE GAESGAAKDV DATA SEQUENCE RVALDRMKEA FDLLGEYVTS QGYDIRFAIE PKPNEPRGDI LLPTVGHALA DATA SEQUENCE FIERLERPEL YGVNPEVGHE QMAGLNFPHG IAQALWAGKL FHIDLNGQSG DATA SEQUENCE IKYDQDLRFG AGDLRAAFWL VDLLESAGYE GPRHFDFKPP RTEDIDGVWA DATA SEQUENCE SAAGCMRNYL ILKERAAAFR ADPEVQEALR ASRLDELAQP TAADGVQELL DATA SEQUENCE ADRTAFEDFD VDAAAARGMA FERLDQLAMD HLLGAR VARS RESID RESNAME ATOMNAME SS_SHIFT SHIFT RC_SHIFT HM_SHIFT EF_SHIFT SIGMA FORMAT %4d %4s %4s %9.3f %9.3f %9.3f %9.3f %9.3f %9.3f 1 S HA 0.000 4.269 4.470 -0.335 0.000 0.327 1 S C 0.000 174.516 174.600 -0.141 0.000 1.055 1 S CA 0.000 58.014 58.200 -0.311 0.000 1.107 1 S CB 0.000 62.862 63.200 -0.564 0.000 0.593 2 Y N -2.905 117.439 120.300 0.073 0.000 3.689 2 Y HA -0.426 4.194 4.550 0.118 0.000 0.221 2 Y C -2.036 173.923 175.900 0.098 0.000 1.247 2 Y CA 0.585 58.742 58.100 0.094 0.000 1.671 2 Y CB -1.406 37.100 38.460 0.077 0.000 1.521 2 Y HN 0.580 8.626 8.280 -0.390 0.000 0.632 3 Q N -0.404 119.497 119.800 0.168 0.000 2.349 3 Q HA 0.171 4.595 4.340 0.141 0.000 0.254 3 Q C -1.984 174.125 176.000 0.182 0.000 0.980 3 Q CA -2.030 53.859 55.803 0.142 0.000 0.924 3 Q CB 0.477 29.265 28.738 0.084 0.000 1.209 3 Q HN -0.356 7.966 8.270 0.112 0.015 0.445 4 P HA 0.201 5.048 4.420 0.380 -0.199 0.271 4 P C -0.692 176.741 177.300 0.223 0.000 1.218 4 P CA -0.738 62.552 63.100 0.316 0.000 0.780 4 P CB 1.170 33.104 31.700 0.389 0.000 0.901 5 T N -2.600 112.080 114.554 0.210 0.000 2.865 5 T HA 0.495 4.926 4.350 0.136 0.000 0.294 5 T C -1.220 173.564 174.700 0.139 0.000 1.119 5 T CA -3.165 59.020 62.100 0.141 0.000 1.007 5 T CB 1.100 70.020 68.868 0.088 0.000 1.225 5 T HN 0.239 8.914 8.240 0.228 -0.298 0.515 6 P HA -0.104 4.439 4.420 0.205 0.000 0.219 6 P C 1.026 178.398 177.300 0.121 0.000 1.146 6 P CA 2.142 65.331 63.100 0.149 0.000 0.808 6 P CB 0.091 31.851 31.700 0.100 0.000 0.779 7 E N -2.082 118.146 120.200 0.046 0.000 2.209 7 E HA -0.320 4.029 4.350 -0.002 0.000 0.196 7 E C 0.749 177.272 176.600 -0.129 0.000 0.993 7 E CA 2.590 58.980 56.400 -0.016 0.000 0.819 7 E CB -0.632 29.062 29.700 -0.011 0.000 0.745 7 E HN -0.344 8.016 8.360 0.051 0.031 0.477 8 D N -4.105 116.182 120.400 -0.187 0.000 2.363 8 D HA -0.081 4.304 4.640 -0.424 0.000 0.220 8 D C -0.088 175.725 176.300 -0.811 0.000 0.994 8 D CA 1.040 54.736 54.000 -0.505 0.000 0.890 8 D CB 0.275 40.726 40.800 -0.582 0.000 0.906 8 D HN -0.426 7.854 8.370 -0.089 0.037 0.530 9 R N -6.795 113.394 120.500 -0.518 0.000 3.872 9 R HA -0.503 3.314 4.340 -0.871 0.000 0.341 9 R C -1.644 174.381 176.300 -0.459 0.000 1.172 9 R CA 0.829 56.537 56.100 -0.653 0.000 0.901 9 R CB -2.804 27.091 30.300 -0.675 0.000 1.422 9 R HN -0.507 7.438 8.270 -0.291 0.151 0.523 10 F N -2.458 117.446 119.950 -0.077 0.000 2.456 10 F HA 0.592 5.391 4.527 -0.258 -0.427 0.358 10 F C 0.604 176.444 175.800 0.066 0.000 1.095 10 F CA -0.727 57.240 58.000 -0.056 0.000 1.216 10 F CB 0.429 39.525 39.000 0.161 0.000 1.125 10 F HN -0.442 7.732 8.300 -0.159 0.031 0.549 11 T N -2.149 112.468 114.554 0.105 0.000 2.901 11 T HA 0.867 5.663 4.350 0.423 -0.192 0.293 11 T C -1.360 173.316 174.700 -0.040 0.000 1.084 11 T CA -2.334 59.908 62.100 0.236 0.000 1.008 11 T CB 3.584 72.641 68.868 0.315 0.000 1.170 11 T HN 0.457 8.636 8.240 -0.103 0.000 0.509 12 F N -1.702 118.401 119.950 0.254 0.000 2.591 12 F HA 0.479 5.095 4.527 -0.119 -0.160 0.309 12 F C 0.399 176.196 175.800 -0.004 0.000 1.098 12 F CA -1.097 56.941 58.000 0.065 0.000 0.937 12 F CB 4.653 43.751 39.000 0.163 0.000 1.250 12 F HN -0.227 8.397 8.300 0.541 0.000 0.447 13 G N 0.056 108.703 108.800 -0.255 0.000 2.483 13 G HA2 0.204 4.123 3.960 -0.322 0.000 0.248 13 G HA3 0.204 2.747 3.960 -2.363 0.000 0.248 13 G C 0.652 175.318 174.900 -0.391 0.000 1.248 13 G CA -0.643 43.958 45.100 -0.833 0.000 0.838 13 G HN 0.024 8.036 8.290 -0.464 0.000 0.566 14 L N 1.717 122.975 121.223 0.058 0.000 2.127 14 L HA -0.221 4.239 4.340 0.200 0.000 0.211 14 L C 1.317 178.310 176.870 0.205 0.000 1.089 14 L CA 2.878 57.852 54.840 0.222 0.000 0.757 14 L CB -0.021 42.242 42.059 0.339 0.000 0.899 14 L HN 0.242 8.613 8.230 0.236 0.000 0.434 15 W N -6.983 114.479 121.300 0.271 0.000 3.077 15 W HA -0.125 4.666 4.660 0.219 0.000 0.245 15 W C -0.338 176.272 176.519 0.152 0.000 1.316 15 W CA -0.271 57.213 57.345 0.232 0.000 1.537 15 W CB -1.272 28.360 29.460 0.288 0.000 1.131 15 W HN -0.103 8.300 8.180 0.427 0.033 0.695 16 T N -2.462 111.860 114.554 -0.386 0.000 2.764 16 T HA -0.054 4.160 4.350 -0.376 -0.089 0.243 16 T C 2.454 176.967 174.700 -0.311 0.000 1.065 16 T CA 1.293 63.145 62.100 -0.414 0.000 1.219 16 T CB 1.522 70.148 68.868 -0.404 0.000 0.918 16 T HN -0.677 7.092 8.240 -0.478 0.184 0.409 17 V N -2.487 117.286 119.914 -0.236 0.000 2.720 17 V HA -0.232 3.660 4.120 -0.380 0.000 0.256 17 V C 0.908 176.896 176.094 -0.177 0.000 1.082 17 V CA 1.800 63.932 62.300 -0.279 0.000 1.101 17 V CB -1.368 30.282 31.823 -0.287 0.000 0.693 17 V HN -0.146 7.960 8.190 -0.141 0.000 0.479 18 G N -2.832 105.963 108.800 -0.009 0.000 2.920 18 G HA2 -0.125 3.851 3.960 0.028 0.000 0.208 18 G HA3 -0.125 4.030 3.960 0.131 -0.116 0.208 18 G C -0.516 174.468 174.900 0.140 0.000 1.159 18 G CA -0.754 44.390 45.100 0.074 0.000 0.784 18 G HN -0.755 7.507 8.290 0.008 0.032 0.535 19 W N 2.148 123.413 121.300 -0.058 0.000 2.322 19 W HA -0.131 4.552 4.660 0.039 0.000 0.328 19 W C -0.004 176.486 176.519 -0.047 0.000 1.395 19 W CA 0.005 57.336 57.345 -0.024 0.000 1.267 19 W CB 0.432 29.860 29.460 -0.054 0.000 1.259 19 W HN -0.466 7.671 8.180 0.213 0.171 0.560 20 Q N 8.315 127.874 119.800 -0.402 0.000 2.451 20 Q HA -0.139 4.002 4.340 -0.331 0.000 0.206 20 Q C 0.311 175.822 176.000 -0.815 0.000 0.947 20 Q CA 1.535 57.058 55.803 -0.466 0.000 0.937 20 Q CB 0.248 28.833 28.738 -0.254 0.000 1.025 20 Q HN 0.291 8.408 8.270 -0.254 0.000 0.511 21 G N -3.420 104.274 108.800 -1.844 0.000 2.157 21 G HA2 -0.432 1.504 3.960 -3.373 0.000 0.239 21 G HA3 -0.432 2.841 3.960 -1.145 0.000 0.239 21 G C -1.397 172.944 174.900 -0.933 0.000 0.982 21 G CA -0.106 43.861 45.100 -1.890 0.000 0.650 21 G HN 0.173 6.767 8.290 -2.744 0.050 0.527 22 R N -0.035 120.133 120.500 -0.554 0.000 2.442 22 R HA 0.148 4.575 4.340 -0.117 -0.157 0.291 22 R C -1.262 175.153 176.300 0.191 0.000 1.069 22 R CA 0.498 56.535 56.100 -0.105 0.000 1.022 22 R CB 0.598 30.879 30.300 -0.032 0.000 0.976 22 R HN -0.268 7.604 8.270 -0.664 0.000 0.443 23 D N 3.271 123.755 120.400 0.140 0.000 2.614 23 D HA 0.344 5.137 4.640 0.255 0.000 0.264 23 D C -0.730 175.568 176.300 -0.004 0.000 1.092 23 D CA -2.355 51.757 54.000 0.186 0.000 1.071 23 D CB 0.271 41.234 40.800 0.273 0.000 1.443 23 D HN -0.114 8.290 8.370 0.057 0.000 0.528 24 P HA -0.036 4.174 4.420 -0.350 0.000 0.228 24 P C -0.624 176.194 177.300 -0.803 0.000 1.151 24 P CA 1.723 64.520 63.100 -0.505 0.000 0.770 24 P CB 0.220 31.483 31.700 -0.728 0.000 0.786 25 F N -3.361 116.583 119.950 -0.011 0.000 2.791 25 F HA 0.281 4.798 4.527 -0.017 0.000 0.316 25 F C -0.566 175.224 175.800 -0.017 0.000 1.134 25 F CA -0.395 57.593 58.000 -0.019 0.000 1.222 25 F CB 1.194 40.174 39.000 -0.034 0.000 1.034 25 F HN -0.470 8.015 8.300 -0.038 -0.207 0.516 26 G N -0.114 108.726 108.800 0.066 0.000 2.759 26 G HA2 0.119 4.103 3.960 0.041 0.000 0.297 26 G HA3 0.119 4.106 3.960 0.046 0.000 0.297 26 G C -2.187 172.704 174.900 -0.015 0.000 1.434 26 G CA -0.210 44.912 45.100 0.037 0.000 0.980 26 G HN -0.805 7.487 8.290 0.012 0.005 0.531 27 D N 1.002 121.383 120.400 -0.032 0.000 2.377 27 D HA 0.017 4.623 4.640 -0.056 0.000 0.245 27 D C 0.062 176.298 176.300 -0.108 0.000 1.196 27 D CA -0.168 53.797 54.000 -0.059 0.000 0.962 27 D CB 1.677 42.450 40.800 -0.046 0.000 1.127 27 D HN 0.065 8.423 8.370 -0.020 0.000 0.471 28 A N -0.370 122.371 122.820 -0.131 0.000 2.531 28 A HA -0.122 4.115 4.320 -0.291 -0.091 0.236 28 A C 0.653 178.131 177.584 -0.177 0.000 1.062 28 A CA 1.571 53.487 52.037 -0.200 0.000 0.760 28 A CB 0.014 18.914 19.000 -0.166 0.000 0.995 28 A HN 0.388 8.475 8.150 -0.104 0.000 0.501 29 T N -2.264 112.151 114.554 -0.233 0.000 3.023 29 T HA 0.112 4.385 4.350 -0.129 0.000 0.253 29 T C 0.476 175.081 174.700 -0.159 0.000 1.038 29 T CA -0.371 61.625 62.100 -0.173 0.000 0.962 29 T CB 0.917 69.684 68.868 -0.169 0.000 1.018 29 T HN 0.369 8.414 8.240 -0.325 0.000 0.521 30 R N 0.693 121.079 120.500 -0.190 0.000 2.771 30 R HA 0.457 4.730 4.340 -0.112 0.000 0.274 30 R C -2.948 173.281 176.300 -0.117 0.000 0.987 30 R CA -2.460 53.553 56.100 -0.146 0.000 0.908 30 R CB 2.120 32.316 30.300 -0.173 0.000 1.213 30 R HN -0.628 7.500 8.270 -0.236 0.000 0.468 31 P HA 0.058 4.451 4.420 -0.044 0.000 0.274 31 P C -1.044 176.238 177.300 -0.031 0.000 1.237 31 P CA -0.664 62.411 63.100 -0.042 0.000 0.793 31 P CB 0.417 32.107 31.700 -0.016 0.000 0.977 32 A N 0.643 123.459 122.820 -0.007 0.000 2.531 32 A HA -0.101 4.230 4.320 0.018 0.000 0.236 32 A C 0.429 178.040 177.584 0.045 0.000 1.062 32 A CA 0.513 52.563 52.037 0.023 0.000 0.760 32 A CB 0.664 19.688 19.000 0.040 0.000 0.995 32 A HN 0.070 8.216 8.150 -0.006 0.000 0.501 33 L N 1.997 123.261 121.223 0.068 0.000 2.309 33 L HA 0.073 4.474 4.340 0.102 0.000 0.282 33 L C -0.267 176.677 176.870 0.123 0.000 1.036 33 L CA -0.855 54.047 54.840 0.104 0.000 0.806 33 L CB 1.040 43.175 42.059 0.126 0.000 1.220 33 L HN 0.282 8.553 8.230 0.069 0.000 0.429 34 D N 4.583 125.061 120.400 0.128 0.000 2.383 34 D HA 0.163 4.881 4.640 0.131 0.000 0.252 34 D C -0.441 175.956 176.300 0.161 0.000 1.166 34 D CA -2.856 51.224 54.000 0.134 0.000 0.879 34 D CB 1.332 42.201 40.800 0.116 0.000 1.164 34 D HN 0.129 8.574 8.370 0.125 0.000 0.462 35 P HA -0.251 4.296 4.420 0.211 0.000 0.217 35 P C 1.010 178.472 177.300 0.270 0.000 1.151 35 P CA 1.989 65.212 63.100 0.205 0.000 0.849 35 P CB 0.229 31.988 31.700 0.099 0.000 0.787 36 V N -3.649 116.399 119.914 0.223 0.000 2.343 36 V HA -0.451 3.785 4.120 0.193 0.000 0.247 36 V C 1.896 178.062 176.094 0.119 0.000 1.051 36 V CA 4.409 66.811 62.300 0.171 0.000 1.036 36 V CB -0.694 31.203 31.823 0.122 0.000 0.654 36 V HN -0.247 8.316 8.190 0.199 -0.253 0.451 37 E N 0.231 120.503 120.200 0.121 0.000 2.077 37 E HA -0.258 4.122 4.350 0.050 0.000 0.193 37 E C 2.397 179.059 176.600 0.103 0.000 0.989 37 E CA 2.873 59.332 56.400 0.099 0.000 0.800 37 E CB -0.703 29.080 29.700 0.138 0.000 0.746 37 E HN -0.473 7.967 8.360 0.133 0.000 0.452 38 T N 2.826 117.503 114.554 0.205 0.000 2.684 38 T HA -0.387 4.188 4.350 0.375 0.000 0.267 38 T C 2.142 176.918 174.700 0.125 0.000 1.036 38 T CA 4.913 67.169 62.100 0.261 0.000 1.148 38 T CB -0.135 68.921 68.868 0.314 0.000 0.863 38 T HN -0.529 7.843 8.240 0.220 0.000 0.436 39 V N 0.882 120.882 119.914 0.143 0.000 2.287 39 V HA -0.476 3.709 4.120 0.109 0.000 0.248 39 V C 1.830 177.915 176.094 -0.014 0.000 1.053 39 V CA 4.307 66.657 62.300 0.082 0.000 1.027 39 V CB -0.948 30.916 31.823 0.069 0.000 0.646 39 V HN -0.177 8.127 8.190 0.189 0.000 0.447 40 Q N -1.487 118.288 119.800 -0.041 0.000 2.079 40 Q HA -0.393 3.901 4.340 -0.077 0.000 0.200 40 Q C 2.870 178.753 176.000 -0.194 0.000 0.974 40 Q CA 3.654 59.401 55.803 -0.094 0.000 0.840 40 Q CB -0.186 28.508 28.738 -0.074 0.000 0.898 40 Q HN -0.391 7.875 8.270 -0.008 0.000 0.430 41 R N -0.925 119.373 120.500 -0.337 0.000 2.075 41 R HA -0.190 3.809 4.340 -0.569 0.000 0.232 41 R C 2.636 178.608 176.300 -0.547 0.000 1.126 41 R CA 2.068 57.759 56.100 -0.682 0.000 0.963 41 R CB -0.179 29.205 30.300 -1.526 0.000 0.858 41 R HN -0.088 8.015 8.270 -0.277 0.000 0.435 42 L N -1.391 119.622 121.223 -0.350 0.000 2.093 42 L HA -0.303 3.906 4.340 -0.218 0.000 0.208 42 L C 1.781 178.613 176.870 -0.063 0.000 1.085 42 L CA 2.849 57.590 54.840 -0.165 0.000 0.755 42 L CB -0.575 41.471 42.059 -0.022 0.000 0.904 42 L HN 0.019 8.075 8.230 -0.291 0.000 0.435 43 A N -0.918 121.869 122.820 -0.056 0.000 1.883 43 A HA -0.322 4.010 4.320 0.022 0.000 0.217 43 A C 2.536 180.096 177.584 -0.041 0.000 1.186 43 A CA 2.833 54.856 52.037 -0.023 0.000 0.624 43 A CB -0.889 18.089 19.000 -0.037 0.000 0.822 43 A HN -0.193 7.912 8.150 -0.074 0.000 0.444 44 E N -0.367 119.773 120.200 -0.100 0.000 2.153 44 E HA -0.256 4.056 4.350 -0.065 0.000 0.194 44 E C 1.691 178.249 176.600 -0.070 0.000 0.988 44 E CA 2.301 58.644 56.400 -0.096 0.000 0.811 44 E CB 0.003 29.614 29.700 -0.150 0.000 0.746 44 E HN -0.578 7.697 8.360 -0.141 0.000 0.466 45 L N -4.773 116.401 121.223 -0.081 0.000 2.552 45 L HA -0.060 4.265 4.340 -0.025 0.000 0.227 45 L C 0.204 177.108 176.870 0.056 0.000 1.146 45 L CA 0.319 55.143 54.840 -0.025 0.000 0.858 45 L CB 0.571 42.600 42.059 -0.049 0.000 0.969 45 L HN -0.679 7.363 8.230 -0.124 0.114 0.451 46 G N -4.456 104.392 108.800 0.080 0.000 2.163 46 G HA2 -0.301 3.729 3.960 0.117 0.000 0.213 46 G HA3 -0.301 3.915 3.960 0.165 -0.157 0.213 46 G C -1.001 174.046 174.900 0.245 0.000 0.991 46 G CA -0.403 44.786 45.100 0.148 0.000 0.653 46 G HN -0.562 7.581 8.290 0.047 0.175 0.518 47 A N -0.346 122.632 122.820 0.264 0.000 2.406 47 A HA -0.043 4.590 4.320 0.522 0.000 0.243 47 A C -0.929 176.836 177.584 0.302 0.000 1.082 47 A CA 0.144 52.416 52.037 0.392 0.000 0.786 47 A CB 1.013 20.281 19.000 0.446 0.000 1.029 47 A HN -0.639 7.627 8.150 0.193 0.000 0.495 48 H N 0.658 119.858 119.070 0.217 0.000 2.451 48 H HA -0.009 4.598 4.556 0.085 0.000 0.294 48 H C -0.255 175.146 175.328 0.121 0.000 1.028 48 H CA 2.258 58.376 56.048 0.118 0.000 1.349 48 H CB 2.208 32.004 29.762 0.056 0.000 1.444 48 H HN 0.489 9.056 8.280 0.478 0.000 0.538 49 G N -5.485 103.495 108.800 0.299 0.000 2.489 49 G HA2 0.308 4.369 3.960 0.126 0.000 0.305 49 G HA3 0.308 4.472 3.960 0.239 -0.061 0.305 49 G C -3.457 171.647 174.900 0.341 0.000 1.311 49 G CA 0.352 45.592 45.100 0.233 0.000 0.813 49 G HN -0.740 7.790 8.290 0.399 0.000 0.480 50 V N -1.065 119.044 119.914 0.325 0.000 3.078 50 V HA 1.044 5.609 4.120 0.424 -0.191 0.311 50 V C -2.256 174.091 176.094 0.422 0.000 1.138 50 V CA -3.547 58.991 62.300 0.397 0.000 1.007 50 V CB 4.474 36.535 31.823 0.396 0.000 1.045 50 V HN 0.428 8.786 8.190 0.278 0.000 0.432 51 T N -0.856 113.960 114.554 0.437 0.000 2.901 51 T HA 0.782 5.503 4.350 0.425 -0.116 0.293 51 T C -1.638 173.416 174.700 0.590 0.000 1.084 51 T CA -2.699 59.656 62.100 0.424 0.000 1.008 51 T CB 3.007 72.027 68.868 0.253 0.000 1.170 51 T HN 0.095 8.579 8.240 0.408 0.000 0.509 52 F N -3.376 116.788 119.950 0.358 0.000 2.641 52 F HA 0.537 5.418 4.527 0.589 0.000 0.308 52 F C -2.586 173.300 175.800 0.143 0.000 1.105 52 F CA -1.775 56.443 58.000 0.363 0.000 0.964 52 F CB 2.160 41.266 39.000 0.177 0.000 1.294 52 F HN -0.158 8.185 8.300 0.072 0.000 0.442 53 H N 2.177 121.406 119.070 0.266 0.000 2.562 53 H HA 0.471 5.110 4.556 -0.107 -0.147 0.352 53 H C 2.133 177.649 175.328 0.313 0.000 1.125 53 H CA 0.313 56.400 56.048 0.066 0.000 1.379 53 H CB 1.167 30.933 29.762 0.006 0.000 1.464 53 H HN 0.079 9.018 8.280 0.567 -0.319 0.563 54 D N 2.706 123.323 120.400 0.362 0.000 2.192 54 D HA -0.464 4.489 4.640 0.522 0.000 0.189 54 D C 1.443 177.903 176.300 0.267 0.000 1.007 54 D CA 3.330 57.553 54.000 0.371 0.000 0.859 54 D CB -0.680 40.267 40.800 0.245 0.000 0.936 54 D HN 0.006 8.515 8.370 0.232 0.000 0.447 55 D N -2.294 118.234 120.400 0.214 0.000 2.363 55 D HA 0.023 4.971 4.640 0.128 -0.231 0.220 55 D C 1.318 177.697 176.300 0.132 0.000 0.994 55 D CA 1.562 55.651 54.000 0.149 0.000 0.890 55 D CB -0.639 40.247 40.800 0.143 0.000 0.906 55 D HN 0.244 8.730 8.370 0.215 0.013 0.530 56 D N -0.707 119.822 120.400 0.216 0.000 2.194 56 D HA -0.133 4.618 4.640 0.186 0.000 0.204 56 D C 0.898 177.243 176.300 0.075 0.000 0.964 56 D CA 2.071 56.201 54.000 0.216 0.000 0.846 56 D CB 0.192 41.239 40.800 0.413 0.000 0.962 56 D HN -0.329 8.068 8.370 0.300 0.153 0.490 57 L N -1.898 119.331 121.223 0.009 0.000 2.168 57 L HA -0.038 4.125 4.340 -0.295 0.000 0.203 57 L C -1.305 175.430 176.870 -0.224 0.000 1.078 57 L CA 0.846 55.543 54.840 -0.238 0.000 0.780 57 L CB 1.916 43.658 42.059 -0.530 0.000 0.939 57 L HN -0.699 7.605 8.230 0.123 0.000 0.451 58 I N -3.913 116.558 120.570 -0.164 0.000 2.410 58 I HA 0.372 4.229 4.170 -0.522 0.000 0.286 58 I C -2.782 173.222 176.117 -0.188 0.000 1.009 58 I CA -3.258 57.886 61.300 -0.259 0.000 1.111 58 I CB 1.722 39.661 38.000 -0.101 0.000 1.262 58 I HN -0.462 7.711 8.210 -0.062 0.000 0.443 59 P HA -0.015 4.402 4.420 -0.005 0.000 0.264 59 P C -0.276 177.036 177.300 0.020 0.000 1.183 59 P CA -0.484 62.577 63.100 -0.065 0.000 0.763 59 P CB 0.293 31.954 31.700 -0.064 0.000 0.807 60 F N 5.794 125.746 119.950 0.004 0.000 2.629 60 F HA -0.420 4.134 4.527 0.045 0.000 0.377 60 F C 1.433 177.260 175.800 0.046 0.000 1.101 60 F CA 1.906 59.933 58.000 0.044 0.000 1.301 60 F CB 0.444 39.497 39.000 0.088 0.000 1.062 60 F HN 0.384 8.844 8.300 0.265 0.000 0.583 61 G N 5.810 114.150 108.800 -0.768 0.000 2.148 61 G HA2 -0.510 3.117 3.960 -0.555 0.000 0.254 61 G HA3 -0.510 3.309 3.960 -0.236 0.000 0.254 61 G C -0.318 174.484 174.900 -0.163 0.000 0.981 61 G CA -0.162 44.680 45.100 -0.430 0.000 0.670 61 G HN 0.382 7.994 8.290 -1.130 0.000 0.528 62 S N 1.898 117.522 115.700 -0.127 0.000 2.572 62 S HA 0.003 4.607 4.470 -0.005 -0.137 0.279 62 S C 0.217 174.798 174.600 -0.032 0.000 1.341 62 S CA 1.438 59.615 58.200 -0.040 0.000 1.043 62 S CB 1.230 64.421 63.200 -0.014 0.000 0.887 62 S HN -0.628 7.533 8.310 -0.167 0.048 0.516 63 S N 4.011 119.714 115.700 0.005 0.000 2.624 63 S HA 0.090 4.554 4.470 -0.010 0.000 0.263 63 S C 1.079 175.690 174.600 0.018 0.000 1.287 63 S CA -0.536 57.666 58.200 0.005 0.000 0.990 63 S CB 1.312 64.521 63.200 0.014 0.000 0.950 63 S HN 0.261 8.956 8.310 0.022 -0.372 0.561 64 D N 1.137 121.546 120.400 0.015 0.000 2.144 64 D HA -0.263 4.391 4.640 0.024 0.000 0.199 64 D C 2.254 178.574 176.300 0.034 0.000 0.984 64 D CA 3.742 57.756 54.000 0.024 0.000 0.834 64 D CB -0.283 40.530 40.800 0.020 0.000 0.955 64 D HN 0.512 8.888 8.370 0.010 0.000 0.465 65 T N 2.304 116.876 114.554 0.031 0.000 2.708 65 T HA -0.352 4.015 4.350 0.028 0.000 0.266 65 T C 1.928 176.654 174.700 0.043 0.000 1.037 65 T CA 4.574 66.693 62.100 0.031 0.000 1.146 65 T CB 0.002 68.883 68.868 0.022 0.000 0.865 65 T HN -0.396 7.860 8.240 0.026 0.000 0.435 66 E N 0.879 121.116 120.200 0.062 0.000 2.051 66 E HA -0.400 3.992 4.350 0.070 0.000 0.192 66 E C 2.004 178.725 176.600 0.202 0.000 0.991 66 E CA 3.251 59.719 56.400 0.114 0.000 0.799 66 E CB -0.341 29.444 29.700 0.141 0.000 0.748 66 E HN -0.728 7.664 8.360 0.054 0.000 0.449 67 R N -0.371 120.212 120.500 0.139 0.000 2.094 67 R HA -0.486 3.942 4.340 0.147 0.000 0.239 67 R C 1.925 178.297 176.300 0.119 0.000 1.137 67 R CA 3.722 59.896 56.100 0.124 0.000 0.943 67 R CB -0.076 30.260 30.300 0.059 0.000 0.850 67 R HN 0.257 8.584 8.270 0.095 0.000 0.433 68 E N -1.611 118.637 120.200 0.080 0.000 2.085 68 E HA -0.311 4.079 4.350 0.066 0.000 0.194 68 E C 2.222 178.855 176.600 0.056 0.000 0.994 68 E CA 3.191 59.628 56.400 0.063 0.000 0.801 68 E CB -0.535 29.191 29.700 0.044 0.000 0.743 68 E HN -0.524 7.878 8.360 0.069 0.000 0.453 69 S N 0.106 115.826 115.700 0.033 0.000 2.359 69 S HA -0.318 4.142 4.470 -0.016 0.000 0.224 69 S C 2.333 176.912 174.600 -0.034 0.000 1.035 69 S CA 3.358 61.543 58.200 -0.026 0.000 1.018 69 S CB -0.256 62.886 63.200 -0.097 0.000 0.876 69 S HN -0.416 7.917 8.310 0.039 0.000 0.448 70 H N 0.940 120.024 119.070 0.023 0.000 2.353 70 H HA -0.248 4.325 4.556 0.028 0.000 0.300 70 H C 2.824 178.171 175.328 0.032 0.000 1.090 70 H CA 3.942 60.001 56.048 0.018 0.000 1.327 70 H CB 0.164 29.921 29.762 -0.008 0.000 1.383 70 H HN -0.368 7.978 8.280 0.110 0.000 0.508 71 I N -0.569 120.093 120.570 0.152 0.000 2.202 71 I HA -0.526 3.724 4.170 0.134 0.000 0.242 71 I C 1.263 177.466 176.117 0.144 0.000 1.091 71 I CA 4.055 65.433 61.300 0.130 0.000 1.368 71 I CB -0.120 37.936 38.000 0.094 0.000 1.058 71 I HN -0.121 8.168 8.210 0.152 0.012 0.410 72 K N 0.015 120.471 120.400 0.092 0.000 2.032 72 K HA -0.441 3.915 4.320 0.060 0.000 0.209 72 K C 2.287 178.929 176.600 0.070 0.000 1.048 72 K CA 3.887 60.213 56.287 0.065 0.000 0.927 72 K CB -0.282 32.239 32.500 0.036 0.000 0.712 72 K HN -0.084 8.214 8.250 0.079 0.000 0.441 73 R N -2.727 117.819 120.500 0.076 0.000 2.096 73 R HA -0.285 4.237 4.340 0.048 -0.153 0.235 73 R C 2.586 178.970 176.300 0.141 0.000 1.127 73 R CA 3.187 59.335 56.100 0.079 0.000 0.968 73 R CB -0.255 30.080 30.300 0.058 0.000 0.861 73 R HN -0.498 7.810 8.270 0.064 0.000 0.440 74 F N 0.863 120.816 119.950 0.005 0.000 2.128 74 F HA -0.314 4.219 4.527 0.011 0.000 0.295 74 F C 0.962 176.757 175.800 -0.008 0.000 1.100 74 F CA 2.536 60.534 58.000 -0.002 0.000 1.260 74 F CB 0.076 39.059 39.000 -0.030 0.000 1.009 74 F HN -0.677 7.773 8.300 0.286 0.021 0.476 75 R N -0.474 120.027 120.500 0.002 0.000 2.105 75 R HA -0.550 3.649 4.340 -0.235 0.000 0.239 75 R C 2.011 178.248 176.300 -0.104 0.000 1.135 75 R CA 3.860 59.894 56.100 -0.111 0.000 0.967 75 R CB -0.223 30.071 30.300 -0.011 0.000 0.861 75 R HN 0.142 8.498 8.270 0.144 0.000 0.442 76 Q N -1.553 118.222 119.800 -0.042 0.000 2.124 76 Q HA -0.293 4.023 4.340 -0.040 0.000 0.202 76 Q C 2.444 178.408 176.000 -0.059 0.000 0.977 76 Q CA 3.031 58.811 55.803 -0.038 0.000 0.850 76 Q CB -0.254 28.478 28.738 -0.009 0.000 0.901 76 Q HN -0.161 8.105 8.270 -0.006 0.000 0.429 77 A N 0.077 122.856 122.820 -0.068 0.000 1.898 77 A HA -0.225 4.065 4.320 -0.050 0.000 0.216 77 A C 1.822 179.324 177.584 -0.137 0.000 1.181 77 A CA 2.863 54.854 52.037 -0.076 0.000 0.620 77 A CB -0.438 18.544 19.000 -0.030 0.000 0.819 77 A HN -0.522 7.519 8.150 -0.050 0.079 0.442 78 L N -1.961 119.116 121.223 -0.244 0.000 2.012 78 L HA -0.401 3.803 4.340 -0.228 0.000 0.210 78 L C 2.465 179.245 176.870 -0.151 0.000 1.073 78 L CA 2.874 57.563 54.840 -0.251 0.000 0.748 78 L CB -0.414 41.420 42.059 -0.374 0.000 0.891 78 L HN -0.080 7.964 8.230 -0.310 0.000 0.431 79 D N -1.900 118.426 120.400 -0.124 0.000 2.144 79 D HA -0.226 4.364 4.640 -0.084 0.000 0.200 79 D C 1.590 177.850 176.300 -0.068 0.000 0.978 79 D CA 2.727 56.677 54.000 -0.084 0.000 0.833 79 D CB -0.374 40.387 40.800 -0.064 0.000 0.961 79 D HN -0.213 8.076 8.370 -0.135 0.000 0.470 80 A N -1.883 120.898 122.820 -0.065 0.000 1.930 80 A HA -0.092 4.203 4.320 -0.042 0.000 0.217 80 A C 1.492 179.046 177.584 -0.051 0.000 1.175 80 A CA 2.400 54.407 52.037 -0.050 0.000 0.627 80 A CB 0.153 19.128 19.000 -0.042 0.000 0.815 80 A HN -0.377 7.714 8.150 -0.072 0.016 0.443 81 T N -6.505 108.012 114.554 -0.062 0.000 3.037 81 T HA 0.044 4.365 4.350 -0.049 0.000 0.251 81 T C 1.269 175.932 174.700 -0.061 0.000 1.079 81 T CA -0.411 61.655 62.100 -0.057 0.000 1.067 81 T CB 1.023 69.855 68.868 -0.059 0.000 0.948 81 T HN -0.642 7.554 8.240 -0.073 0.000 0.496 82 G N 2.584 111.339 108.800 -0.074 0.000 2.148 82 G HA2 -0.278 3.630 3.960 -0.086 0.000 0.254 82 G HA3 -0.278 3.637 3.960 -0.075 0.000 0.254 82 G C -0.077 174.753 174.900 -0.116 0.000 0.981 82 G CA 0.272 45.320 45.100 -0.086 0.000 0.670 82 G HN -0.374 7.870 8.290 -0.077 0.000 0.528 83 M N 0.462 119.995 119.600 -0.111 0.000 2.238 83 M HA -0.038 4.675 4.480 -0.127 -0.309 0.347 83 M C 0.115 176.333 176.300 -0.137 0.000 1.173 83 M CA 0.447 55.679 55.300 -0.112 0.000 1.147 83 M CB 0.573 33.135 32.600 -0.063 0.000 1.547 83 M HN -0.751 7.418 8.290 -0.099 0.062 0.455 84 T N -3.639 110.826 114.554 -0.149 0.000 2.948 84 T HA 0.272 4.571 4.350 -0.084 0.000 0.285 84 T C -1.244 173.485 174.700 0.048 0.000 1.019 84 T CA -2.220 59.827 62.100 -0.089 0.000 1.013 84 T CB 2.880 71.648 68.868 -0.167 0.000 1.117 84 T HN 0.207 8.339 8.240 -0.180 0.000 0.533 85 V N 1.211 121.186 119.914 0.101 0.000 2.320 85 V HA 0.780 5.539 4.120 0.257 -0.485 0.268 85 V C -1.818 174.383 176.094 0.178 0.000 1.021 85 V CA -3.904 58.524 62.300 0.212 0.000 0.813 85 V CB -0.014 31.993 31.823 0.308 0.000 1.054 85 V HN 0.617 8.847 8.190 0.068 0.000 0.444 86 P HA 0.132 4.616 4.420 0.106 0.000 0.240 86 P C -1.452 175.883 177.300 0.058 0.000 1.190 86 P CA 0.439 63.615 63.100 0.127 0.000 0.781 86 P CB 0.795 32.593 31.700 0.163 0.000 0.931 87 M N -2.497 117.112 119.600 0.014 0.000 2.465 87 M HA 0.743 5.351 4.480 -0.166 -0.228 0.284 87 M C -2.998 173.166 176.300 -0.227 0.000 1.212 87 M CA -1.156 54.039 55.300 -0.175 0.000 0.910 87 M CB 4.140 36.468 32.600 -0.453 0.000 1.725 87 M HN -0.690 7.597 8.290 0.079 0.051 0.477 88 A N 1.658 124.226 122.820 -0.420 0.000 2.564 88 A HA 0.941 4.928 4.320 -0.738 -0.110 0.288 88 A C -2.352 174.614 177.584 -1.029 0.000 1.164 88 A CA -1.179 50.404 52.037 -0.756 0.000 0.712 88 A CB 4.003 22.433 19.000 -0.949 0.000 1.303 88 A HN 0.131 8.048 8.150 -0.388 0.000 0.418 89 T N -1.450 112.505 114.554 -0.998 0.000 2.739 89 T HA 0.472 4.083 4.350 -1.386 -0.093 0.303 89 T C -1.506 172.995 174.700 -0.333 0.000 1.389 89 T CA -1.461 60.118 62.100 -0.868 0.000 1.001 89 T CB 1.442 69.937 68.868 -0.621 0.000 1.436 89 T HN 0.275 7.958 8.240 -0.928 0.000 0.500 90 T N 2.951 117.492 114.554 -0.022 0.000 2.859 90 T HA 0.224 4.661 4.350 0.145 0.000 0.281 90 T C -1.509 173.272 174.700 0.135 0.000 1.005 90 T CA -0.194 61.981 62.100 0.125 0.000 1.025 90 T CB 1.295 70.248 68.868 0.141 0.000 0.977 90 T HN 0.273 8.495 8.240 -0.031 0.000 0.458 91 N N 4.880 123.587 118.700 0.012 0.000 2.439 91 N HA 0.032 4.513 4.740 -0.433 0.000 0.243 91 N C -1.152 174.068 175.510 -0.484 0.000 1.088 91 N CA -0.550 52.265 53.050 -0.391 0.000 0.940 91 N CB -0.335 37.819 38.487 -0.556 0.000 1.180 91 N HN 0.385 9.145 8.380 0.047 -0.351 0.505 92 L N 4.524 125.435 121.223 -0.520 0.000 3.094 92 L HA 0.178 3.551 4.340 -1.612 0.000 0.254 92 L C -1.379 175.145 176.870 -0.577 0.000 1.298 92 L CA -0.385 53.869 54.840 -0.977 0.000 1.050 92 L CB -0.991 40.509 42.059 -0.931 0.000 1.420 92 L HN -0.132 7.957 8.230 -0.235 0.000 0.548 93 F N -6.731 113.103 119.950 -0.193 0.000 2.839 93 F HA 0.498 4.987 4.527 -0.064 0.000 0.355 93 F C 0.064 175.916 175.800 0.088 0.000 0.904 93 F CA -0.241 57.731 58.000 -0.047 0.000 1.098 93 F CB 0.779 39.741 39.000 -0.064 0.000 0.982 93 F HN -0.105 7.953 8.300 -0.802 -0.239 0.600 94 T N 2.816 117.259 114.554 -0.186 0.000 2.809 94 T HA -0.232 4.188 4.350 0.117 0.000 0.260 94 T C 0.157 174.851 174.700 -0.010 0.000 1.039 94 T CA 4.400 66.482 62.100 -0.029 0.000 1.141 94 T CB 0.260 69.019 68.868 -0.181 0.000 0.869 94 T HN -0.340 7.864 8.240 -0.624 -0.339 0.437 95 H N 2.554 121.567 119.070 -0.094 0.000 2.815 95 H HA 0.048 4.427 4.556 -0.294 0.000 0.350 95 H C -0.351 174.872 175.328 -0.175 0.000 1.080 95 H CA -0.882 55.017 56.048 -0.248 0.000 1.433 95 H CB 1.643 31.112 29.762 -0.488 0.000 1.432 95 H HN -0.241 8.121 8.280 0.137 0.000 0.592 96 P HA -0.234 4.123 4.420 -0.105 0.000 0.221 96 P C 0.753 178.013 177.300 -0.066 0.000 1.145 96 P CA 1.863 64.863 63.100 -0.167 0.000 0.795 96 P CB -0.004 31.550 31.700 -0.243 0.000 0.775 97 V N -1.056 118.851 119.914 -0.012 0.000 2.469 97 V HA -0.333 3.691 4.120 -0.159 0.000 0.251 97 V C 0.801 176.728 176.094 -0.278 0.000 1.064 97 V CA 3.081 65.234 62.300 -0.245 0.000 1.066 97 V CB -0.276 31.229 31.823 -0.530 0.000 0.667 97 V HN -0.671 7.671 8.190 0.325 0.042 0.461 98 F N -4.559 115.426 119.950 0.058 0.000 2.693 98 F HA 0.232 4.926 4.527 0.018 -0.156 0.303 98 F C 1.409 177.204 175.800 -0.009 0.000 1.143 98 F CA -1.562 56.448 58.000 0.016 0.000 1.389 98 F CB -1.857 37.142 39.000 -0.001 0.000 1.060 98 F HN -0.468 7.701 8.300 -0.164 0.032 0.535 99 K N -0.556 119.904 120.400 0.100 0.000 2.211 99 K HA -0.301 4.051 4.320 0.054 0.000 0.204 99 K C 0.316 176.938 176.600 0.036 0.000 1.047 99 K CA 3.058 59.374 56.287 0.050 0.000 0.935 99 K CB -0.517 31.987 32.500 0.006 0.000 0.728 99 K HN -0.655 7.535 8.250 0.051 0.090 0.452 100 D N -1.507 118.920 120.400 0.046 0.000 2.440 100 D HA 0.131 4.775 4.640 0.006 0.000 0.216 100 D C -0.882 175.435 176.300 0.028 0.000 1.150 100 D CA -1.217 52.798 54.000 0.025 0.000 0.832 100 D CB 1.166 41.977 40.800 0.019 0.000 0.992 100 D HN -0.314 8.067 8.370 0.062 0.026 0.502 101 G N -2.121 106.712 108.800 0.055 0.000 2.392 101 G HA2 -0.216 3.873 3.960 -0.061 0.000 0.677 101 G HA3 -0.216 3.820 3.960 -0.003 -0.078 0.677 101 G C -1.406 173.567 174.900 0.121 0.000 1.334 101 G CA -0.828 44.281 45.100 0.015 0.000 0.961 101 G HN -0.537 7.565 8.290 0.092 0.243 0.616 102 G N -1.266 107.497 108.800 -0.060 0.000 2.571 102 G HA2 0.369 4.458 3.960 0.214 0.000 0.225 102 G HA3 0.369 4.074 3.960 -0.425 0.000 0.225 102 G C 1.001 175.955 174.900 0.090 0.000 1.731 102 G CA 0.315 45.371 45.100 -0.073 0.000 0.858 102 G HN 0.209 8.894 8.290 -0.185 -0.506 0.611 103 F N -1.309 118.575 119.950 -0.110 0.000 2.333 103 F HA -0.082 4.387 4.527 -0.098 0.000 0.300 103 F C 0.838 176.600 175.800 -0.063 0.000 1.083 103 F CA 0.391 58.322 58.000 -0.115 0.000 1.395 103 F CB -0.109 38.763 39.000 -0.213 0.000 1.056 103 F HN -0.172 7.908 8.300 -0.367 0.000 0.529 104 T N -7.763 106.861 114.554 0.116 0.000 3.182 104 T HA 0.094 4.488 4.350 0.073 0.000 0.277 104 T C -0.519 174.209 174.700 0.047 0.000 1.013 104 T CA -1.947 60.191 62.100 0.063 0.000 0.900 104 T CB 1.234 70.118 68.868 0.026 0.000 1.098 104 T HN -0.356 8.155 8.240 0.067 -0.231 0.543 105 A N 1.284 124.147 122.820 0.071 0.000 2.561 105 A HA -0.303 4.260 4.320 0.053 -0.211 0.234 105 A C 0.340 177.955 177.584 0.051 0.000 1.055 105 A CA 0.523 52.601 52.037 0.069 0.000 0.756 105 A CB 0.480 19.548 19.000 0.112 0.000 0.986 105 A HN -0.680 7.526 8.150 0.094 0.000 0.505 106 N N 2.734 121.454 118.700 0.034 0.000 2.244 106 N HA -0.262 4.493 4.740 0.025 0.000 0.183 106 N C 0.049 175.575 175.510 0.027 0.000 1.016 106 N CA 1.899 54.964 53.050 0.025 0.000 0.866 106 N CB 0.018 38.514 38.487 0.015 0.000 0.980 106 N HN -0.005 8.653 8.380 0.029 -0.260 0.430 107 D N -0.437 119.981 120.400 0.030 0.000 2.343 107 D HA 0.047 4.697 4.640 0.018 0.000 0.255 107 D C 0.137 176.462 176.300 0.040 0.000 1.187 107 D CA 0.557 54.573 54.000 0.025 0.000 0.875 107 D CB 0.474 41.283 40.800 0.015 0.000 1.136 107 D HN -0.274 8.101 8.370 0.032 0.015 0.469 108 R N 4.904 125.424 120.500 0.032 0.000 2.096 108 R HA -0.460 3.906 4.340 0.044 0.000 0.235 108 R C 0.638 176.968 176.300 0.050 0.000 1.127 108 R CA 4.121 60.244 56.100 0.038 0.000 0.968 108 R CB 0.087 30.402 30.300 0.024 0.000 0.861 108 R HN 0.489 8.773 8.270 0.023 0.000 0.440 109 D N -2.974 117.449 120.400 0.038 0.000 2.178 109 D HA -0.207 4.463 4.640 0.050 0.000 0.201 109 D C 2.153 178.504 176.300 0.085 0.000 0.980 109 D CA 2.844 56.870 54.000 0.044 0.000 0.842 109 D CB -1.592 39.214 40.800 0.010 0.000 0.948 109 D HN 0.382 8.768 8.370 0.026 0.000 0.472 110 V N 0.954 120.920 119.914 0.085 0.000 2.358 110 V HA -0.393 3.827 4.120 0.166 0.000 0.246 110 V C 2.086 178.334 176.094 0.257 0.000 1.047 110 V CA 3.381 65.776 62.300 0.159 0.000 1.035 110 V CB -0.635 31.253 31.823 0.109 0.000 0.658 110 V HN -0.864 7.348 8.190 0.058 0.012 0.452 111 R N -0.591 120.018 120.500 0.181 0.000 2.091 111 R HA -0.247 4.436 4.340 0.236 -0.201 0.238 111 R C 2.956 179.356 176.300 0.166 0.000 1.136 111 R CA 3.631 59.841 56.100 0.182 0.000 0.959 111 R CB -0.404 29.963 30.300 0.111 0.000 0.856 111 R HN -0.649 7.702 8.270 0.135 0.000 0.437 112 R N -1.350 119.227 120.500 0.129 0.000 2.081 112 R HA -0.334 4.037 4.340 0.051 0.000 0.235 112 R C 2.372 178.763 176.300 0.151 0.000 1.131 112 R CA 3.369 59.528 56.100 0.098 0.000 0.960 112 R CB -0.214 30.130 30.300 0.074 0.000 0.856 112 R HN -0.392 7.949 8.270 0.118 0.000 0.436 113 Y N 0.758 121.109 120.300 0.085 0.000 2.165 113 Y HA -0.487 4.107 4.550 0.073 0.000 0.286 113 Y C 1.092 177.108 175.900 0.193 0.000 1.155 113 Y CA 3.067 61.232 58.100 0.108 0.000 1.164 113 Y CB -0.217 38.289 38.460 0.077 0.000 0.978 113 Y HN -0.378 8.091 8.280 0.314 0.000 0.513 114 A N -0.976 121.987 122.820 0.239 0.000 1.908 114 A HA -0.418 3.937 4.320 0.059 0.000 0.218 114 A C 1.754 179.419 177.584 0.135 0.000 1.181 114 A CA 3.310 55.443 52.037 0.159 0.000 0.627 114 A CB -0.734 18.410 19.000 0.242 0.000 0.818 114 A HN 0.090 8.469 8.150 0.383 0.000 0.445 115 L N -2.556 118.748 121.223 0.136 0.000 2.046 115 L HA -0.437 3.939 4.340 0.060 0.000 0.208 115 L C 2.513 179.345 176.870 -0.064 0.000 1.077 115 L CA 3.035 57.880 54.840 0.008 0.000 0.747 115 L CB -0.469 41.520 42.059 -0.117 0.000 0.896 115 L HN -0.522 7.792 8.230 0.141 0.000 0.432 116 R N -1.858 118.595 120.500 -0.079 0.000 2.081 116 R HA -0.350 3.915 4.340 -0.125 0.000 0.235 116 R C 2.327 178.546 176.300 -0.135 0.000 1.131 116 R CA 2.454 58.488 56.100 -0.110 0.000 0.960 116 R CB -0.847 29.416 30.300 -0.062 0.000 0.856 116 R HN -0.223 8.019 8.270 -0.046 0.000 0.436 117 K N -0.246 120.029 120.400 -0.210 0.000 2.057 117 K HA -0.273 3.953 4.320 -0.157 0.000 0.207 117 K C 2.278 178.849 176.600 -0.048 0.000 1.049 117 K CA 3.367 59.547 56.287 -0.179 0.000 0.931 117 K CB -0.186 32.135 32.500 -0.298 0.000 0.714 117 K HN -0.004 8.082 8.250 -0.274 0.000 0.440 118 T N 1.997 116.545 114.554 -0.011 0.000 2.708 118 T HA -0.323 4.107 4.350 0.132 0.000 0.266 118 T C 1.977 176.656 174.700 -0.035 0.000 1.037 118 T CA 4.765 66.902 62.100 0.062 0.000 1.146 118 T CB -0.020 68.949 68.868 0.168 0.000 0.865 118 T HN -0.468 7.760 8.240 -0.020 0.000 0.435 119 I N 1.157 121.660 120.570 -0.111 0.000 2.208 119 I HA -0.546 3.509 4.170 -0.193 0.000 0.245 119 I C 1.218 177.279 176.117 -0.094 0.000 1.097 119 I CA 4.486 65.657 61.300 -0.215 0.000 1.363 119 I CB -0.364 37.355 38.000 -0.469 0.000 1.051 119 I HN -0.078 8.064 8.210 -0.113 0.000 0.413 120 R N -1.024 119.445 120.500 -0.052 0.000 2.091 120 R HA -0.442 3.917 4.340 0.031 0.000 0.238 120 R C 1.932 178.282 176.300 0.083 0.000 1.136 120 R CA 4.162 60.275 56.100 0.022 0.000 0.959 120 R CB -0.181 30.127 30.300 0.013 0.000 0.856 120 R HN -0.316 7.910 8.270 -0.073 0.000 0.437 121 N N -1.912 116.849 118.700 0.100 0.000 2.354 121 N HA -0.127 4.750 4.740 0.229 0.000 0.179 121 N C 2.069 177.684 175.510 0.175 0.000 1.021 121 N CA 2.376 55.548 53.050 0.203 0.000 0.887 121 N CB -0.444 38.221 38.487 0.297 0.000 0.974 121 N HN -0.778 7.633 8.380 0.071 0.012 0.437 122 I N 1.137 121.678 120.570 -0.049 0.000 2.208 122 I HA -0.648 3.339 4.170 -0.304 0.000 0.245 122 I C 1.238 177.364 176.117 0.015 0.000 1.097 122 I CA 4.616 65.820 61.300 -0.159 0.000 1.363 122 I CB -0.388 37.528 38.000 -0.141 0.000 1.051 122 I HN 0.133 8.291 8.210 -0.087 0.000 0.413 123 D N -0.701 119.777 120.400 0.131 0.000 2.117 123 D HA -0.260 4.402 4.640 0.037 0.000 0.197 123 D C 2.566 178.898 176.300 0.054 0.000 0.987 123 D CA 3.427 57.499 54.000 0.120 0.000 0.829 123 D CB -0.473 40.467 40.800 0.233 0.000 0.961 123 D HN -0.581 7.873 8.370 0.155 0.008 0.460 124 L N 0.337 121.641 121.223 0.136 0.000 2.056 124 L HA -0.180 4.247 4.340 0.145 0.000 0.207 124 L C 1.352 178.362 176.870 0.234 0.000 1.078 124 L CA 2.627 57.581 54.840 0.189 0.000 0.749 124 L CB -0.393 41.819 42.059 0.255 0.000 0.901 124 L HN -0.851 7.473 8.230 0.156 0.000 0.433 125 A N -0.700 122.281 122.820 0.269 0.000 1.883 125 A HA -0.345 4.210 4.320 0.392 0.000 0.217 125 A C 2.213 179.855 177.584 0.097 0.000 1.186 125 A CA 3.280 55.472 52.037 0.258 0.000 0.624 125 A CB -0.948 18.218 19.000 0.277 0.000 0.822 125 A HN 0.145 8.453 8.150 0.263 0.000 0.444 126 V N -1.044 118.826 119.914 -0.073 0.000 2.287 126 V HA -0.429 3.592 4.120 -0.166 0.000 0.248 126 V C 2.866 178.900 176.094 -0.099 0.000 1.053 126 V CA 4.099 66.272 62.300 -0.211 0.000 1.027 126 V CB -0.830 30.591 31.823 -0.670 0.000 0.646 126 V HN -0.101 8.025 8.190 -0.105 0.000 0.447 127 E N 0.759 120.931 120.200 -0.047 0.000 2.118 127 E HA -0.275 4.067 4.350 -0.013 0.000 0.195 127 E C 2.099 178.723 176.600 0.041 0.000 0.992 127 E CA 2.863 59.267 56.400 0.006 0.000 0.804 127 E CB -0.060 29.665 29.700 0.042 0.000 0.741 127 E HN -0.735 7.597 8.360 -0.048 0.000 0.458 128 L N -5.050 116.231 121.223 0.096 0.000 2.554 128 L HA -0.070 4.318 4.340 0.080 0.000 0.226 128 L C -0.152 176.772 176.870 0.091 0.000 1.137 128 L CA 0.254 55.165 54.840 0.119 0.000 0.863 128 L CB 0.520 42.724 42.059 0.241 0.000 0.985 128 L HN -0.567 7.722 8.230 0.124 0.016 0.451 129 G N -4.856 103.981 108.800 0.062 0.000 2.168 129 G HA2 -0.329 3.636 3.960 0.010 0.000 0.197 129 G HA3 -0.329 3.652 3.960 0.036 0.000 0.197 129 G C -0.934 173.990 174.900 0.041 0.000 0.997 129 G CA -0.425 44.696 45.100 0.035 0.000 0.658 129 G HN -0.734 7.418 8.290 0.050 0.168 0.513 130 A N 0.761 123.620 122.820 0.064 0.000 2.488 130 A HA 0.040 4.530 4.320 0.055 -0.137 0.249 130 A C -0.343 177.238 177.584 -0.006 0.000 1.083 130 A CA 0.001 52.066 52.037 0.046 0.000 0.768 130 A CB 0.475 19.512 19.000 0.062 0.000 1.017 130 A HN -0.213 7.990 8.150 0.089 0.000 0.496 131 K N 1.466 121.855 120.400 -0.018 0.000 2.354 131 K HA 0.382 4.660 4.320 -0.070 0.000 0.194 131 K C -0.070 176.487 176.600 -0.073 0.000 1.038 131 K CA -0.809 55.444 56.287 -0.056 0.000 1.052 131 K CB 1.286 33.751 32.500 -0.058 0.000 0.861 131 K HN -0.173 8.077 8.250 -0.000 0.000 0.535 132 T N 1.937 116.462 114.554 -0.048 0.000 2.861 132 T HA 0.634 5.350 4.350 -0.036 -0.387 0.287 132 T C -2.229 172.440 174.700 -0.051 0.000 1.003 132 T CA -0.393 61.682 62.100 -0.040 0.000 0.977 132 T CB 2.972 71.835 68.868 -0.008 0.000 0.996 132 T HN -0.755 7.461 8.240 -0.039 0.000 0.448 133 Y N 7.593 127.825 120.300 -0.113 0.000 2.345 133 Y HA 0.511 5.208 4.550 -0.078 -0.193 0.331 133 Y C -1.952 174.034 175.900 0.144 0.000 0.959 133 Y CA -1.681 56.399 58.100 -0.033 0.000 1.204 133 Y CB 2.687 41.116 38.460 -0.052 0.000 1.135 133 Y HN 0.780 9.093 8.280 0.055 0.000 0.477 134 V N 8.338 128.102 119.914 -0.249 0.000 2.607 134 V HA 0.499 4.919 4.120 0.139 -0.217 0.289 134 V C -1.308 174.861 176.094 0.126 0.000 1.053 134 V CA -1.294 60.994 62.300 -0.020 0.000 0.996 134 V CB 1.683 33.410 31.823 -0.160 0.000 0.995 134 V HN 0.283 8.121 8.190 -0.587 0.000 0.476 135 A N 7.044 130.063 122.820 0.331 0.000 2.304 135 A HA 0.458 4.947 4.320 0.282 0.000 0.314 135 A C -2.215 175.565 177.584 0.327 0.000 1.187 135 A CA -1.211 51.047 52.037 0.369 0.000 0.810 135 A CB 2.584 21.973 19.000 0.649 0.000 1.183 135 A HN 0.541 8.905 8.150 0.355 0.000 0.487 136 W N 6.149 127.478 121.300 0.050 0.000 2.336 136 W HA 0.448 5.127 4.660 0.032 0.000 0.315 136 W C -0.263 176.225 176.519 -0.051 0.000 1.016 136 W CA -1.172 56.176 57.345 0.005 0.000 1.318 136 W CB 1.691 31.129 29.460 -0.036 0.000 1.247 136 W HN 0.312 8.669 8.180 0.296 0.000 0.414 137 G N 7.982 116.495 108.800 -0.478 0.000 3.458 137 G HA2 0.038 3.676 3.960 -0.536 0.000 0.256 137 G HA3 0.038 3.766 3.960 -0.386 0.000 0.256 137 G C 0.056 174.398 174.900 -0.929 0.000 0.938 137 G CA -1.003 43.752 45.100 -0.575 0.000 1.890 137 G HN 0.474 8.598 8.290 -0.276 0.000 0.639 138 G N 0.859 108.650 108.800 -1.681 0.000 2.448 138 G HA2 -0.260 2.712 3.960 -1.647 0.000 0.219 138 G HA3 -0.260 1.983 3.960 -2.862 0.000 0.219 138 G C -0.070 174.377 174.900 -0.756 0.000 1.127 138 G CA 1.058 45.054 45.100 -1.838 0.000 0.766 138 G HN -0.322 6.849 8.290 -1.760 0.062 0.552 139 R N -4.137 116.055 120.500 -0.513 0.000 2.334 139 R HA 0.045 4.260 4.340 -0.207 0.000 0.216 139 R C -0.911 175.266 176.300 -0.204 0.000 0.905 139 R CA -1.085 54.866 56.100 -0.248 0.000 1.064 139 R CB -0.436 29.798 30.300 -0.110 0.000 1.046 139 R HN 0.102 8.004 8.270 -0.564 0.030 0.508 140 E N 0.806 120.850 120.200 -0.261 0.000 2.105 140 E HA 0.193 4.464 4.350 -0.131 0.000 0.285 140 E C -0.094 176.414 176.600 -0.153 0.000 1.055 140 E CA -0.855 55.438 56.400 -0.180 0.000 0.843 140 E CB -0.717 28.870 29.700 -0.187 0.000 1.067 140 E HN -0.811 7.162 8.360 -0.358 0.171 0.398 141 G N 1.972 110.711 108.800 -0.102 0.000 2.403 141 G HA2 0.132 4.044 3.960 -0.079 0.000 0.223 141 G HA3 0.132 4.219 3.960 -0.101 -0.188 0.223 141 G C -2.868 171.996 174.900 -0.059 0.000 1.287 141 G CA 0.300 45.348 45.100 -0.086 0.000 0.982 141 G HN -0.301 7.939 8.290 -0.083 0.000 0.471 142 A N -2.001 120.788 122.820 -0.052 0.000 2.597 142 A HA 0.425 4.727 4.320 -0.031 0.000 0.292 142 A C -2.096 175.471 177.584 -0.030 0.000 1.057 142 A CA -0.170 51.846 52.037 -0.034 0.000 0.674 142 A CB 2.593 21.577 19.000 -0.026 0.000 1.278 142 A HN -0.166 7.948 8.150 -0.059 0.000 0.416 143 E N -0.459 119.728 120.200 -0.021 0.000 2.431 143 E HA 0.112 4.453 4.350 -0.015 0.000 0.200 143 E C -0.459 176.135 176.600 -0.010 0.000 0.995 143 E CA 0.510 56.902 56.400 -0.014 0.000 0.915 143 E CB 0.851 30.545 29.700 -0.011 0.000 0.930 143 E HN 0.583 8.932 8.360 -0.019 0.000 0.496 144 S N -3.618 112.076 115.700 -0.010 0.000 2.588 144 S HA 0.284 4.751 4.470 -0.005 0.000 0.275 144 S C 0.795 175.391 174.600 -0.007 0.000 1.130 144 S CA -1.555 56.641 58.200 -0.007 0.000 0.855 144 S CB 3.167 66.364 63.200 -0.005 0.000 1.116 144 S HN -0.598 7.705 8.310 -0.012 0.000 0.472 145 G N 0.654 109.452 108.800 -0.004 0.000 2.421 145 G HA2 -0.152 3.806 3.960 -0.004 0.000 0.217 145 G HA3 -0.152 3.807 3.960 -0.001 0.000 0.217 145 G C 0.530 175.429 174.900 -0.002 0.000 1.143 145 G CA 1.168 46.266 45.100 -0.003 0.000 0.784 145 G HN 0.353 8.641 8.290 -0.003 0.000 0.541 146 A N -0.696 122.123 122.820 -0.001 0.000 2.238 146 A HA 0.082 4.403 4.320 0.001 0.000 0.210 146 A C 0.433 178.017 177.584 -0.001 0.000 1.179 146 A CA 0.155 52.192 52.037 -0.000 0.000 0.827 146 A CB -0.282 18.719 19.000 0.001 0.000 0.856 146 A HN -0.190 7.959 8.150 -0.002 0.000 0.488 147 A N -1.641 121.177 122.820 -0.003 0.000 2.015 147 A HA -0.126 4.193 4.320 -0.003 0.000 0.219 147 A C -0.198 177.384 177.584 -0.003 0.000 1.163 147 A CA 1.430 53.465 52.037 -0.004 0.000 0.646 147 A CB 0.247 19.243 19.000 -0.007 0.000 0.806 147 A HN -0.364 7.729 8.150 -0.004 0.055 0.448 148 K N -1.907 118.490 120.400 -0.004 0.000 2.578 148 K HA 0.120 4.439 4.320 -0.001 0.000 0.250 148 K C -1.681 174.919 176.600 -0.000 0.000 0.955 148 K CA -0.930 55.354 56.287 -0.004 0.000 0.825 148 K CB 1.333 33.826 32.500 -0.012 0.000 1.151 148 K HN -0.542 7.664 8.250 -0.005 0.042 0.432 149 D N 7.232 127.635 120.400 0.005 0.000 2.352 149 D HA 0.051 4.696 4.640 0.008 0.000 0.245 149 D C 0.295 176.602 176.300 0.012 0.000 1.224 149 D CA -0.864 53.141 54.000 0.009 0.000 0.879 149 D CB 0.357 41.164 40.800 0.011 0.000 1.057 149 D HN 0.226 8.600 8.370 0.006 0.000 0.491 150 V N 5.382 125.303 119.914 0.011 0.000 2.427 150 V HA -0.490 3.634 4.120 0.007 0.000 0.248 150 V C 1.528 177.639 176.094 0.028 0.000 1.051 150 V CA 3.373 65.680 62.300 0.013 0.000 1.048 150 V CB 0.290 32.118 31.823 0.008 0.000 0.666 150 V HN 0.449 8.645 8.190 0.010 0.000 0.456 151 R N -1.009 119.510 120.500 0.031 0.000 2.083 151 R HA -0.359 4.012 4.340 0.051 0.000 0.237 151 R C 2.416 178.743 176.300 0.044 0.000 1.137 151 R CA 3.587 59.712 56.100 0.041 0.000 0.951 151 R CB -0.482 29.838 30.300 0.033 0.000 0.851 151 R HN -0.530 7.826 8.270 0.026 -0.070 0.434 152 V N -0.410 119.524 119.914 0.033 0.000 2.427 152 V HA -0.249 4.054 4.120 0.035 -0.162 0.248 152 V C 1.974 178.091 176.094 0.040 0.000 1.051 152 V CA 2.799 65.119 62.300 0.033 0.000 1.048 152 V CB -0.587 31.250 31.823 0.023 0.000 0.666 152 V HN -0.569 7.898 8.190 0.028 -0.260 0.456 153 A N 0.578 123.418 122.820 0.034 0.000 1.908 153 A HA -0.356 3.985 4.320 0.035 0.000 0.218 153 A C 2.141 179.760 177.584 0.058 0.000 1.181 153 A CA 3.405 55.463 52.037 0.034 0.000 0.627 153 A CB -0.697 18.310 19.000 0.012 0.000 0.818 153 A HN 0.097 8.264 8.150 0.028 0.000 0.445 154 L N -2.450 118.817 121.223 0.074 0.000 2.083 154 L HA -0.496 3.929 4.340 0.141 0.000 0.209 154 L C 2.085 179.071 176.870 0.194 0.000 1.083 154 L CA 3.095 58.025 54.840 0.150 0.000 0.752 154 L CB -0.672 41.488 42.059 0.167 0.000 0.899 154 L HN 0.058 8.325 8.230 0.061 0.000 0.433 155 D N -0.272 120.197 120.400 0.115 0.000 2.104 155 D HA -0.295 4.396 4.640 0.086 0.000 0.194 155 D C 2.819 179.169 176.300 0.083 0.000 0.994 155 D CA 3.523 57.574 54.000 0.085 0.000 0.830 155 D CB -0.688 40.142 40.800 0.049 0.000 0.959 155 D HN -0.333 8.017 8.370 0.091 0.074 0.452 156 R N -1.768 118.776 120.500 0.072 0.000 2.092 156 R HA -0.097 4.260 4.340 0.027 0.000 0.231 156 R C 2.480 178.821 176.300 0.068 0.000 1.119 156 R CA 2.054 58.185 56.100 0.051 0.000 0.970 156 R CB -0.280 30.047 30.300 0.046 0.000 0.864 156 R HN -0.305 7.934 8.270 0.068 0.072 0.440 157 M N -1.344 118.344 119.600 0.147 0.000 2.200 157 M HA -0.186 4.367 4.480 0.123 0.000 0.265 157 M C 1.821 178.378 176.300 0.427 0.000 1.066 157 M CA 3.650 59.091 55.300 0.235 0.000 1.127 157 M CB -0.482 32.252 32.600 0.223 0.000 1.379 157 M HN 0.139 8.519 8.290 0.149 0.000 0.420 158 K N 0.694 121.359 120.400 0.441 0.000 2.063 158 K HA -0.420 4.058 4.320 0.263 0.000 0.208 158 K C 1.563 178.204 176.600 0.068 0.000 1.048 158 K CA 3.917 60.337 56.287 0.223 0.000 0.928 158 K CB -0.223 32.297 32.500 0.033 0.000 0.713 158 K HN 0.160 8.658 8.250 0.412 0.000 0.442 159 E N -0.780 119.435 120.200 0.024 0.000 2.085 159 E HA -0.342 3.986 4.350 -0.037 0.000 0.194 159 E C 1.972 178.494 176.600 -0.131 0.000 0.994 159 E CA 3.035 59.409 56.400 -0.043 0.000 0.801 159 E CB -0.062 29.616 29.700 -0.037 0.000 0.743 159 E HN -0.397 7.995 8.360 0.053 0.000 0.453 160 A N -0.770 121.902 122.820 -0.246 0.000 1.858 160 A HA -0.247 3.752 4.320 -0.535 0.000 0.216 160 A C 2.272 179.502 177.584 -0.590 0.000 1.190 160 A CA 3.138 54.813 52.037 -0.604 0.000 0.617 160 A CB -0.767 17.532 19.000 -1.168 0.000 0.827 160 A HN -0.332 7.711 8.150 -0.177 0.000 0.443 161 F N -2.973 116.805 119.950 -0.286 0.000 2.171 161 F HA -0.404 3.963 4.527 -0.266 0.000 0.300 161 F C 2.276 178.006 175.800 -0.117 0.000 1.090 161 F CA 4.170 62.044 58.000 -0.209 0.000 1.293 161 F CB -0.478 38.419 39.000 -0.172 0.000 1.013 161 F HN -0.063 8.130 8.300 -0.179 0.000 0.486 162 D N 0.554 120.977 120.400 0.039 0.000 2.117 162 D HA -0.237 4.477 4.640 0.124 0.000 0.198 162 D C 2.436 178.765 176.300 0.048 0.000 0.982 162 D CA 3.328 57.360 54.000 0.054 0.000 0.828 162 D CB -0.292 40.506 40.800 -0.002 0.000 0.967 162 D HN 0.131 8.506 8.370 0.009 0.000 0.464 163 L N 0.978 122.181 121.223 -0.034 0.000 2.017 163 L HA -0.379 3.968 4.340 0.010 0.000 0.208 163 L C 1.376 178.262 176.870 0.026 0.000 1.073 163 L CA 3.426 58.250 54.840 -0.026 0.000 0.745 163 L CB -0.043 41.957 42.059 -0.099 0.000 0.894 163 L HN -0.169 8.011 8.230 -0.084 0.000 0.432 164 L N -2.937 118.257 121.223 -0.047 0.000 2.079 164 L HA -0.446 3.957 4.340 0.106 0.000 0.210 164 L C 2.278 179.305 176.870 0.262 0.000 1.081 164 L CA 3.078 57.943 54.840 0.041 0.000 0.752 164 L CB -0.798 41.105 42.059 -0.259 0.000 0.896 164 L HN -0.192 7.955 8.230 -0.139 0.000 0.433 165 G N -2.014 106.943 108.800 0.262 0.000 2.408 165 G HA2 -0.388 3.831 3.960 0.431 0.000 0.217 165 G HA3 -0.388 3.796 3.960 0.373 0.000 0.217 165 G C 0.916 175.943 174.900 0.211 0.000 1.150 165 G CA 1.887 47.189 45.100 0.336 0.000 0.776 165 G HN -0.037 8.374 8.290 0.216 0.008 0.542 166 E N 3.141 123.437 120.200 0.160 0.000 2.077 166 E HA -0.320 4.075 4.350 0.075 0.000 0.193 166 E C 1.565 178.221 176.600 0.094 0.000 0.989 166 E CA 2.481 58.941 56.400 0.101 0.000 0.800 166 E CB -0.433 29.315 29.700 0.079 0.000 0.746 166 E HN -0.188 8.192 8.360 0.156 0.073 0.452 167 Y N 0.949 121.266 120.300 0.029 0.000 2.114 167 Y HA -0.306 4.224 4.550 -0.033 0.000 0.284 167 Y C 2.139 178.019 175.900 -0.033 0.000 1.143 167 Y CA 3.143 61.240 58.100 -0.003 0.000 1.135 167 Y CB 0.356 38.828 38.460 0.020 0.000 0.980 167 Y HN -0.057 8.384 8.280 0.268 0.000 0.499 168 V N -4.100 115.820 119.914 0.010 0.000 2.407 168 V HA -0.510 3.400 4.120 -0.350 0.000 0.248 168 V C 1.740 177.715 176.094 -0.199 0.000 1.055 168 V CA 4.119 66.354 62.300 -0.109 0.000 1.049 168 V CB -1.528 30.388 31.823 0.155 0.000 0.662 168 V HN -0.174 8.169 8.190 0.256 0.000 0.455 169 T N 3.300 117.799 114.554 -0.091 0.000 2.708 169 T HA -0.302 4.005 4.350 -0.071 0.000 0.266 169 T C 2.570 177.175 174.700 -0.160 0.000 1.037 169 T CA 4.699 66.749 62.100 -0.083 0.000 1.146 169 T CB -0.103 68.756 68.868 -0.016 0.000 0.865 169 T HN -0.261 7.957 8.240 -0.015 0.013 0.435 170 S N 1.515 117.095 115.700 -0.201 0.000 2.402 170 S HA -0.180 4.203 4.470 -0.143 0.000 0.229 170 S C 1.552 175.956 174.600 -0.326 0.000 1.021 170 S CA 2.913 60.988 58.200 -0.209 0.000 0.974 170 S CB -0.560 62.538 63.200 -0.170 0.000 0.800 170 S HN -0.160 8.038 8.310 -0.187 0.000 0.484 171 Q N -1.352 118.105 119.800 -0.571 0.000 2.425 171 Q HA 0.061 4.070 4.340 -0.551 0.000 0.204 171 Q C 0.568 176.260 176.000 -0.513 0.000 0.933 171 Q CA -0.209 55.148 55.803 -0.744 0.000 0.939 171 Q CB 0.169 27.929 28.738 -1.630 0.000 1.044 171 Q HN -0.582 7.274 8.270 -0.649 0.025 0.513 172 G N -1.224 107.380 108.800 -0.327 0.000 2.160 172 G HA2 -0.393 3.502 3.960 -0.108 0.000 0.251 172 G HA3 -0.393 3.503 3.960 -0.107 0.000 0.251 172 G C -0.128 174.760 174.900 -0.019 0.000 1.008 172 G CA 0.676 45.693 45.100 -0.139 0.000 0.724 172 G HN -0.604 7.307 8.290 -0.327 0.183 0.514 173 Y N -0.542 119.691 120.300 -0.112 0.000 2.346 173 Y HA -0.161 4.341 4.550 -0.080 0.000 0.330 173 Y C -0.466 175.376 175.900 -0.096 0.000 1.178 173 Y CA -1.015 57.026 58.100 -0.099 0.000 1.331 173 Y CB 0.258 38.650 38.460 -0.113 0.000 1.253 173 Y HN -0.630 7.524 8.280 -0.165 0.027 0.529 174 D N 3.408 123.852 120.400 0.074 0.000 2.499 174 D HA 0.177 4.802 4.640 -0.024 0.000 0.225 174 D C -1.252 175.008 176.300 -0.067 0.000 1.124 174 D CA -0.148 53.842 54.000 -0.016 0.000 0.938 174 D CB 0.428 41.209 40.800 -0.032 0.000 1.014 174 D HN 0.188 8.605 8.370 0.078 0.000 0.517 175 I N 1.123 121.637 120.570 -0.094 0.000 2.827 175 I HA 0.195 4.428 4.170 -0.156 -0.156 0.298 175 I C -2.437 173.517 176.117 -0.273 0.000 1.235 175 I CA -1.509 59.687 61.300 -0.174 0.000 1.021 175 I CB 3.795 41.684 38.000 -0.186 0.000 1.259 175 I HN -0.299 7.729 8.210 -0.047 0.154 0.427 176 R N 1.010 121.332 120.500 -0.297 0.000 2.888 176 R HA 0.520 4.622 4.340 -0.397 0.000 0.264 176 R C -2.310 173.811 176.300 -0.298 0.000 1.045 176 R CA -2.656 53.264 56.100 -0.300 0.000 0.962 176 R CB 3.018 33.233 30.300 -0.142 0.000 1.210 176 R HN 0.020 8.150 8.270 -0.233 0.000 0.479 177 F N -1.823 118.226 119.950 0.165 0.000 2.458 177 F HA 0.829 5.763 4.527 0.324 -0.213 0.330 177 F C -0.928 175.065 175.800 0.321 0.000 1.082 177 F CA -2.127 56.037 58.000 0.272 0.000 0.995 177 F CB 3.524 42.699 39.000 0.291 0.000 1.170 177 F HN 0.325 8.672 8.300 0.079 0.000 0.478 178 A N 0.841 123.938 122.820 0.461 0.000 2.353 178 A HA 0.653 5.198 4.320 0.204 -0.103 0.299 178 A C -1.835 175.904 177.584 0.258 0.000 1.089 178 A CA -1.476 50.732 52.037 0.285 0.000 0.736 178 A CB 2.714 21.866 19.000 0.253 0.000 1.195 178 A HN 0.720 9.166 8.150 0.493 0.000 0.447 179 I N 4.761 125.436 120.570 0.175 0.000 2.371 179 I HA 0.197 4.680 4.170 0.233 -0.173 0.290 179 I C -0.564 175.658 176.117 0.175 0.000 1.028 179 I CA -0.138 61.259 61.300 0.161 0.000 1.345 179 I CB 1.132 39.151 38.000 0.032 0.000 1.407 179 I HN 0.504 8.786 8.210 0.120 0.000 0.501 180 E N 8.890 129.235 120.200 0.242 0.000 2.055 180 E HA 0.579 5.238 4.350 0.237 -0.166 0.274 180 E C -2.253 174.556 176.600 0.349 0.000 0.949 180 E CA -3.543 53.029 56.400 0.287 0.000 0.775 180 E CB 2.410 32.297 29.700 0.311 0.000 1.097 180 E HN 0.206 8.731 8.360 0.274 0.000 0.404 181 P HA 0.226 4.847 4.420 0.177 -0.095 0.274 181 P C -1.821 175.675 177.300 0.327 0.000 1.231 181 P CA -0.650 62.594 63.100 0.240 0.000 0.790 181 P CB 1.165 32.976 31.700 0.185 0.000 0.951 182 K N -1.238 119.269 120.400 0.177 0.000 2.557 182 K HA 0.428 4.755 4.320 0.012 0.000 0.261 182 K C -1.801 174.779 176.600 -0.033 0.000 0.932 182 K CA -2.472 53.824 56.287 0.016 0.000 0.829 182 K CB 3.420 35.873 32.500 -0.079 0.000 1.358 182 K HN -0.280 8.038 8.250 0.113 0.000 0.430 183 P HA 0.144 4.583 4.420 -0.082 -0.067 0.226 183 P C -1.719 175.540 177.300 -0.069 0.000 1.161 183 P CA 0.947 64.010 63.100 -0.060 0.000 0.804 183 P CB 0.906 32.588 31.700 -0.031 0.000 0.829 184 N N -3.279 115.384 118.700 -0.062 0.000 3.046 184 N HA -0.054 4.725 4.740 -0.059 -0.075 0.243 184 N C -2.081 173.409 175.510 -0.033 0.000 1.452 184 N CA -0.678 52.344 53.050 -0.047 0.000 0.882 184 N CB 3.104 41.575 38.487 -0.026 0.000 1.425 184 N HN -0.718 7.619 8.380 -0.071 0.000 0.517 185 E N -1.942 118.250 120.200 -0.014 0.000 7.334 185 E HA -0.162 4.199 4.350 0.018 0.000 0.208 185 E C -1.990 174.640 176.600 0.051 0.000 0.948 185 E CA 0.002 56.413 56.400 0.019 0.000 1.626 185 E CB 0.994 30.718 29.700 0.039 0.000 0.908 185 E HN 0.362 8.708 8.360 -0.024 0.000 0.271 186 P HA 0.156 4.589 4.420 0.022 0.000 0.257 186 P C -0.786 176.499 177.300 -0.024 0.000 1.241 186 P CA 0.214 63.318 63.100 0.007 0.000 0.816 186 P CB 0.469 32.183 31.700 0.024 0.000 1.150 187 R N -1.045 119.421 120.500 -0.057 0.000 2.500 187 R HA 0.319 4.808 4.340 -0.044 -0.175 0.275 187 R C 1.787 178.062 176.300 -0.041 0.000 1.051 187 R CA -2.458 53.608 56.100 -0.057 0.000 1.088 187 R CB -0.065 30.182 30.300 -0.087 0.000 1.063 187 R HN -0.937 7.284 8.270 -0.081 0.000 0.511 188 G N 2.624 111.405 108.800 -0.031 0.000 2.440 188 G HA2 -0.272 3.681 3.960 -0.011 0.000 0.218 188 G HA3 -0.272 3.678 3.960 -0.017 0.000 0.218 188 G C -0.460 174.422 174.900 -0.030 0.000 1.154 188 G CA 1.119 46.207 45.100 -0.021 0.000 0.767 188 G HN 0.254 8.828 8.290 -0.031 -0.302 0.552 189 D N 0.213 120.586 120.400 -0.045 0.000 2.879 189 D HA 0.407 5.147 4.640 -0.060 -0.135 0.236 189 D C -1.814 174.434 176.300 -0.085 0.000 1.171 189 D CA -0.168 53.795 54.000 -0.061 0.000 0.868 189 D CB 3.768 44.535 40.800 -0.055 0.000 1.598 189 D HN -0.500 7.843 8.370 -0.046 0.000 0.497 190 I N 1.266 121.772 120.570 -0.107 0.000 2.437 190 I HA 0.419 4.682 4.170 -0.147 -0.181 0.298 190 I C -0.050 175.979 176.117 -0.147 0.000 0.984 190 I CA -1.055 60.160 61.300 -0.142 0.000 1.214 190 I CB 2.043 39.945 38.000 -0.163 0.000 1.365 190 I HN 0.008 8.158 8.210 -0.101 0.000 0.469 191 L N 5.111 126.243 121.223 -0.152 0.000 2.461 191 L HA -0.042 4.215 4.340 -0.138 0.000 0.272 191 L C 0.177 176.945 176.870 -0.169 0.000 1.197 191 L CA 0.457 55.207 54.840 -0.150 0.000 0.836 191 L CB 0.446 42.421 42.059 -0.140 0.000 1.105 191 L HN -0.152 7.985 8.230 -0.156 0.000 0.477 192 L N -5.351 115.774 121.223 -0.163 0.000 3.632 192 L HA -0.232 4.086 4.340 -0.037 0.000 0.510 192 L C -1.480 175.323 176.870 -0.112 0.000 1.299 192 L CA -0.353 54.420 54.840 -0.112 0.000 0.829 192 L CB -2.005 39.965 42.059 -0.149 0.000 1.559 192 L HN 0.339 8.481 8.230 -0.147 0.000 0.857 193 P HA 0.062 4.620 4.420 -0.123 -0.212 0.236 193 P C -0.364 176.903 177.300 -0.055 0.000 1.177 193 P CA 0.584 63.567 63.100 -0.195 0.000 0.773 193 P CB 0.512 32.026 31.700 -0.310 0.000 0.878 194 T N -9.421 105.164 114.554 0.052 0.000 2.841 194 T HA 0.235 4.810 4.350 0.162 -0.128 0.296 194 T C 0.542 175.369 174.700 0.213 0.000 1.166 194 T CA -3.075 59.140 62.100 0.192 0.000 1.007 194 T CB 3.114 72.147 68.868 0.274 0.000 1.253 194 T HN -1.035 7.178 8.240 0.038 0.050 0.511 195 V N 1.073 121.093 119.914 0.178 0.000 2.282 195 V HA -0.400 3.795 4.120 0.125 0.000 0.249 195 V C 1.437 177.600 176.094 0.114 0.000 1.057 195 V CA 4.083 66.460 62.300 0.129 0.000 1.032 195 V CB -0.588 31.286 31.823 0.085 0.000 0.645 195 V HN 0.264 9.006 8.190 0.181 -0.443 0.447 196 G N -2.204 106.663 108.800 0.112 0.000 2.446 196 G HA2 -0.340 3.634 3.960 0.023 0.000 0.217 196 G HA3 -0.340 3.605 3.960 -0.025 0.000 0.217 196 G C 1.249 176.157 174.900 0.014 0.000 1.168 196 G CA 2.375 47.492 45.100 0.028 0.000 0.771 196 G HN -0.316 8.050 8.290 0.136 0.006 0.551 197 H N 2.588 121.686 119.070 0.047 0.000 2.387 197 H HA -0.289 4.301 4.556 0.056 0.000 0.299 197 H C 2.299 177.667 175.328 0.067 0.000 1.090 197 H CA 3.804 59.881 56.048 0.049 0.000 1.332 197 H CB -0.368 29.410 29.762 0.026 0.000 1.386 197 H HN -0.666 7.818 8.280 0.340 0.000 0.516 198 A N -0.749 122.179 122.820 0.180 0.000 1.898 198 A HA -0.337 4.056 4.320 0.122 0.000 0.216 198 A C 1.410 179.069 177.584 0.126 0.000 1.181 198 A CA 3.205 55.319 52.037 0.128 0.000 0.620 198 A CB -0.438 18.614 19.000 0.088 0.000 0.819 198 A HN -0.245 8.021 8.150 0.194 0.000 0.442 199 L N -2.180 119.091 121.223 0.080 0.000 2.042 199 L HA -0.479 3.874 4.340 0.021 0.000 0.210 199 L C 2.300 179.197 176.870 0.046 0.000 1.076 199 L CA 3.052 57.919 54.840 0.044 0.000 0.749 199 L CB -0.386 41.697 42.059 0.040 0.000 0.893 199 L HN -0.109 8.170 8.230 0.081 0.000 0.432 200 A N -1.055 121.802 122.820 0.062 0.000 1.902 200 A HA -0.284 4.049 4.320 0.021 0.000 0.217 200 A C 1.654 179.277 177.584 0.064 0.000 1.181 200 A CA 2.858 54.923 52.037 0.046 0.000 0.623 200 A CB -0.734 18.282 19.000 0.026 0.000 0.818 200 A HN -0.241 7.948 8.150 0.066 0.000 0.443 201 F N -0.881 119.047 119.950 -0.037 0.000 2.134 201 F HA -0.349 4.152 4.527 -0.043 0.000 0.299 201 F C 1.750 177.479 175.800 -0.119 0.000 1.097 201 F CA 2.951 60.915 58.000 -0.061 0.000 1.264 201 F CB 0.440 39.410 39.000 -0.051 0.000 1.001 201 F HN -0.662 7.799 8.300 0.268 0.000 0.479 202 I N -1.666 118.823 120.570 -0.135 0.000 2.264 202 I HA -0.535 3.339 4.170 -0.494 0.000 0.248 202 I C 2.009 177.967 176.117 -0.265 0.000 1.111 202 I CA 4.023 65.156 61.300 -0.278 0.000 1.382 202 I CB -0.517 37.428 38.000 -0.092 0.000 1.060 202 I HN -0.289 7.958 8.210 0.062 0.000 0.418 203 E N -2.749 117.354 120.200 -0.162 0.000 2.333 203 E HA -0.247 4.048 4.350 -0.090 0.000 0.198 203 E C 0.947 177.451 176.600 -0.160 0.000 1.007 203 E CA 1.656 57.985 56.400 -0.119 0.000 0.845 203 E CB -0.990 28.671 29.700 -0.065 0.000 0.766 203 E HN -0.490 7.780 8.360 -0.117 0.019 0.507 204 R N -3.712 116.629 120.500 -0.265 0.000 2.317 204 R HA 0.110 4.349 4.340 -0.168 0.000 0.208 204 R C -0.322 175.792 176.300 -0.309 0.000 0.914 204 R CA -1.787 54.160 56.100 -0.255 0.000 1.060 204 R CB 0.437 30.586 30.300 -0.252 0.000 1.015 204 R HN -0.405 7.495 8.270 -0.339 0.167 0.498 205 L N -1.478 119.503 121.223 -0.403 0.000 2.472 205 L HA -0.312 3.801 4.340 -0.379 0.000 0.260 205 L C -0.157 176.615 176.870 -0.163 0.000 1.209 205 L CA 0.523 55.138 54.840 -0.375 0.000 0.817 205 L CB 0.065 41.755 42.059 -0.615 0.000 1.106 205 L HN -0.611 7.141 8.230 -0.419 0.227 0.479 206 E N 1.271 121.418 120.200 -0.089 0.000 2.110 206 E HA -0.218 4.115 4.350 -0.027 0.000 0.193 206 E C 0.497 177.126 176.600 0.049 0.000 0.988 206 E CA 2.058 58.453 56.400 -0.009 0.000 0.804 206 E CB 0.697 30.406 29.700 0.016 0.000 0.745 206 E HN 0.207 8.874 8.360 -0.106 -0.371 0.458 207 R N -3.445 117.141 120.500 0.143 0.000 2.868 207 R HA 0.529 5.017 4.340 0.133 -0.068 0.289 207 R C -1.981 174.512 176.300 0.321 0.000 1.443 207 R CA -2.925 53.301 56.100 0.210 0.000 1.651 207 R CB -0.391 30.047 30.300 0.230 0.000 1.242 207 R HN -0.153 8.190 8.270 0.165 0.026 0.621 208 P HA -0.166 4.400 4.420 0.243 0.000 0.219 208 P C 0.957 178.426 177.300 0.283 0.000 1.146 208 P CA 2.076 65.301 63.100 0.209 0.000 0.808 208 P CB 0.282 32.014 31.700 0.053 0.000 0.779 209 E N -3.084 117.240 120.200 0.206 0.000 2.333 209 E HA -0.219 4.250 4.350 0.198 0.000 0.198 209 E C 0.882 177.619 176.600 0.227 0.000 1.007 209 E CA 2.280 58.794 56.400 0.189 0.000 0.845 209 E CB -1.631 28.135 29.700 0.111 0.000 0.766 209 E HN 0.545 8.968 8.360 0.169 0.038 0.507 210 L N -2.073 119.249 121.223 0.165 0.000 2.599 210 L HA -0.033 4.318 4.340 0.019 0.000 0.230 210 L C -1.681 175.131 176.870 -0.096 0.000 1.141 210 L CA 0.474 55.278 54.840 -0.059 0.000 0.877 210 L CB 0.268 42.159 42.059 -0.279 0.000 1.009 210 L HN -0.654 7.659 8.230 0.226 0.052 0.447 211 Y N -3.593 116.917 120.300 0.350 0.000 2.425 211 Y HA 0.659 5.614 4.550 0.350 -0.195 0.344 211 Y C -0.712 175.037 175.900 -0.251 0.000 0.969 211 Y CA -1.773 56.442 58.100 0.193 0.000 1.052 211 Y CB 3.102 41.587 38.460 0.041 0.000 1.215 211 Y HN -0.508 7.938 8.280 0.401 0.075 0.451 212 G N -0.447 108.041 108.800 -0.521 0.000 3.135 212 G HA2 0.783 4.279 3.960 -0.773 0.000 0.278 212 G HA3 0.783 3.446 3.960 -2.292 -0.078 0.278 212 G C -2.790 171.893 174.900 -0.361 0.000 1.302 212 G CA -1.232 43.229 45.100 -1.064 0.000 0.880 212 G HN 0.629 8.827 8.290 -0.153 0.000 0.574 213 V N -5.840 113.913 119.914 -0.267 0.000 2.769 213 V HA 0.711 5.003 4.120 0.015 -0.163 0.312 213 V C -2.143 173.997 176.094 0.076 0.000 1.058 213 V CA -3.917 58.366 62.300 -0.028 0.000 0.952 213 V CB 2.655 34.480 31.823 0.002 0.000 1.019 213 V HN 0.192 8.156 8.190 -0.376 0.000 0.445 214 N N 2.431 121.215 118.700 0.140 0.000 2.904 214 N HA 0.597 5.680 4.740 0.220 -0.211 0.257 214 N C -2.303 173.321 175.510 0.190 0.000 1.363 214 N CA -3.558 49.609 53.050 0.196 0.000 0.856 214 N CB 1.189 39.796 38.487 0.200 0.000 1.166 214 N HN 0.150 8.505 8.380 0.137 0.107 0.499 215 P HA 0.098 4.672 4.420 0.257 0.000 0.275 215 P C -2.287 175.188 177.300 0.293 0.000 1.228 215 P CA -0.479 62.783 63.100 0.269 0.000 0.786 215 P CB 0.958 32.806 31.700 0.247 0.000 0.927 216 E N 1.685 121.986 120.200 0.169 0.000 2.187 216 E HA 0.446 4.933 4.350 -0.134 -0.217 0.268 216 E C 1.022 177.295 176.600 -0.545 0.000 0.896 216 E CA -2.648 53.636 56.400 -0.193 0.000 0.766 216 E CB 2.791 32.142 29.700 -0.581 0.000 1.142 216 E HN 0.154 8.643 8.360 0.214 0.000 0.408 217 V N 7.158 126.444 119.914 -1.045 0.000 2.231 217 V HA -0.498 1.722 4.120 -3.167 0.000 0.250 217 V C 1.724 177.429 176.094 -0.649 0.000 1.058 217 V CA 4.434 65.834 62.300 -1.499 0.000 1.022 217 V CB -0.498 30.886 31.823 -0.731 0.000 0.640 217 V HN 0.197 7.953 8.190 -0.725 0.000 0.445 218 G N -4.499 104.079 108.800 -0.371 0.000 2.422 218 G HA2 -0.255 3.620 3.960 -0.142 0.000 0.218 218 G HA3 -0.255 3.631 3.960 -0.122 0.000 0.218 218 G C 0.876 175.784 174.900 0.014 0.000 1.140 218 G CA 1.904 46.910 45.100 -0.155 0.000 0.775 218 G HN -0.274 7.982 8.290 -0.391 -0.201 0.545 219 H N 2.414 121.428 119.070 -0.093 0.000 2.357 219 H HA -0.229 4.317 4.556 -0.015 0.000 0.301 219 H C 2.559 177.909 175.328 0.037 0.000 1.082 219 H CA 1.871 57.913 56.048 -0.010 0.000 1.342 219 H CB 0.228 30.010 29.762 0.033 0.000 1.389 219 H HN -0.648 7.508 8.280 -0.164 0.025 0.511 220 E N -2.232 118.097 120.200 0.214 0.000 2.106 220 E HA -0.312 4.160 4.350 0.202 0.000 0.192 220 E C 2.404 179.086 176.600 0.136 0.000 0.984 220 E CA 2.311 58.843 56.400 0.221 0.000 0.806 220 E CB -0.757 29.172 29.700 0.381 0.000 0.750 220 E HN -0.629 7.842 8.360 0.185 0.000 0.458 221 Q N -1.268 118.580 119.800 0.079 0.000 2.291 221 Q HA -0.153 4.217 4.340 0.051 0.000 0.205 221 Q C 3.054 179.069 176.000 0.025 0.000 0.970 221 Q CA 2.192 58.017 55.803 0.037 0.000 0.876 221 Q CB -0.096 28.637 28.738 -0.010 0.000 0.935 221 Q HN -0.666 7.622 8.270 0.048 0.011 0.455 222 M N -1.325 118.296 119.600 0.035 0.000 2.549 222 M HA -0.165 4.316 4.480 0.000 0.000 0.260 222 M C 0.705 177.019 176.300 0.024 0.000 1.076 222 M CA 2.721 58.032 55.300 0.019 0.000 1.090 222 M CB 0.183 32.793 32.600 0.017 0.000 1.418 222 M HN -0.332 7.860 8.290 0.056 0.131 0.486 223 A N -4.012 118.833 122.820 0.042 0.000 2.387 223 A HA 0.250 4.587 4.320 0.029 0.000 0.234 223 A C 0.359 177.966 177.584 0.040 0.000 1.253 223 A CA -0.826 51.235 52.037 0.041 0.000 0.894 223 A CB 0.078 19.110 19.000 0.054 0.000 0.963 223 A HN -0.620 7.408 8.150 0.057 0.157 0.508 224 G N -0.671 108.149 108.800 0.034 0.000 2.168 224 G HA2 -0.326 3.645 3.960 0.018 0.000 0.257 224 G HA3 -0.326 3.646 3.960 0.020 0.000 0.257 224 G C -0.064 174.854 174.900 0.030 0.000 0.997 224 G CA 0.821 45.936 45.100 0.025 0.000 0.708 224 G HN -0.405 7.706 8.290 0.032 0.198 0.520 225 L N -2.299 118.956 121.223 0.053 0.000 2.439 225 L HA 0.026 4.387 4.340 0.035 0.000 0.259 225 L C -0.716 176.185 176.870 0.051 0.000 1.129 225 L CA -1.129 53.745 54.840 0.056 0.000 0.803 225 L CB 0.885 43.000 42.059 0.093 0.000 1.161 225 L HN -0.681 7.547 8.230 0.065 0.041 0.462 226 N N -0.639 118.060 118.700 -0.002 0.000 2.415 226 N HA -0.041 4.677 4.740 -0.038 0.000 0.246 226 N C -0.044 175.504 175.510 0.063 0.000 1.078 226 N CA -0.865 52.142 53.050 -0.071 0.000 0.942 226 N CB 0.133 38.370 38.487 -0.416 0.000 1.140 226 N HN 0.086 8.460 8.380 -0.010 0.000 0.501 227 F N 9.053 128.997 119.950 -0.010 0.000 2.102 227 F HA -0.017 4.534 4.527 0.040 0.000 0.298 227 F C -1.515 174.318 175.800 0.055 0.000 1.105 227 F CA 4.581 62.602 58.000 0.035 0.000 1.239 227 F CB -1.714 37.314 39.000 0.048 0.000 0.991 227 F HN 0.460 8.915 8.300 0.259 0.000 0.474 228 P HA -0.344 4.036 4.420 -0.066 0.000 0.216 228 P C 1.768 179.085 177.300 0.028 0.000 1.153 228 P CA 3.473 66.582 63.100 0.015 0.000 0.858 228 P CB -0.541 31.247 31.700 0.148 0.000 0.789 229 H N -2.200 116.811 119.070 -0.099 0.000 2.353 229 H HA -0.338 4.144 4.556 -0.123 0.000 0.300 229 H C 2.456 177.704 175.328 -0.134 0.000 1.090 229 H CA 2.522 58.501 56.048 -0.115 0.000 1.327 229 H CB 0.074 29.780 29.762 -0.093 0.000 1.383 229 H HN -0.007 8.654 8.280 0.103 -0.320 0.508 230 G N -0.512 108.278 108.800 -0.017 0.000 2.422 230 G HA2 -0.322 3.618 3.960 -0.033 0.000 0.218 230 G HA3 -0.322 3.587 3.960 -0.086 0.000 0.218 230 G C 1.206 176.000 174.900 -0.178 0.000 1.146 230 G CA 1.921 46.970 45.100 -0.085 0.000 0.769 230 G HN -0.233 8.055 8.290 -0.003 0.000 0.547 231 I N 2.213 122.575 120.570 -0.348 0.000 2.226 231 I HA -0.378 3.610 4.170 -0.303 0.000 0.245 231 I C 1.763 177.797 176.117 -0.138 0.000 1.100 231 I CA 1.451 62.559 61.300 -0.320 0.000 1.374 231 I CB -1.339 36.380 38.000 -0.467 0.000 1.057 231 I HN -0.011 7.927 8.210 -0.454 0.000 0.413 232 A N -0.629 122.132 122.820 -0.099 0.000 1.908 232 A HA -0.420 3.889 4.320 -0.017 0.000 0.218 232 A C 2.043 179.631 177.584 0.007 0.000 1.181 232 A CA 3.466 55.477 52.037 -0.044 0.000 0.627 232 A CB -1.034 17.917 19.000 -0.082 0.000 0.818 232 A HN 0.021 8.104 8.150 -0.112 0.000 0.445 233 Q N -0.818 118.968 119.800 -0.023 0.000 2.119 233 Q HA -0.329 4.051 4.340 0.065 0.000 0.201 233 Q C 2.146 178.231 176.000 0.142 0.000 0.972 233 Q CA 2.918 58.750 55.803 0.048 0.000 0.847 233 Q CB -0.080 28.650 28.738 -0.014 0.000 0.903 233 Q HN -0.302 7.933 8.270 -0.058 0.000 0.433 234 A N 0.042 122.893 122.820 0.051 0.000 1.902 234 A HA -0.329 4.025 4.320 0.056 0.000 0.217 234 A C 1.948 179.579 177.584 0.077 0.000 1.181 234 A CA 3.182 55.246 52.037 0.044 0.000 0.623 234 A CB -0.529 18.459 19.000 -0.019 0.000 0.818 234 A HN -0.265 7.883 8.150 -0.003 0.000 0.443 235 L N -2.659 118.610 121.223 0.078 0.000 2.046 235 L HA -0.374 4.024 4.340 0.097 0.000 0.208 235 L C 2.598 179.557 176.870 0.148 0.000 1.077 235 L CA 2.687 57.589 54.840 0.102 0.000 0.747 235 L CB -0.303 41.805 42.059 0.082 0.000 0.896 235 L HN -0.042 8.215 8.230 0.044 0.000 0.432 236 W N 1.167 122.458 121.300 -0.016 0.000 2.342 236 W HA -0.393 4.262 4.660 -0.008 0.000 0.297 236 W C 1.035 177.552 176.519 -0.003 0.000 1.213 236 W CA 3.258 60.594 57.345 -0.014 0.000 1.251 236 W CB -0.010 29.432 29.460 -0.030 0.000 1.136 236 W HN 0.079 8.448 8.180 0.315 0.000 0.526 237 A N -4.860 118.016 122.820 0.092 0.000 2.208 237 A HA 0.016 4.186 4.320 -0.251 0.000 0.209 237 A C 0.395 177.945 177.584 -0.058 0.000 1.161 237 A CA 0.178 52.177 52.037 -0.064 0.000 0.782 237 A CB 0.295 19.330 19.000 0.057 0.000 0.816 237 A HN -0.625 7.558 8.150 0.229 0.105 0.477 238 G N -0.377 108.424 108.800 0.001 0.000 2.176 238 G HA2 -0.277 3.732 3.960 0.081 0.000 0.252 238 G HA3 -0.277 3.709 3.960 0.042 0.000 0.252 238 G C -0.430 174.563 174.900 0.155 0.000 1.024 238 G CA 0.479 45.619 45.100 0.066 0.000 0.755 238 G HN -0.415 7.694 8.290 0.020 0.193 0.507 239 K N -3.223 117.228 120.400 0.085 0.000 2.469 239 K HA 0.303 4.531 4.320 -0.154 0.000 0.204 239 K C -1.563 174.999 176.600 -0.064 0.000 1.047 239 K CA -1.615 54.617 56.287 -0.092 0.000 1.072 239 K CB 0.720 33.115 32.500 -0.174 0.000 0.863 239 K HN -0.137 8.155 8.250 0.070 0.000 0.530 240 L N 1.856 123.177 121.223 0.162 0.000 2.387 240 L HA 0.069 4.467 4.340 0.096 0.000 0.267 240 L C -0.821 176.317 176.870 0.445 0.000 1.197 240 L CA -0.368 54.583 54.840 0.185 0.000 1.070 240 L CB -1.067 41.041 42.059 0.082 0.000 1.349 240 L HN -0.197 8.146 8.230 0.187 0.000 0.422 241 F N 4.443 124.490 119.950 0.163 0.000 2.512 241 F HA -0.060 4.565 4.527 0.163 0.000 0.296 241 F C -0.246 175.722 175.800 0.280 0.000 1.110 241 F CA -0.293 57.818 58.000 0.185 0.000 1.446 241 F CB 0.581 39.666 39.000 0.141 0.000 1.092 241 F HN -0.377 8.122 8.300 0.332 0.000 0.554 242 H N -4.256 115.008 119.070 0.323 0.000 2.967 242 H HA 0.309 5.041 4.556 0.295 0.000 0.318 242 H C -2.035 173.361 175.328 0.114 0.000 1.375 242 H CA -0.541 55.639 56.048 0.220 0.000 1.132 242 H CB 3.830 33.670 29.762 0.130 0.000 1.848 242 H HN -0.875 7.613 8.280 0.408 0.038 0.524 243 I N 0.349 120.850 120.570 -0.115 0.000 2.913 243 I HA 0.194 4.561 4.170 0.089 -0.143 0.302 243 I C -3.234 172.890 176.117 0.012 0.000 1.246 243 I CA -1.685 59.594 61.300 -0.035 0.000 1.010 243 I CB 4.287 42.159 38.000 -0.214 0.000 1.259 243 I HN 0.186 8.062 8.210 -0.556 0.000 0.434 244 D N 5.952 126.405 120.400 0.088 0.000 2.344 244 D HA 0.511 5.365 4.640 0.104 -0.152 0.239 244 D C -1.060 175.178 176.300 -0.105 0.000 1.064 244 D CA -1.212 52.820 54.000 0.054 0.000 0.829 244 D CB 1.957 42.804 40.800 0.078 0.000 1.129 244 D HN 0.100 8.541 8.370 0.120 0.000 0.506 245 L N 3.266 124.358 121.223 -0.218 0.000 2.295 245 L HA 0.388 4.623 4.340 -0.175 0.000 0.285 245 L C -1.726 175.193 176.870 0.083 0.000 1.035 245 L CA -0.483 54.224 54.840 -0.222 0.000 0.806 245 L CB 0.826 42.469 42.059 -0.692 0.000 1.214 245 L HN 0.596 8.650 8.230 -0.293 0.000 0.426 246 N N 0.781 119.609 118.700 0.214 0.000 3.441 246 N HA 0.078 5.047 4.740 0.320 -0.037 0.313 246 N C -1.864 173.742 175.510 0.159 0.000 1.526 246 N CA -0.970 52.215 53.050 0.226 0.000 0.871 246 N CB 2.362 40.913 38.487 0.106 0.000 1.779 246 N HN -0.057 8.444 8.380 0.202 0.000 0.529 247 G N -3.587 105.242 108.800 0.047 0.000 2.574 247 G HA2 0.275 4.203 3.960 -0.053 0.000 0.299 247 G HA3 0.275 4.341 3.960 -0.049 -0.136 0.299 247 G C -2.870 171.993 174.900 -0.063 0.000 1.298 247 G CA -1.033 44.046 45.100 -0.035 0.000 0.952 247 G HN 0.084 8.323 8.290 0.063 0.089 0.477 248 Q N -0.555 119.194 119.800 -0.085 0.000 2.320 248 Q HA 0.302 4.568 4.340 -0.124 0.000 0.272 248 Q C -1.407 174.537 176.000 -0.093 0.000 1.023 248 Q CA -0.503 55.237 55.803 -0.105 0.000 0.855 248 Q CB 3.259 31.934 28.738 -0.105 0.000 1.367 248 Q HN 0.148 8.367 8.270 -0.084 0.000 0.406 249 S N 6.432 122.069 115.700 -0.105 0.000 2.614 249 S HA 0.153 4.585 4.470 -0.063 0.000 0.230 249 S C -0.821 173.743 174.600 -0.059 0.000 0.952 249 S CA -0.214 57.943 58.200 -0.073 0.000 0.949 249 S CB 0.213 63.377 63.200 -0.060 0.000 0.786 249 S HN 0.510 8.998 8.310 -0.139 -0.262 0.478 250 G N -0.715 108.047 108.800 -0.063 0.000 2.325 250 G HA2 -0.188 3.754 3.960 -0.030 0.000 0.285 250 G HA3 -0.188 3.752 3.960 -0.034 0.000 0.285 250 G C -2.543 172.328 174.900 -0.047 0.000 1.303 250 G CA -0.783 44.292 45.100 -0.042 0.000 0.970 250 G HN -0.992 7.187 8.290 -0.064 0.072 0.490 251 I N 1.808 122.364 120.570 -0.024 0.000 2.294 251 I HA 0.011 4.170 4.170 -0.017 0.000 0.295 251 I C -0.578 175.535 176.117 -0.006 0.000 1.098 251 I CA 0.572 61.864 61.300 -0.012 0.000 1.277 251 I CB -0.971 37.031 38.000 0.004 0.000 1.434 251 I HN 0.174 8.375 8.210 -0.016 0.000 0.498 252 K N 6.096 126.482 120.400 -0.024 0.000 2.670 252 K HA 0.109 4.470 4.320 0.070 0.000 0.289 252 K C -1.959 174.633 176.600 -0.013 0.000 1.045 252 K CA -1.686 54.608 56.287 0.011 0.000 0.834 252 K CB 1.363 33.867 32.500 0.007 0.000 1.531 252 K HN -0.333 7.892 8.250 -0.042 0.000 0.376 253 Y N -3.204 117.113 120.300 0.029 0.000 2.861 253 Y HA -0.257 4.306 4.550 0.023 0.000 0.344 253 Y C -1.147 174.764 175.900 0.018 0.000 1.272 253 Y CA -0.483 57.634 58.100 0.028 0.000 1.502 253 Y CB 0.060 38.550 38.460 0.049 0.000 1.333 253 Y HN -0.112 8.392 8.280 0.374 0.000 0.634 254 D N 0.636 121.034 120.400 -0.002 0.000 2.342 254 D HA -0.165 4.417 4.640 -0.097 0.000 0.260 254 D C 0.096 176.323 176.300 -0.122 0.000 1.278 254 D CA 0.346 54.308 54.000 -0.065 0.000 0.910 254 D CB 0.272 41.083 40.800 0.019 0.000 1.079 254 D HN -0.281 8.556 8.370 0.131 -0.388 0.496 255 Q N 5.124 124.756 119.800 -0.280 0.000 2.163 255 Q HA -0.046 4.222 4.340 -0.121 0.000 0.198 255 Q C 0.340 176.281 176.000 -0.099 0.000 0.954 255 Q CA 1.199 56.871 55.803 -0.218 0.000 0.851 255 Q CB 0.928 29.497 28.738 -0.283 0.000 0.928 255 Q HN 0.330 8.792 8.270 -0.285 -0.363 0.459 256 D N -3.236 117.112 120.400 -0.088 0.000 2.699 256 D HA -0.370 4.254 4.640 -0.026 0.000 0.239 256 D C -0.965 175.358 176.300 0.037 0.000 1.136 256 D CA 1.024 54.997 54.000 -0.045 0.000 0.668 256 D CB -2.227 38.502 40.800 -0.118 0.000 1.060 256 D HN -0.235 8.078 8.370 -0.095 0.000 0.429 257 L N -2.739 118.507 121.223 0.038 0.000 2.476 257 L HA -0.106 4.306 4.340 0.120 0.000 0.264 257 L C 0.692 177.664 176.870 0.171 0.000 1.224 257 L CA 0.388 55.283 54.840 0.092 0.000 0.821 257 L CB 0.343 42.414 42.059 0.021 0.000 1.101 257 L HN -0.397 7.827 8.230 -0.010 0.000 0.488 258 R N -1.656 118.943 120.500 0.165 0.000 2.734 258 R HA -0.177 4.109 4.340 -0.090 0.000 0.266 258 R C -0.542 175.741 176.300 -0.029 0.000 1.044 258 R CA 0.127 56.209 56.100 -0.030 0.000 1.128 258 R CB 0.493 30.682 30.300 -0.184 0.000 1.010 258 R HN 0.234 8.602 8.270 0.163 0.000 0.461 259 F N 3.206 123.037 119.950 -0.199 0.000 2.572 259 F HA -0.282 4.138 4.527 -0.019 0.095 0.370 259 F C 0.680 176.426 175.800 -0.090 0.000 1.103 259 F CA 1.845 59.808 58.000 -0.062 0.000 1.286 259 F CB 0.741 39.816 39.000 0.126 0.000 1.105 259 F HN -0.511 7.735 8.300 -0.090 0.000 0.583 260 G N 5.776 114.027 108.800 -0.915 0.000 2.345 260 G HA2 -0.438 3.020 3.960 -0.836 0.000 0.218 260 G HA3 -0.438 3.208 3.960 -0.522 0.000 0.218 260 G C -1.336 173.350 174.900 -0.357 0.000 1.058 260 G CA -0.196 44.501 45.100 -0.671 0.000 0.632 260 G HN 0.434 8.045 8.290 -1.132 0.000 0.508 261 A N 1.026 123.703 122.820 -0.238 0.000 2.310 261 A HA 0.278 4.514 4.320 -0.140 0.000 0.260 261 A C 0.543 178.047 177.584 -0.133 0.000 1.112 261 A CA 0.269 52.219 52.037 -0.145 0.000 0.804 261 A CB 0.247 19.196 19.000 -0.085 0.000 1.081 261 A HN -0.665 7.265 8.150 -0.226 0.084 0.499 262 G N 0.753 109.495 108.800 -0.096 0.000 2.543 262 G HA2 -0.426 3.491 3.960 -0.071 0.000 0.286 262 G HA3 -0.426 3.659 3.960 -0.085 -0.176 0.286 262 G C -0.596 174.253 174.900 -0.085 0.000 1.153 262 G CA 0.836 45.886 45.100 -0.084 0.000 0.968 262 G HN 0.257 8.497 8.290 -0.082 0.000 0.544 263 D N 3.929 124.283 120.400 -0.077 0.000 2.453 263 D HA 0.172 4.782 4.640 -0.050 0.000 0.223 263 D C 0.578 176.832 176.300 -0.077 0.000 1.183 263 D CA -1.520 52.447 54.000 -0.054 0.000 0.933 263 D CB -0.539 40.250 40.800 -0.019 0.000 1.038 263 D HN -0.129 8.195 8.370 -0.077 0.000 0.513 264 L N 6.846 128.007 121.223 -0.102 0.000 2.046 264 L HA -0.184 4.037 4.340 -0.199 0.000 0.208 264 L C 1.159 177.964 176.870 -0.107 0.000 1.077 264 L CA 2.316 57.069 54.840 -0.145 0.000 0.747 264 L CB 0.139 42.106 42.059 -0.153 0.000 0.896 264 L HN -0.336 7.839 8.230 -0.093 0.000 0.432 265 R N -1.823 118.640 120.500 -0.063 0.000 2.081 265 R HA -0.399 3.857 4.340 -0.140 0.000 0.235 265 R C 2.020 178.394 176.300 0.123 0.000 1.131 265 R CA 3.367 59.453 56.100 -0.023 0.000 0.960 265 R CB -0.642 29.691 30.300 0.055 0.000 0.856 265 R HN -0.090 8.146 8.270 -0.057 0.000 0.436 266 A N -1.518 121.392 122.820 0.150 0.000 1.972 266 A HA -0.178 4.357 4.320 0.359 0.000 0.219 266 A C 1.879 179.581 177.584 0.197 0.000 1.169 266 A CA 2.735 54.909 52.037 0.228 0.000 0.635 266 A CB -0.935 18.162 19.000 0.161 0.000 0.810 266 A HN -0.280 8.225 8.150 0.091 -0.299 0.446 267 A N -0.686 122.169 122.820 0.059 0.000 1.902 267 A HA -0.358 4.076 4.320 0.191 0.000 0.217 267 A C 1.206 178.819 177.584 0.049 0.000 1.181 267 A CA 3.155 55.199 52.037 0.011 0.000 0.623 267 A CB -0.556 18.194 19.000 -0.417 0.000 0.818 267 A HN -0.384 7.657 8.150 -0.005 0.106 0.443 268 F N 0.648 120.471 119.950 -0.211 0.000 2.069 268 F HA -0.388 3.966 4.527 -0.288 0.000 0.298 268 F C 1.025 176.656 175.800 -0.281 0.000 1.113 268 F CA 4.140 61.932 58.000 -0.347 0.000 1.214 268 F CB 0.072 38.716 39.000 -0.594 0.000 0.978 268 F HN -0.415 7.908 8.300 0.038 0.000 0.474 269 W N -3.227 118.060 121.300 -0.021 0.000 2.402 269 W HA -0.392 4.074 4.660 -0.325 0.000 0.286 269 W C 2.125 178.585 176.519 -0.098 0.000 1.221 269 W CA 2.631 59.899 57.345 -0.128 0.000 1.257 269 W CB -0.035 29.438 29.460 0.022 0.000 1.120 269 W HN -0.087 8.120 8.180 0.045 0.000 0.551 270 L N 0.119 121.463 121.223 0.201 0.000 1.994 270 L HA -0.346 4.088 4.340 0.156 0.000 0.208 270 L C 1.444 178.351 176.870 0.062 0.000 1.071 270 L CA 3.562 58.507 54.840 0.175 0.000 0.745 270 L CB -0.438 41.817 42.059 0.326 0.000 0.892 270 L HN -0.092 8.262 8.230 0.230 0.014 0.431 271 V N -0.741 119.156 119.914 -0.028 0.000 2.343 271 V HA -0.495 3.569 4.120 -0.094 0.000 0.247 271 V C 2.199 178.203 176.094 -0.151 0.000 1.051 271 V CA 4.146 66.349 62.300 -0.161 0.000 1.036 271 V CB -1.260 30.338 31.823 -0.374 0.000 0.654 271 V HN -0.236 7.948 8.190 -0.009 0.000 0.451 272 D N -0.132 120.109 120.400 -0.265 0.000 2.116 272 D HA -0.335 4.189 4.640 -0.194 0.000 0.193 272 D C 2.020 178.311 176.300 -0.014 0.000 0.998 272 D CA 3.457 57.342 54.000 -0.192 0.000 0.836 272 D CB 0.210 40.841 40.800 -0.281 0.000 0.951 272 D HN -0.291 7.845 8.370 -0.390 0.000 0.449 273 L N -0.274 120.965 121.223 0.027 0.000 2.027 273 L HA -0.185 4.190 4.340 0.059 0.000 0.206 273 L C 1.608 178.505 176.870 0.045 0.000 1.074 273 L CA 2.689 57.558 54.840 0.048 0.000 0.745 273 L CB -0.120 41.966 42.059 0.045 0.000 0.898 273 L HN -0.593 7.653 8.230 0.026 0.000 0.433 274 L N -1.907 119.343 121.223 0.046 0.000 2.042 274 L HA -0.511 3.872 4.340 0.072 0.000 0.210 274 L C 2.345 179.295 176.870 0.133 0.000 1.076 274 L CA 3.532 58.427 54.840 0.091 0.000 0.749 274 L CB -0.737 41.395 42.059 0.121 0.000 0.893 274 L HN 0.080 8.332 8.230 0.035 0.000 0.432 275 E N -1.713 118.548 120.200 0.101 0.000 2.072 275 E HA -0.240 4.176 4.350 0.110 0.000 0.190 275 E C 3.444 180.084 176.600 0.067 0.000 0.982 275 E CA 2.240 58.694 56.400 0.090 0.000 0.803 275 E CB -0.699 29.041 29.700 0.068 0.000 0.755 275 E HN -0.143 8.261 8.360 0.073 0.000 0.453 276 S N 1.145 116.880 115.700 0.058 0.000 2.370 276 S HA -0.253 4.246 4.470 0.049 0.000 0.226 276 S C 1.398 176.032 174.600 0.057 0.000 1.033 276 S CA 2.960 61.193 58.200 0.055 0.000 1.011 276 S CB -0.165 63.070 63.200 0.059 0.000 0.852 276 S HN -0.058 8.284 8.310 0.052 0.000 0.457 277 A N -2.450 120.411 122.820 0.069 0.000 2.167 277 A HA 0.045 4.404 4.320 0.065 0.000 0.214 277 A C 0.160 177.792 177.584 0.080 0.000 1.151 277 A CA 0.104 52.186 52.037 0.075 0.000 0.735 277 A CB 0.097 19.148 19.000 0.084 0.000 0.802 277 A HN -0.380 7.794 8.150 0.073 0.020 0.467 278 G N -2.095 106.753 108.800 0.080 0.000 2.198 278 G HA2 -0.328 3.658 3.960 0.043 0.000 0.257 278 G HA3 -0.328 3.654 3.960 0.036 0.000 0.257 278 G C 0.058 175.001 174.900 0.071 0.000 1.042 278 G CA 0.216 45.350 45.100 0.056 0.000 0.791 278 G HN -0.726 7.388 8.290 0.081 0.225 0.502 279 Y N -1.131 119.165 120.300 -0.007 0.000 2.805 279 Y HA -0.271 4.270 4.550 -0.015 0.000 0.331 279 Y C -0.753 175.114 175.900 -0.055 0.000 1.241 279 Y CA 0.570 58.657 58.100 -0.022 0.000 1.546 279 Y CB 0.903 39.353 38.460 -0.017 0.000 1.248 279 Y HN -0.718 7.699 8.280 0.229 0.000 0.559 280 E N 6.784 126.606 120.200 -0.630 0.000 2.498 280 E HA -0.024 4.069 4.350 -0.429 0.000 0.203 280 E C -0.519 175.618 176.600 -0.771 0.000 1.013 280 E CA -0.418 55.650 56.400 -0.554 0.000 0.927 280 E CB 0.544 30.065 29.700 -0.298 0.000 1.012 280 E HN 0.472 8.496 8.360 -0.561 0.000 0.482 281 G N 0.499 108.444 108.800 -1.425 0.000 2.588 281 G HA2 0.243 3.893 3.960 -0.516 0.000 0.278 281 G HA3 0.243 3.751 3.960 -0.754 0.000 0.278 281 G C -2.723 171.796 174.900 -0.635 0.000 1.307 281 G CA -1.501 43.071 45.100 -0.880 0.000 1.016 281 G HN -0.425 6.426 8.290 -2.399 0.000 0.503 282 P HA 0.054 4.343 4.420 -0.379 -0.097 0.268 282 P C -1.014 176.123 177.300 -0.271 0.000 1.205 282 P CA -0.049 62.864 63.100 -0.310 0.000 0.771 282 P CB 0.491 32.080 31.700 -0.185 0.000 0.858 283 R N 3.290 123.573 120.500 -0.363 0.000 2.593 283 R HA 0.255 4.355 4.340 -0.400 0.000 0.282 283 R C -1.220 174.691 176.300 -0.649 0.000 1.300 283 R CA -1.731 54.079 56.100 -0.484 0.000 1.221 283 R CB -0.589 29.322 30.300 -0.648 0.000 1.157 283 R HN 0.211 8.231 8.270 -0.417 0.000 0.555 284 H N 4.634 123.280 119.070 -0.707 0.000 2.489 284 H HA 0.301 4.722 4.556 -0.547 -0.194 0.322 284 H C -1.635 173.225 175.328 -0.780 0.000 1.091 284 H CA -1.502 54.187 56.048 -0.600 0.000 1.291 284 H CB 2.220 31.844 29.762 -0.231 0.000 1.436 284 H HN -0.183 7.834 8.280 -0.438 0.000 0.480 285 F N 6.294 125.756 119.950 -0.815 0.000 2.404 285 F HA 0.342 4.811 4.527 -0.429 -0.199 0.354 285 F C -1.210 174.258 175.800 -0.554 0.000 1.122 285 F CA -1.331 56.296 58.000 -0.623 0.000 1.080 285 F CB 0.906 39.477 39.000 -0.716 0.000 1.131 285 F HN 0.575 8.234 8.300 -1.069 0.000 0.471 286 D N 4.038 124.379 120.400 -0.097 0.000 2.477 286 D HA 0.220 4.833 4.640 -0.046 0.000 0.239 286 D C -2.214 174.189 176.300 0.172 0.000 1.102 286 D CA -1.852 52.178 54.000 0.051 0.000 0.901 286 D CB 0.921 41.843 40.800 0.203 0.000 1.026 286 D HN -0.324 8.012 8.370 -0.057 0.000 0.515 287 F N 0.140 120.068 119.950 -0.037 0.000 2.650 287 F HA 0.280 4.853 4.527 -0.049 -0.076 0.320 287 F C -3.204 172.562 175.800 -0.057 0.000 1.091 287 F CA -2.426 55.557 58.000 -0.028 0.000 0.962 287 F CB 2.628 41.640 39.000 0.020 0.000 1.363 287 F HN -0.731 7.719 8.300 0.250 0.000 0.482 288 K N 0.710 120.801 120.400 -0.515 0.000 2.450 288 K HA 0.484 4.417 4.320 -0.647 0.000 0.257 288 K C -2.456 173.937 176.600 -0.345 0.000 0.953 288 K CA -3.187 52.755 56.287 -0.575 0.000 0.844 288 K CB 1.851 33.928 32.500 -0.706 0.000 1.103 288 K HN 0.192 8.337 8.250 -0.174 0.000 0.429 289 P HA 0.085 4.595 4.420 0.149 0.000 0.263 289 P C -2.113 175.302 177.300 0.193 0.000 1.195 289 P CA -1.311 61.802 63.100 0.022 0.000 0.762 289 P CB -0.479 31.192 31.700 -0.048 0.000 0.799 290 P HA -0.027 4.611 4.420 0.363 0.000 0.267 290 P C 0.751 178.176 177.300 0.209 0.000 1.201 290 P CA 0.233 63.486 63.100 0.255 0.000 0.775 290 P CB 0.516 32.311 31.700 0.158 0.000 0.854 291 R N 0.814 121.442 120.500 0.214 0.000 2.316 291 R HA -0.254 4.007 4.340 -0.131 0.000 0.202 291 R C 0.293 176.574 176.300 -0.030 0.000 1.029 291 R CA 2.285 58.364 56.100 -0.036 0.000 1.018 291 R CB -0.716 29.483 30.300 -0.169 0.000 0.888 291 R HN 0.420 8.885 8.270 0.326 0.000 0.471 292 T N -5.570 108.999 114.554 0.024 0.000 2.929 292 T HA -0.235 4.114 4.350 -0.002 0.000 0.271 292 T C 0.499 175.194 174.700 -0.007 0.000 1.085 292 T CA 1.143 63.248 62.100 0.009 0.000 1.125 292 T CB -0.181 68.704 68.868 0.029 0.000 0.874 292 T HN -0.466 7.770 8.240 0.064 0.042 0.494 293 E N 1.882 122.076 120.200 -0.010 0.000 2.313 293 E HA 0.160 4.501 4.350 -0.015 0.000 0.272 293 E C -0.321 176.245 176.600 -0.057 0.000 1.038 293 E CA -1.162 55.224 56.400 -0.024 0.000 0.863 293 E CB 1.002 30.693 29.700 -0.015 0.000 1.060 293 E HN -0.497 7.799 8.360 0.001 0.065 0.402 294 D N 1.745 122.115 120.400 -0.051 0.000 2.478 294 D HA -0.007 4.588 4.640 -0.075 0.000 0.269 294 D C 1.317 177.559 176.300 -0.096 0.000 1.232 294 D CA -1.112 52.851 54.000 -0.062 0.000 1.059 294 D CB 0.730 41.510 40.800 -0.033 0.000 1.104 294 D HN 0.120 8.469 8.370 -0.035 0.000 0.566 295 I N -1.648 118.868 120.570 -0.090 0.000 2.264 295 I HA -0.320 3.683 4.170 -0.277 0.000 0.248 295 I C 0.303 176.342 176.117 -0.131 0.000 1.111 295 I CA 2.306 63.514 61.300 -0.152 0.000 1.382 295 I CB 0.195 38.174 38.000 -0.034 0.000 1.060 295 I HN 0.099 8.274 8.210 -0.059 0.000 0.418 296 D N -1.011 119.395 120.400 0.010 0.000 2.144 296 D HA -0.247 4.514 4.640 0.201 0.000 0.200 296 D C 2.555 178.874 176.300 0.033 0.000 0.978 296 D CA 3.459 57.511 54.000 0.087 0.000 0.833 296 D CB -0.644 40.203 40.800 0.079 0.000 0.961 296 D HN -0.584 7.897 8.370 0.011 -0.104 0.470 297 G N -0.407 108.380 108.800 -0.021 0.000 2.448 297 G HA2 -0.218 3.749 3.960 0.012 0.000 0.218 297 G HA3 -0.218 3.870 3.960 -0.018 -0.139 0.218 297 G C 1.194 176.059 174.900 -0.058 0.000 1.135 297 G CA 1.657 46.746 45.100 -0.019 0.000 0.784 297 G HN -0.514 7.991 8.290 -0.029 -0.233 0.543 298 V N 2.276 122.069 119.914 -0.203 0.000 2.252 298 V HA -0.629 3.368 4.120 -0.205 0.000 0.249 298 V C 1.386 177.306 176.094 -0.291 0.000 1.056 298 V CA 4.291 66.375 62.300 -0.359 0.000 1.022 298 V CB -0.109 31.274 31.823 -0.733 0.000 0.641 298 V HN -0.343 7.628 8.190 -0.225 0.084 0.445 299 W N -3.102 118.206 121.300 0.014 0.000 2.436 299 W HA -0.345 4.286 4.660 -0.048 0.000 0.284 299 W C 1.813 178.317 176.519 -0.025 0.000 1.225 299 W CA 2.356 59.687 57.345 -0.024 0.000 1.271 299 W CB -0.449 28.991 29.460 -0.034 0.000 1.114 299 W HN -0.622 7.320 8.180 -0.396 0.000 0.559 300 A N -1.101 121.813 122.820 0.156 0.000 1.902 300 A HA -0.414 3.957 4.320 0.084 0.000 0.217 300 A C 2.079 179.688 177.584 0.042 0.000 1.181 300 A CA 3.062 55.148 52.037 0.083 0.000 0.623 300 A CB -1.060 17.974 19.000 0.057 0.000 0.818 300 A HN -0.101 8.130 8.150 0.135 0.000 0.443 301 S N -1.292 114.446 115.700 0.062 0.000 2.368 301 S HA -0.308 4.166 4.470 0.006 0.000 0.224 301 S C 1.855 176.402 174.600 -0.088 0.000 1.029 301 S CA 2.908 61.146 58.200 0.063 0.000 0.988 301 S CB -0.318 63.034 63.200 0.253 0.000 0.838 301 S HN -0.284 8.068 8.310 0.071 0.000 0.462 302 A N 0.727 123.564 122.820 0.028 0.000 1.877 302 A HA -0.276 3.834 4.320 -0.350 0.000 0.216 302 A C 1.331 178.812 177.584 -0.171 0.000 1.186 302 A CA 2.857 54.817 52.037 -0.128 0.000 0.620 302 A CB -0.707 18.242 19.000 -0.085 0.000 0.822 302 A HN -0.378 7.859 8.150 0.146 0.000 0.443 303 A N -2.296 120.484 122.820 -0.067 0.000 1.933 303 A HA -0.362 3.920 4.320 -0.063 0.000 0.218 303 A C 1.829 179.327 177.584 -0.143 0.000 1.175 303 A CA 2.877 54.873 52.037 -0.068 0.000 0.628 303 A CB -0.540 18.460 19.000 -0.001 0.000 0.814 303 A HN -0.110 8.042 8.150 0.004 0.000 0.444 304 G N -2.522 106.181 108.800 -0.160 0.000 2.422 304 G HA2 -0.386 3.494 3.960 -0.133 0.000 0.218 304 G HA3 -0.386 3.478 3.960 -0.159 0.000 0.218 304 G C 0.779 175.504 174.900 -0.292 0.000 1.146 304 G CA 1.912 46.904 45.100 -0.181 0.000 0.769 304 G HN -0.207 7.905 8.290 -0.131 0.099 0.547 305 C N 3.305 122.297 119.300 -0.513 0.000 2.393 305 C HA -0.292 3.852 4.460 -0.526 0.000 0.276 305 C C 2.506 177.071 174.990 -0.709 0.000 1.215 305 C CA 3.700 62.228 59.018 -0.816 0.000 1.743 305 C CB -1.695 24.991 27.740 -1.756 0.000 2.044 305 C HN -0.370 7.539 8.230 -0.535 0.000 0.464 306 M N -1.693 117.460 119.600 -0.745 0.000 2.132 306 M HA -0.446 3.321 4.480 -1.188 0.000 0.263 306 M C 1.972 178.119 176.300 -0.255 0.000 1.065 306 M CA 4.013 58.843 55.300 -0.783 0.000 1.122 306 M CB -0.317 31.846 32.600 -0.727 0.000 1.365 306 M HN -0.713 7.183 8.290 -0.657 0.000 0.411 307 R N -0.171 120.248 120.500 -0.135 0.000 2.083 307 R HA -0.398 3.986 4.340 0.073 0.000 0.237 307 R C 2.047 178.332 176.300 -0.026 0.000 1.137 307 R CA 3.975 60.066 56.100 -0.016 0.000 0.951 307 R CB -0.141 30.137 30.300 -0.035 0.000 0.851 307 R HN 0.043 8.204 8.270 -0.183 0.000 0.434 308 N N -1.026 117.645 118.700 -0.047 0.000 2.166 308 N HA -0.352 4.316 4.740 -0.121 0.000 0.186 308 N C 2.103 177.689 175.510 0.126 0.000 1.019 308 N CA 3.139 56.165 53.050 -0.040 0.000 0.856 308 N CB -0.049 38.364 38.487 -0.123 0.000 0.993 308 N HN -0.223 8.104 8.380 -0.088 0.000 0.426 309 Y N 1.862 122.322 120.300 0.267 0.000 2.128 309 Y HA -0.444 4.454 4.550 0.580 0.000 0.284 309 Y C 1.406 177.486 175.900 0.300 0.000 1.154 309 Y CA 4.012 62.370 58.100 0.431 0.000 1.149 309 Y CB 0.086 38.858 38.460 0.519 0.000 0.976 309 Y HN -0.591 7.937 8.280 0.414 0.000 0.505 310 L N -2.138 119.375 121.223 0.483 0.000 2.083 310 L HA -0.457 4.185 4.340 0.504 0.000 0.209 310 L C 2.245 179.245 176.870 0.216 0.000 1.083 310 L CA 3.242 58.337 54.840 0.424 0.000 0.752 310 L CB -0.273 42.069 42.059 0.471 0.000 0.899 310 L HN -0.382 8.117 8.230 0.447 0.000 0.433 311 I N -0.699 119.825 120.570 -0.076 0.000 2.179 311 I HA -0.571 3.346 4.170 -0.423 0.000 0.242 311 I C 2.034 178.111 176.117 -0.065 0.000 1.088 311 I CA 4.592 65.699 61.300 -0.322 0.000 1.357 311 I CB -0.212 37.456 38.000 -0.554 0.000 1.051 311 I HN -0.096 8.062 8.210 -0.087 0.000 0.409 312 L N -1.783 119.408 121.223 -0.054 0.000 2.083 312 L HA -0.487 3.880 4.340 0.046 0.000 0.209 312 L C 1.930 178.775 176.870 -0.042 0.000 1.083 312 L CA 3.276 58.101 54.840 -0.026 0.000 0.752 312 L CB -0.790 41.221 42.059 -0.081 0.000 0.899 312 L HN -0.185 8.007 8.230 -0.063 0.000 0.433 313 K N -0.492 119.877 120.400 -0.051 0.000 2.057 313 K HA -0.474 3.800 4.320 -0.076 0.000 0.207 313 K C 1.557 178.204 176.600 0.079 0.000 1.049 313 K CA 3.756 60.043 56.287 0.000 0.000 0.931 313 K CB -0.321 32.257 32.500 0.129 0.000 0.714 313 K HN 0.008 8.233 8.250 -0.042 0.000 0.440 314 E N -0.742 119.546 120.200 0.147 0.000 2.051 314 E HA -0.349 4.099 4.350 0.163 0.000 0.192 314 E C 2.567 179.268 176.600 0.168 0.000 0.991 314 E CA 3.211 59.720 56.400 0.182 0.000 0.799 314 E CB -0.170 29.703 29.700 0.289 0.000 0.748 314 E HN -0.537 7.923 8.360 0.165 0.000 0.449 315 R N -2.195 118.408 120.500 0.171 0.000 2.092 315 R HA -0.248 4.240 4.340 0.247 0.000 0.231 315 R C 2.445 178.925 176.300 0.300 0.000 1.119 315 R CA 1.623 57.868 56.100 0.241 0.000 0.970 315 R CB -0.891 29.538 30.300 0.214 0.000 0.864 315 R HN -0.230 8.127 8.270 0.144 0.000 0.440 316 A N -0.995 121.923 122.820 0.163 0.000 1.898 316 A HA -0.159 4.172 4.320 0.019 0.000 0.216 316 A C 1.942 179.579 177.584 0.088 0.000 1.181 316 A CA 2.906 54.926 52.037 -0.028 0.000 0.620 316 A CB -0.910 17.854 19.000 -0.393 0.000 0.819 316 A HN 0.167 8.374 8.150 0.095 0.000 0.442 317 A N -1.635 121.227 122.820 0.070 0.000 1.902 317 A HA -0.413 3.937 4.320 0.050 0.000 0.217 317 A C 1.577 179.195 177.584 0.056 0.000 1.181 317 A CA 3.079 55.154 52.037 0.063 0.000 0.623 317 A CB -0.519 18.521 19.000 0.068 0.000 0.818 317 A HN -0.250 7.938 8.150 0.064 0.000 0.443 318 A N -1.447 121.426 122.820 0.088 0.000 1.902 318 A HA -0.251 4.110 4.320 0.068 0.000 0.217 318 A C 1.684 179.151 177.584 -0.195 0.000 1.181 318 A CA 2.734 54.812 52.037 0.067 0.000 0.623 318 A CB -0.673 18.463 19.000 0.227 0.000 0.818 318 A HN -0.315 7.910 8.150 0.125 0.000 0.443 319 F N -0.320 119.346 119.950 -0.474 0.000 2.069 319 F HA -0.336 3.241 4.527 -1.584 0.000 0.298 319 F C 2.086 177.722 175.800 -0.273 0.000 1.113 319 F CA 2.704 60.286 58.000 -0.696 0.000 1.214 319 F CB 0.278 39.179 39.000 -0.166 0.000 0.978 319 F HN -0.329 8.006 8.300 0.058 0.000 0.474 320 R N -2.698 117.687 120.500 -0.191 0.000 2.148 320 R HA -0.232 3.840 4.340 -0.447 0.000 0.223 320 R C 1.000 177.190 176.300 -0.183 0.000 1.088 320 R CA 1.227 57.181 56.100 -0.243 0.000 0.985 320 R CB -0.596 29.685 30.300 -0.031 0.000 0.880 320 R HN -0.250 8.041 8.270 0.035 0.000 0.451 321 A N -3.253 119.497 122.820 -0.118 0.000 2.123 321 A HA 0.020 4.309 4.320 -0.052 0.000 0.214 321 A C -0.141 177.407 177.584 -0.060 0.000 1.152 321 A CA 0.113 52.112 52.037 -0.062 0.000 0.728 321 A CB 0.389 19.382 19.000 -0.012 0.000 0.814 321 A HN -0.580 7.482 8.150 -0.103 0.026 0.464 322 D N 0.101 120.439 120.400 -0.102 0.000 2.401 322 D HA 0.174 4.836 4.640 0.036 0.000 0.254 322 D C -1.330 174.951 176.300 -0.033 0.000 1.192 322 D CA -2.363 51.626 54.000 -0.018 0.000 0.885 322 D CB 0.560 41.395 40.800 0.058 0.000 1.147 322 D HN -0.734 7.474 8.370 -0.191 0.047 0.478 323 P HA -0.249 4.160 4.420 -0.017 0.000 0.217 323 P C 1.270 178.570 177.300 0.000 0.000 1.148 323 P CA 2.066 65.163 63.100 -0.004 0.000 0.828 323 P CB 0.304 32.010 31.700 0.010 0.000 0.783 324 E N -2.428 117.786 120.200 0.025 0.000 2.150 324 E HA -0.278 4.091 4.350 0.032 0.000 0.193 324 E C 2.569 179.182 176.600 0.022 0.000 0.985 324 E CA 2.974 59.397 56.400 0.038 0.000 0.814 324 E CB -0.335 29.407 29.700 0.071 0.000 0.752 324 E HN -0.153 8.497 8.360 0.041 -0.266 0.466 325 V N 0.443 120.341 119.914 -0.027 0.000 2.379 325 V HA -0.505 3.585 4.120 -0.050 0.000 0.245 325 V C 1.692 177.707 176.094 -0.132 0.000 1.044 325 V CA 4.088 66.305 62.300 -0.139 0.000 1.036 325 V CB -0.222 31.321 31.823 -0.467 0.000 0.664 325 V HN -0.709 7.381 8.190 -0.022 0.087 0.453 326 Q N -0.742 118.990 119.800 -0.113 0.000 2.096 326 Q HA -0.456 3.834 4.340 -0.083 0.000 0.204 326 Q C 2.517 178.503 176.000 -0.024 0.000 0.982 326 Q CA 3.614 59.376 55.803 -0.069 0.000 0.850 326 Q CB -0.367 28.340 28.738 -0.052 0.000 0.901 326 Q HN -0.149 8.053 8.270 -0.114 0.000 0.422 327 E N -0.394 119.801 120.200 -0.009 0.000 2.072 327 E HA -0.294 4.062 4.350 0.010 0.000 0.191 327 E C 1.833 178.448 176.600 0.026 0.000 0.985 327 E CA 2.478 58.884 56.400 0.011 0.000 0.801 327 E CB -0.450 29.259 29.700 0.016 0.000 0.750 327 E HN -0.390 7.956 8.360 -0.013 0.006 0.452 328 A N -0.404 122.437 122.820 0.036 0.000 1.933 328 A HA -0.293 4.068 4.320 0.068 0.000 0.218 328 A C 2.249 179.883 177.584 0.084 0.000 1.175 328 A CA 3.180 55.259 52.037 0.070 0.000 0.628 328 A CB -0.561 18.501 19.000 0.103 0.000 0.814 328 A HN -0.348 7.818 8.150 0.027 0.000 0.444 329 L N -2.611 118.648 121.223 0.060 0.000 2.046 329 L HA -0.492 3.918 4.340 0.116 0.000 0.208 329 L C 2.336 179.246 176.870 0.067 0.000 1.077 329 L CA 3.220 58.104 54.840 0.074 0.000 0.747 329 L CB -0.556 41.523 42.059 0.034 0.000 0.896 329 L HN 0.096 8.342 8.230 0.027 0.000 0.432 330 R N -1.567 118.958 120.500 0.041 0.000 2.081 330 R HA -0.293 4.218 4.340 0.036 -0.149 0.235 330 R C 3.138 179.459 176.300 0.036 0.000 1.131 330 R CA 3.047 59.168 56.100 0.035 0.000 0.960 330 R CB -0.269 30.044 30.300 0.022 0.000 0.856 330 R HN -0.560 7.728 8.270 0.030 0.000 0.436 331 A N -0.389 122.453 122.820 0.037 0.000 1.978 331 A HA -0.260 4.068 4.320 0.013 0.000 0.220 331 A C 1.000 178.593 177.584 0.014 0.000 1.170 331 A CA 2.983 55.034 52.037 0.024 0.000 0.636 331 A CB -0.678 18.338 19.000 0.027 0.000 0.810 331 A HN 0.150 8.251 8.150 0.040 0.073 0.448 332 S N -4.017 111.717 115.700 0.057 0.000 2.605 332 S HA 0.242 4.862 4.470 -0.050 -0.181 0.217 332 S C -0.669 173.996 174.600 0.108 0.000 0.958 332 S CA -0.136 58.110 58.200 0.077 0.000 0.919 332 S CB 0.451 63.823 63.200 0.287 0.000 0.780 332 S HN -0.525 7.809 8.310 0.082 0.025 0.507 333 R N -3.121 117.421 120.500 0.071 0.000 3.776 333 R HA -0.419 4.107 4.340 0.047 -0.158 0.312 333 R C 0.441 176.791 176.300 0.084 0.000 1.181 333 R CA 0.750 56.887 56.100 0.062 0.000 0.836 333 R CB -3.061 27.264 30.300 0.042 0.000 1.324 333 R HN -0.371 7.737 8.270 0.058 0.196 0.501 334 L N -2.919 118.362 121.223 0.096 0.000 2.201 334 L HA -0.279 4.107 4.340 0.076 0.000 0.212 334 L C 0.887 177.785 176.870 0.046 0.000 1.105 334 L CA 2.829 57.714 54.840 0.074 0.000 0.775 334 L CB -1.171 40.931 42.059 0.073 0.000 0.913 334 L HN -0.280 7.976 8.230 0.106 0.038 0.440 335 D N -2.188 118.237 120.400 0.041 0.000 2.117 335 D HA -0.286 4.370 4.640 0.026 0.000 0.198 335 D C 2.205 178.521 176.300 0.027 0.000 0.982 335 D CA 2.748 56.765 54.000 0.029 0.000 0.828 335 D CB -1.285 39.529 40.800 0.024 0.000 0.967 335 D HN -0.008 8.372 8.370 0.045 0.016 0.464 336 E N 0.726 120.944 120.200 0.030 0.000 2.204 336 E HA -0.212 4.151 4.350 0.022 0.000 0.194 336 E C 2.129 178.743 176.600 0.024 0.000 0.989 336 E CA 2.024 58.439 56.400 0.026 0.000 0.824 336 E CB -0.065 29.652 29.700 0.028 0.000 0.756 336 E HN -0.324 8.057 8.360 0.035 0.000 0.477 337 L N -1.060 120.180 121.223 0.029 0.000 2.127 337 L HA -0.286 4.064 4.340 0.016 0.000 0.211 337 L C 0.496 177.373 176.870 0.012 0.000 1.089 337 L CA 2.311 57.162 54.840 0.019 0.000 0.757 337 L CB -0.034 42.036 42.059 0.018 0.000 0.899 337 L HN -0.507 7.728 8.230 0.036 0.017 0.434 338 A N -3.523 119.307 122.820 0.017 0.000 2.167 338 A HA -0.044 4.288 4.320 0.020 0.000 0.214 338 A C 0.125 177.720 177.584 0.019 0.000 1.151 338 A CA 0.266 52.314 52.037 0.020 0.000 0.735 338 A CB 0.222 19.235 19.000 0.022 0.000 0.802 338 A HN -0.701 7.331 8.150 0.020 0.130 0.467 339 Q N -0.099 119.711 119.800 0.016 0.000 2.314 339 Q HA 0.169 4.518 4.340 0.014 0.000 0.258 339 Q C -2.327 173.679 176.000 0.011 0.000 0.954 339 Q CA -2.176 53.635 55.803 0.013 0.000 0.890 339 Q CB -0.393 28.351 28.738 0.011 0.000 1.210 339 Q HN -0.672 7.449 8.270 0.016 0.159 0.410 340 P HA -0.019 4.408 4.420 0.013 0.000 0.265 340 P C 0.292 177.593 177.300 0.001 0.000 1.193 340 P CA 0.135 63.241 63.100 0.009 0.000 0.765 340 P CB 0.580 32.286 31.700 0.010 0.000 0.823 341 T N 3.021 117.573 114.554 -0.003 0.000 2.746 341 T HA -0.205 4.135 4.350 -0.017 0.000 0.267 341 T C -0.261 174.429 174.700 -0.018 0.000 1.039 341 T CA 1.838 63.929 62.100 -0.015 0.000 1.142 341 T CB 0.254 69.111 68.868 -0.018 0.000 0.866 341 T HN 0.060 8.301 8.240 0.000 0.000 0.444 342 A N -0.554 122.259 122.820 -0.012 0.000 3.474 342 A HA 0.379 4.830 4.320 -0.015 -0.140 0.251 342 A C -0.480 177.100 177.584 -0.007 0.000 1.062 342 A CA -0.384 51.645 52.037 -0.014 0.000 0.945 342 A CB 0.248 19.236 19.000 -0.020 0.000 1.296 342 A HN -0.478 7.667 8.150 -0.007 0.000 0.592 343 A N 0.037 122.855 122.820 -0.003 0.000 2.121 343 A HA -0.276 4.044 4.320 0.001 0.000 0.218 343 A C 0.327 177.910 177.584 -0.002 0.000 1.154 343 A CA 2.521 54.557 52.037 -0.001 0.000 0.679 343 A CB -0.481 18.520 19.000 0.002 0.000 0.795 343 A HN 0.563 8.711 8.150 -0.003 0.000 0.458 344 D N -5.046 115.352 120.400 -0.004 0.000 2.310 344 D HA -0.145 4.493 4.640 -0.003 0.000 0.212 344 D C 0.986 177.283 176.300 -0.006 0.000 0.965 344 D CA -0.485 53.513 54.000 -0.005 0.000 0.879 344 D CB -0.466 40.331 40.800 -0.005 0.000 0.921 344 D HN -0.050 8.264 8.370 -0.006 0.052 0.510 345 G N -0.698 108.097 108.800 -0.008 0.000 2.710 345 G HA2 -0.293 3.662 3.960 -0.009 0.000 0.668 345 G HA3 -0.293 3.662 3.960 -0.008 0.000 0.668 345 G C -0.111 174.780 174.900 -0.014 0.000 1.320 345 G CA -0.697 44.397 45.100 -0.010 0.000 0.860 345 G HN -0.674 7.447 8.290 -0.008 0.164 0.538 346 V N -1.285 118.619 119.914 -0.015 0.000 2.307 346 V HA -0.349 3.756 4.120 -0.025 0.000 0.245 346 V C 0.746 176.827 176.094 -0.021 0.000 1.045 346 V CA 3.694 65.982 62.300 -0.021 0.000 1.024 346 V CB 0.313 32.123 31.823 -0.022 0.000 0.651 346 V HN 0.236 8.418 8.190 -0.013 0.000 0.449 347 Q N -0.384 119.406 119.800 -0.016 0.000 2.084 347 Q HA -0.343 3.986 4.340 -0.018 0.000 0.202 347 Q C 2.504 178.496 176.000 -0.013 0.000 0.978 347 Q CA 3.245 59.040 55.803 -0.015 0.000 0.844 347 Q CB -1.408 27.323 28.738 -0.011 0.000 0.898 347 Q HN 0.043 8.304 8.270 -0.014 0.000 0.426 348 E N -0.203 119.990 120.200 -0.011 0.000 2.033 348 E HA -0.293 4.054 4.350 -0.005 0.000 0.199 348 E C 2.851 179.445 176.600 -0.011 0.000 1.011 348 E CA 2.632 59.028 56.400 -0.008 0.000 0.815 348 E CB -0.418 29.278 29.700 -0.007 0.000 0.755 348 E HN -0.318 8.036 8.360 -0.010 0.000 0.451 349 L N 0.411 121.623 121.223 -0.017 0.000 2.043 349 L HA -0.314 4.013 4.340 -0.021 0.000 0.212 349 L C 2.580 179.435 176.870 -0.025 0.000 1.075 349 L CA 2.917 57.743 54.840 -0.024 0.000 0.752 349 L CB -0.177 41.863 42.059 -0.032 0.000 0.891 349 L HN -0.330 7.890 8.230 -0.018 0.000 0.432 350 L N -4.898 116.307 121.223 -0.030 0.000 2.191 350 L HA -0.295 4.012 4.340 -0.054 0.000 0.212 350 L C 0.932 177.793 176.870 -0.015 0.000 1.103 350 L CA 2.013 56.831 54.840 -0.037 0.000 0.769 350 L CB -0.211 41.823 42.059 -0.041 0.000 0.908 350 L HN -0.184 8.018 8.230 -0.029 0.011 0.438 351 A N -5.932 116.885 122.820 -0.005 0.000 2.275 351 A HA -0.011 4.315 4.320 0.010 0.000 0.212 351 A C -1.103 176.492 177.584 0.018 0.000 1.201 351 A CA -0.410 51.631 52.037 0.007 0.000 0.843 351 A CB 0.952 19.954 19.000 0.005 0.000 0.873 351 A HN -0.640 7.263 8.150 -0.008 0.243 0.492 352 D N -0.808 119.603 120.400 0.018 0.000 2.411 352 D HA 0.044 4.700 4.640 0.026 0.000 0.225 352 D C 0.536 176.868 176.300 0.053 0.000 1.156 352 D CA -1.056 52.961 54.000 0.027 0.000 0.874 352 D CB 0.156 40.963 40.800 0.012 0.000 1.034 352 D HN -0.715 7.475 8.370 0.010 0.186 0.502 353 R N 6.150 126.687 120.500 0.062 0.000 2.189 353 R HA -0.232 4.399 4.340 0.116 -0.222 0.223 353 R C 1.891 178.251 176.300 0.101 0.000 1.092 353 R CA 2.718 58.872 56.100 0.089 0.000 0.989 353 R CB -0.054 30.289 30.300 0.072 0.000 0.876 353 R HN 0.140 8.440 8.270 0.050 0.000 0.457 354 T N -3.404 111.199 114.554 0.081 0.000 3.072 354 T HA -0.170 4.260 4.350 0.134 0.000 0.266 354 T C 0.850 175.600 174.700 0.083 0.000 1.127 354 T CA 2.456 64.617 62.100 0.102 0.000 1.107 354 T CB -0.129 68.787 68.868 0.079 0.000 0.910 354 T HN -0.326 8.122 8.240 0.063 -0.170 0.513 355 A N -0.953 121.892 122.820 0.041 0.000 2.238 355 A HA -0.032 4.158 4.320 -0.215 0.000 0.210 355 A C -0.895 176.755 177.584 0.109 0.000 1.179 355 A CA 1.348 53.359 52.037 -0.043 0.000 0.827 355 A CB 0.137 19.116 19.000 -0.034 0.000 0.856 355 A HN -0.238 7.788 8.150 0.059 0.160 0.488 356 F N -2.420 117.544 119.950 0.023 0.000 1.826 356 F HA 0.026 4.604 4.527 0.084 0.000 0.231 356 F C 0.967 176.833 175.800 0.109 0.000 1.252 356 F CA 1.441 59.480 58.000 0.064 0.000 1.294 356 F CB 1.108 40.120 39.000 0.021 0.000 1.951 356 F HN -0.445 7.830 8.300 0.217 0.155 0.188 357 E N -0.054 120.241 120.200 0.159 0.000 2.118 357 E HA -0.225 4.079 4.350 -0.076 0.000 0.195 357 E C 0.314 176.910 176.600 -0.007 0.000 0.992 357 E CA 2.826 59.247 56.400 0.035 0.000 0.804 357 E CB -0.143 29.628 29.700 0.118 0.000 0.741 357 E HN 0.278 8.828 8.360 0.316 0.000 0.458 358 D N -3.092 117.340 120.400 0.054 0.000 2.462 358 D HA 0.197 4.844 4.640 0.012 0.000 0.221 358 D C -1.268 175.093 176.300 0.102 0.000 1.173 358 D CA -0.224 53.806 54.000 0.050 0.000 0.831 358 D CB 0.300 41.133 40.800 0.055 0.000 1.001 358 D HN -0.335 8.068 8.370 0.095 0.024 0.499 359 F N 2.318 122.230 119.950 -0.064 0.000 2.438 359 F HA -0.021 4.489 4.527 -0.028 0.000 0.356 359 F C -0.545 175.212 175.800 -0.071 0.000 1.099 359 F CA -0.112 57.857 58.000 -0.052 0.000 1.185 359 F CB 1.128 40.104 39.000 -0.040 0.000 1.115 359 F HN -0.843 7.389 8.300 0.173 0.173 0.526 360 D N 10.146 130.204 120.400 -0.571 0.000 2.483 360 D HA 0.126 4.555 4.640 -0.352 0.000 0.220 360 D C 1.107 176.925 176.300 -0.804 0.000 1.173 360 D CA -1.885 51.809 54.000 -0.510 0.000 0.964 360 D CB -0.537 40.087 40.800 -0.292 0.000 1.046 360 D HN 0.345 8.422 8.370 -0.489 0.000 0.517 361 V N 1.764 121.282 119.914 -0.659 0.000 2.407 361 V HA -0.345 3.316 4.120 -0.766 0.000 0.248 361 V C 1.165 177.081 176.094 -0.297 0.000 1.055 361 V CA 3.334 65.330 62.300 -0.506 0.000 1.049 361 V CB -0.350 31.362 31.823 -0.184 0.000 0.662 361 V HN -0.293 7.612 8.190 -0.476 0.000 0.455 362 D N 1.173 121.435 120.400 -0.230 0.000 2.123 362 D HA -0.205 4.365 4.640 -0.118 0.000 0.200 362 D C 1.935 178.148 176.300 -0.146 0.000 0.976 362 D CA 3.256 57.167 54.000 -0.148 0.000 0.831 362 D CB -0.629 40.102 40.800 -0.114 0.000 0.974 362 D HN -0.393 7.899 8.370 -0.239 -0.065 0.469 363 A N -0.875 121.836 122.820 -0.183 0.000 1.930 363 A HA -0.192 4.065 4.320 -0.105 0.000 0.217 363 A C 1.760 179.265 177.584 -0.132 0.000 1.175 363 A CA 2.779 54.731 52.037 -0.141 0.000 0.627 363 A CB -0.586 18.330 19.000 -0.141 0.000 0.815 363 A HN -0.397 7.919 8.150 -0.221 -0.299 0.443 364 A N -2.430 120.275 122.820 -0.192 0.000 1.873 364 A HA -0.248 4.043 4.320 -0.049 0.000 0.215 364 A C 2.296 179.848 177.584 -0.054 0.000 1.186 364 A CA 2.508 54.487 52.037 -0.096 0.000 0.616 364 A CB -0.567 18.385 19.000 -0.080 0.000 0.823 364 A HN -0.480 7.488 8.150 -0.303 0.000 0.442 365 A N -1.888 120.889 122.820 -0.071 0.000 1.972 365 A HA -0.298 4.009 4.320 -0.021 0.000 0.219 365 A C 0.973 178.530 177.584 -0.045 0.000 1.169 365 A CA 2.319 54.330 52.037 -0.042 0.000 0.635 365 A CB -0.431 18.542 19.000 -0.044 0.000 0.810 365 A HN -0.270 7.813 8.150 -0.112 0.000 0.446 366 A N -3.354 119.432 122.820 -0.056 0.000 2.119 366 A HA -0.101 4.193 4.320 -0.044 0.000 0.217 366 A C 0.027 177.582 177.584 -0.049 0.000 1.153 366 A CA 0.367 52.375 52.037 -0.049 0.000 0.692 366 A CB 0.042 19.011 19.000 -0.051 0.000 0.799 366 A HN -0.587 7.495 8.150 -0.068 0.028 0.458 367 R N 0.918 121.387 120.500 -0.051 0.000 2.296 367 R HA -0.043 4.267 4.340 -0.051 0.000 0.323 367 R C 0.652 176.904 176.300 -0.078 0.000 1.067 367 R CA -0.618 55.449 56.100 -0.055 0.000 0.946 367 R CB 0.259 30.531 30.300 -0.046 0.000 0.991 367 R HN -0.789 7.403 8.270 -0.050 0.048 0.448 368 G N 5.886 114.635 108.800 -0.085 0.000 2.544 368 G HA2 -0.041 3.846 3.960 -0.120 0.000 0.242 368 G HA3 -0.041 3.857 3.960 -0.102 0.000 0.242 368 G C 0.603 175.381 174.900 -0.204 0.000 1.247 368 G CA -0.817 44.210 45.100 -0.122 0.000 0.840 368 G HN 0.438 8.687 8.290 -0.068 0.000 0.578 369 M N 2.468 121.854 119.600 -0.356 0.000 2.506 369 M HA -0.092 4.064 4.480 -0.539 0.000 0.260 369 M C 1.043 176.995 176.300 -0.580 0.000 1.104 369 M CA -0.467 54.414 55.300 -0.698 0.000 1.112 369 M CB -0.898 30.781 32.600 -1.534 0.000 1.401 369 M HN 0.463 8.559 8.290 -0.323 0.000 0.473 370 A N -3.643 119.007 122.820 -0.282 0.000 2.860 370 A HA -0.307 3.991 4.320 -0.036 0.000 0.267 370 A C 0.462 178.089 177.584 0.070 0.000 1.421 370 A CA 1.587 53.577 52.037 -0.078 0.000 0.831 370 A CB -2.485 16.495 19.000 -0.034 0.000 1.041 370 A HN 0.175 8.139 8.150 -0.243 0.040 0.623 371 F N -1.808 118.166 119.950 0.040 0.000 2.325 371 F HA -0.170 4.392 4.527 0.058 0.000 0.299 371 F C 1.377 177.214 175.800 0.063 0.000 1.090 371 F CA 0.464 58.493 58.000 0.049 0.000 1.392 371 F CB -0.482 38.536 39.000 0.029 0.000 1.053 371 F HN 0.099 8.313 8.300 -0.093 0.030 0.521 372 E N 0.054 120.393 120.200 0.231 0.000 2.072 372 E HA -0.192 4.256 4.350 0.162 0.000 0.190 372 E C 2.534 179.221 176.600 0.144 0.000 0.982 372 E CA 3.246 59.741 56.400 0.158 0.000 0.803 372 E CB -0.844 28.921 29.700 0.108 0.000 0.755 372 E HN 0.415 8.867 8.360 0.195 0.024 0.453 373 R N -0.341 120.238 120.500 0.133 0.000 2.081 373 R HA -0.241 4.165 4.340 0.109 0.000 0.235 373 R C 2.314 178.718 176.300 0.174 0.000 1.131 373 R CA 2.832 59.008 56.100 0.126 0.000 0.960 373 R CB -0.586 29.773 30.300 0.098 0.000 0.856 373 R HN -0.119 8.224 8.270 0.122 0.000 0.436 374 L N -1.497 119.855 121.223 0.215 0.000 2.012 374 L HA -0.313 4.197 4.340 0.283 0.000 0.210 374 L C 1.230 178.300 176.870 0.333 0.000 1.073 374 L CA 3.417 58.428 54.840 0.286 0.000 0.748 374 L CB -0.265 41.977 42.059 0.305 0.000 0.891 374 L HN -0.608 7.748 8.230 0.211 0.000 0.431 375 D N -2.315 118.240 120.400 0.260 0.000 2.178 375 D HA -0.319 4.505 4.640 0.307 0.000 0.202 375 D C 2.115 178.525 176.300 0.183 0.000 0.974 375 D CA 3.327 57.470 54.000 0.239 0.000 0.841 375 D CB 0.093 40.996 40.800 0.172 0.000 0.953 375 D HN -0.216 8.295 8.370 0.236 0.000 0.478 376 Q N 0.077 119.970 119.800 0.154 0.000 2.172 376 Q HA -0.172 4.210 4.340 0.071 0.000 0.200 376 Q C 2.196 178.272 176.000 0.128 0.000 0.964 376 Q CA 2.311 58.176 55.803 0.104 0.000 0.855 376 Q CB -0.429 28.357 28.738 0.081 0.000 0.918 376 Q HN -0.332 8.035 8.270 0.161 0.000 0.444 377 L N -0.975 120.378 121.223 0.216 0.000 2.046 377 L HA -0.340 4.139 4.340 0.230 0.000 0.208 377 L C 1.946 179.058 176.870 0.404 0.000 1.077 377 L CA 3.081 58.111 54.840 0.317 0.000 0.747 377 L CB -0.510 41.785 42.059 0.394 0.000 0.896 377 L HN -0.133 8.233 8.230 0.227 0.000 0.432 378 A N -1.295 121.715 122.820 0.318 0.000 1.902 378 A HA -0.404 3.717 4.320 -0.332 0.000 0.217 378 A C 1.588 178.988 177.584 -0.307 0.000 1.181 378 A CA 2.946 54.884 52.037 -0.165 0.000 0.623 378 A CB -0.669 18.204 19.000 -0.211 0.000 0.818 378 A HN -0.329 7.963 8.150 0.366 0.078 0.443 379 M N -0.962 118.544 119.600 -0.158 0.000 2.080 379 M HA -0.402 3.877 4.480 -0.334 0.000 0.260 379 M C 1.507 177.700 176.300 -0.180 0.000 1.068 379 M CA 2.813 57.989 55.300 -0.207 0.000 1.109 379 M CB -0.430 32.114 32.600 -0.094 0.000 1.342 379 M HN -0.158 8.110 8.290 -0.037 0.000 0.405 380 D N -0.674 119.676 120.400 -0.084 0.000 2.123 380 D HA -0.335 4.241 4.640 -0.106 0.000 0.196 380 D C 2.593 178.801 176.300 -0.153 0.000 0.992 380 D CA 3.652 57.590 54.000 -0.103 0.000 0.833 380 D CB -0.605 40.147 40.800 -0.080 0.000 0.954 380 D HN -0.177 8.176 8.370 -0.028 0.000 0.455 381 H N 0.372 119.404 119.070 -0.062 0.000 2.353 381 H HA -0.148 4.417 4.556 0.017 0.000 0.300 381 H C 3.011 178.234 175.328 -0.175 0.000 1.090 381 H CA 3.282 59.310 56.048 -0.035 0.000 1.327 381 H CB 0.366 30.204 29.762 0.125 0.000 1.383 381 H HN -0.316 8.011 8.280 0.079 0.000 0.508 382 L N 1.179 122.202 121.223 -0.333 0.000 2.042 382 L HA -0.277 3.802 4.340 -0.435 0.000 0.210 382 L C 1.385 178.102 176.870 -0.256 0.000 1.076 382 L CA 2.933 57.478 54.840 -0.492 0.000 0.749 382 L CB -0.182 41.327 42.059 -0.918 0.000 0.893 382 L HN -0.164 7.811 8.230 -0.425 0.000 0.432 383 L N -6.479 114.617 121.223 -0.212 0.000 2.599 383 L HA -0.080 4.172 4.340 -0.146 0.000 0.230 383 L C 0.611 177.423 176.870 -0.097 0.000 1.141 383 L CA 0.050 54.803 54.840 -0.145 0.000 0.877 383 L CB -0.296 41.684 42.059 -0.132 0.000 1.009 383 L HN -0.472 7.604 8.230 -0.228 0.017 0.447 384 G N -2.017 106.733 108.800 -0.084 0.000 2.198 384 G HA2 -0.302 3.777 3.960 -0.032 0.000 0.260 384 G HA3 -0.302 3.641 3.960 -0.029 0.000 0.260 384 G C -0.345 174.515 174.900 -0.068 0.000 1.025 384 G CA 0.344 45.414 45.100 -0.050 0.000 0.769 384 G HN -0.601 7.445 8.290 -0.094 0.188 0.507 385 A N 0.238 122.999 122.820 -0.099 0.000 3.257 385 A HA 0.335 4.614 4.320 -0.068 0.000 0.308 385 A C -1.385 176.128 177.584 -0.118 0.000 1.175 385 A CA -0.810 51.174 52.037 -0.089 0.000 1.018 385 A CB 0.610 19.564 19.000 -0.076 0.000 1.088 385 A HN -0.180 7.872 8.150 -0.118 0.027 0.567 386 R N 0.000 120.414 120.500 -0.144 0.000 2.786 386 R HA 0.000 4.257 4.340 -0.138 0.000 0.208 386 R CA 0.000 56.005 56.100 -0.158 0.000 0.921 386 R CB 0.000 30.112 30.300 -0.313 0.000 0.687 386 R HN 0.000 8.192 8.270 -0.130 0.000 0.535