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 3mmo_1_A DATA FIRST_RESID 5 DATA SEQUENCE NLKPVDAMQC FDCHTQIEDM HTVGKHATVN CVHCHDATEH VETASSRRMG DATA SEQUENCE ERPVTRMDLE ACATCHTAQF NSFVEVRHES HPRLEKATPT SRSPMFDKLI DATA SEQUENCE AGHGFAFEHA EPRSHAFMLV DHFVVDRAYG GRFQFKNWQK VTDGMGAVRG DATA SEQUENCE AWTVLTDADP ESSDQRRFLS QTATAANPVC LNCKTQDHIL DWAYMGDEHE DATA SEQUENCE AAKWSRTSEV VEFARDLNHP LNCFMCHDPH SAGPRVVRDG LINAVVDRGL DATA SEQUENCE GTYPHDPVKS EQQGMTKVTF QRGREDFRAI GLLDTADSNV MCAQCHVEYN DATA SEQUENCE CNPGYQLSDG SRVGMDDRRA NHFFWANVFD YKEAAQEIDF FDFRHATTGA DATA SEQUENCE ALPKLQHPEA ETFWGSVHER NGVACADCHM PKVQLENGKV YTSHSQRTPR DATA SEQUENCE DMMGQACLNC HAEWTEDQAL YAIDYIKNYT HGKIVKSEYW LAKMIDLFPV DATA SEQUENCE AKRAGVSEDV LNQARELHYD AHLYWEWWTA ENSVGFHNPD QARESLMTSI DATA SEQUENCE SKSKEAVSLL NDAIDAQV 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 5 N HA 0.000 4.709 4.740 -0.051 0.000 0.220 5 N C 0.000 175.471 175.510 -0.065 0.000 1.280 5 N CA 0.000 53.021 53.050 -0.049 0.000 0.885 5 N CB 0.000 38.463 38.487 -0.040 0.000 1.341 6 L N 0.919 122.086 121.223 -0.094 0.000 2.453 6 L HA -0.022 4.245 4.340 -0.121 0.000 0.272 6 L C -0.429 176.377 176.870 -0.106 0.000 1.182 6 L CA 0.409 55.170 54.840 -0.133 0.000 0.858 6 L CB 0.241 42.150 42.059 -0.249 0.000 1.120 6 L HN 0.013 8.184 8.230 -0.098 0.000 0.474 7 K N 3.675 124.020 120.400 -0.092 0.000 2.323 7 K HA 0.423 4.708 4.320 -0.058 0.000 0.259 7 K C -2.232 174.326 176.600 -0.069 0.000 0.947 7 K CA -2.972 53.275 56.287 -0.066 0.000 0.819 7 K CB 0.781 33.252 32.500 -0.048 0.000 1.109 7 K HN -0.096 8.099 8.250 -0.092 0.000 0.429 8 P HA -0.038 4.482 4.420 -0.056 -0.133 0.272 8 P C -1.088 176.187 177.300 -0.041 0.000 1.223 8 P CA -0.498 62.576 63.100 -0.044 0.000 0.784 8 P CB 0.676 32.365 31.700 -0.019 0.000 0.923 9 V N -3.640 116.247 119.914 -0.045 0.000 2.966 9 V HA 0.247 4.338 4.120 -0.047 0.000 0.317 9 V C -1.074 174.978 176.094 -0.071 0.000 1.070 9 V CA -2.725 59.543 62.300 -0.054 0.000 1.008 9 V CB 1.842 33.632 31.823 -0.055 0.000 1.070 9 V HN -0.050 8.424 8.190 -0.044 -0.310 0.457 10 D N 1.118 121.471 120.400 -0.079 0.000 2.402 10 D HA 0.019 4.611 4.640 -0.080 0.000 0.235 10 D C 0.295 176.491 176.300 -0.173 0.000 1.226 10 D CA -0.558 53.385 54.000 -0.095 0.000 0.918 10 D CB -0.056 40.703 40.800 -0.069 0.000 1.043 10 D HN 0.194 8.522 8.370 -0.070 0.000 0.506 11 A N 7.461 130.132 122.820 -0.247 0.000 2.019 11 A HA -0.204 3.800 4.320 -0.526 0.000 0.219 11 A C 1.164 178.317 177.584 -0.717 0.000 1.164 11 A CA 2.376 54.088 52.037 -0.540 0.000 0.644 11 A CB 0.011 18.655 19.000 -0.594 0.000 0.805 11 A HN 0.205 8.241 8.150 -0.189 0.000 0.449 12 M N -2.993 116.418 119.600 -0.314 0.000 2.159 12 M HA -0.351 4.134 4.480 0.007 0.000 0.263 12 M C 1.836 178.097 176.300 -0.064 0.000 1.063 12 M CA 1.559 56.803 55.300 -0.093 0.000 1.110 12 M CB -1.467 31.148 32.600 0.026 0.000 1.374 12 M HN -0.444 7.873 8.290 -0.201 -0.147 0.411 13 Q N 0.564 120.302 119.800 -0.103 0.000 2.050 13 Q HA -0.271 4.048 4.340 -0.035 0.000 0.202 13 Q C 2.845 178.806 176.000 -0.065 0.000 0.980 13 Q CA 3.099 58.862 55.803 -0.067 0.000 0.840 13 Q CB -0.231 28.465 28.738 -0.071 0.000 0.898 13 Q HN -0.367 7.984 8.270 -0.121 -0.154 0.424 14 C N -0.195 119.023 119.300 -0.137 0.000 2.413 14 C HA -0.269 4.215 4.460 0.040 0.000 0.276 14 C C 2.698 177.765 174.990 0.127 0.000 1.248 14 C CA 3.751 62.748 59.018 -0.034 0.000 1.742 14 C CB -1.902 25.747 27.740 -0.152 0.000 2.017 14 C HN -0.569 7.530 8.230 -0.219 0.000 0.481 15 F N -2.670 117.304 119.950 0.040 0.000 2.408 15 F HA -0.199 4.369 4.527 0.068 0.000 0.300 15 F C 0.794 176.599 175.800 0.008 0.000 1.090 15 F CA -0.255 57.767 58.000 0.037 0.000 1.427 15 F CB -1.403 37.612 39.000 0.024 0.000 1.070 15 F HN -0.337 7.889 8.300 -0.123 0.000 0.549 16 D N -1.906 118.585 120.400 0.151 0.000 2.263 16 D HA -0.131 4.547 4.640 0.064 0.000 0.208 16 D C 0.726 177.024 176.300 -0.003 0.000 0.971 16 D CA 2.365 56.398 54.000 0.055 0.000 0.867 16 D CB 0.174 40.984 40.800 0.016 0.000 0.929 16 D HN -0.490 7.924 8.370 0.120 0.028 0.492 17 C N -3.685 115.586 119.300 -0.047 0.000 3.559 17 C HA 0.115 4.484 4.460 -0.151 0.000 0.314 17 C C -0.756 174.041 174.990 -0.321 0.000 1.419 17 C CA -1.062 57.834 59.018 -0.204 0.000 1.775 17 C CB 0.762 28.301 27.740 -0.335 0.000 2.430 17 C HN -0.666 7.529 8.230 -0.013 0.027 0.686 18 H N 0.876 120.001 119.070 0.091 0.000 2.386 18 H HA 0.268 4.866 4.556 0.069 0.000 0.232 18 H C 0.444 175.819 175.328 0.079 0.000 1.416 18 H CA -1.023 55.083 56.048 0.097 0.000 1.285 18 H CB 0.780 30.611 29.762 0.115 0.000 1.625 18 H HN -0.299 7.950 8.280 0.143 0.117 0.521 19 T N -1.249 113.362 114.554 0.095 0.000 2.833 19 T HA -0.251 4.085 4.350 -0.023 0.000 0.269 19 T C 1.454 176.147 174.700 -0.012 0.000 1.054 19 T CA 2.512 64.619 62.100 0.011 0.000 1.135 19 T CB 0.042 68.904 68.868 -0.010 0.000 0.869 19 T HN 0.141 8.417 8.240 0.060 0.000 0.466 20 Q N 2.793 122.615 119.800 0.035 0.000 2.050 20 Q HA -0.308 4.022 4.340 -0.017 0.000 0.202 20 Q C 1.352 177.371 176.000 0.032 0.000 0.980 20 Q CA 3.593 59.409 55.803 0.021 0.000 0.840 20 Q CB -0.366 28.395 28.738 0.038 0.000 0.898 20 Q HN -0.048 8.264 8.270 0.070 0.000 0.424 21 I N -2.491 118.109 120.570 0.050 0.000 2.252 21 I HA -0.379 3.774 4.170 -0.029 0.000 0.245 21 I C 1.925 178.004 176.117 -0.063 0.000 1.102 21 I CA 1.944 63.231 61.300 -0.023 0.000 1.385 21 I CB -1.303 36.624 38.000 -0.122 0.000 1.064 21 I HN -0.187 8.083 8.210 0.100 0.000 0.414 22 E N 1.812 121.853 120.200 -0.265 0.000 2.070 22 E HA -0.506 2.936 4.350 -1.514 0.000 0.197 22 E C 2.153 178.522 176.600 -0.385 0.000 1.004 22 E CA 3.721 59.616 56.400 -0.842 0.000 0.805 22 E CB -0.211 28.940 29.700 -0.914 0.000 0.744 22 E HN -0.187 8.084 8.360 -0.149 0.000 0.451 23 D N -2.868 117.419 120.400 -0.188 0.000 2.219 23 D HA -0.166 4.406 4.640 -0.112 0.000 0.205 23 D C 1.488 177.771 176.300 -0.028 0.000 0.970 23 D CA 2.513 56.455 54.000 -0.097 0.000 0.851 23 D CB -0.203 40.559 40.800 -0.063 0.000 0.943 23 D HN -0.327 7.950 8.370 -0.155 0.000 0.488 24 M N -1.927 117.686 119.600 0.022 0.000 2.216 24 M HA -0.119 4.405 4.480 0.074 0.000 0.264 24 M C 1.412 177.798 176.300 0.142 0.000 1.080 24 M CA 3.295 58.654 55.300 0.098 0.000 1.153 24 M CB 0.626 33.330 32.600 0.173 0.000 1.356 24 M HN -0.888 7.399 8.290 0.016 0.013 0.432 25 H N 0.548 119.663 119.070 0.075 0.000 2.363 25 H HA -0.030 4.887 4.556 0.217 -0.231 0.301 25 H C 2.292 177.688 175.328 0.112 0.000 1.074 25 H CA 4.066 60.212 56.048 0.164 0.000 1.354 25 H CB 1.554 31.480 29.762 0.273 0.000 1.397 25 H HN -0.034 8.381 8.280 0.226 0.000 0.516 26 T N -4.925 109.702 114.554 0.121 0.000 3.035 26 T HA -0.103 4.336 4.350 0.147 0.000 0.268 26 T C 1.261 175.974 174.700 0.022 0.000 1.109 26 T CA 2.690 64.836 62.100 0.076 0.000 1.119 26 T CB -0.387 68.480 68.868 -0.002 0.000 0.900 26 T HN -0.270 8.000 8.240 0.051 0.000 0.503 27 V N 0.006 119.925 119.914 0.008 0.000 2.949 27 V HA 0.212 4.334 4.120 0.004 0.000 0.245 27 V C 0.864 176.956 176.094 -0.003 0.000 1.086 27 V CA 0.691 62.993 62.300 0.003 0.000 1.097 27 V CB 0.407 32.233 31.823 0.004 0.000 0.762 27 V HN -0.460 7.697 8.190 0.014 0.042 0.470 28 G N -1.076 107.717 108.800 -0.011 0.000 2.510 28 G HA2 0.201 4.149 3.960 -0.020 0.000 0.280 28 G HA3 0.201 4.316 3.960 -0.030 -0.173 0.280 28 G C -0.168 174.707 174.900 -0.042 0.000 1.386 28 G CA -0.753 44.331 45.100 -0.027 0.000 1.047 28 G HN -0.781 7.504 8.290 -0.008 0.000 0.527 29 K N -1.061 119.301 120.400 -0.065 0.000 2.487 29 K HA -0.021 4.294 4.320 -0.009 0.000 0.192 29 K C 0.224 176.853 176.600 0.049 0.000 1.027 29 K CA 1.111 57.378 56.287 -0.034 0.000 1.054 29 K CB 0.068 32.535 32.500 -0.055 0.000 0.824 29 K HN -0.081 8.112 8.250 -0.095 0.000 0.510 30 H N -2.471 116.539 119.070 -0.100 0.000 2.505 30 H HA 0.262 4.761 4.556 -0.096 0.000 0.286 30 H C 0.375 175.477 175.328 -0.376 0.000 1.072 30 H CA -1.114 54.842 56.048 -0.154 0.000 1.141 30 H CB -0.031 29.678 29.762 -0.089 0.000 1.550 30 H HN -0.139 8.079 8.280 -0.016 0.052 0.547 31 A N -0.160 122.546 122.820 -0.191 0.000 2.024 31 A HA -0.174 3.977 4.320 -0.509 -0.137 0.220 31 A C 0.334 177.911 177.584 -0.012 0.000 1.164 31 A CA 2.562 54.467 52.037 -0.220 0.000 0.643 31 A CB 0.055 19.032 19.000 -0.037 0.000 0.806 31 A HN -0.823 7.216 8.150 -0.092 0.055 0.451 32 T N -8.111 106.454 114.554 0.019 0.000 3.107 32 T HA 0.071 4.484 4.350 0.104 0.000 0.249 32 T C 0.339 175.085 174.700 0.075 0.000 1.096 32 T CA -0.690 61.451 62.100 0.068 0.000 1.012 32 T CB -0.011 68.880 68.868 0.038 0.000 0.977 32 T HN -0.356 7.866 8.240 0.002 0.019 0.527 33 V N 4.745 124.699 119.914 0.067 0.000 2.368 33 V HA 0.034 4.133 4.120 -0.035 0.000 0.266 33 V C -0.275 175.960 176.094 0.236 0.000 1.045 33 V CA -0.310 62.005 62.300 0.025 0.000 0.899 33 V CB -1.119 30.564 31.823 -0.234 0.000 1.006 33 V HN -0.384 7.665 8.190 0.041 0.166 0.470 34 N N 5.498 124.338 118.700 0.232 0.000 2.508 34 N HA -0.080 4.754 4.740 0.158 0.000 0.264 34 N C 1.337 176.958 175.510 0.185 0.000 1.216 34 N CA 0.450 53.615 53.050 0.192 0.000 0.943 34 N CB 2.538 41.102 38.487 0.129 0.000 1.113 34 N HN 0.134 8.659 8.380 0.241 0.000 0.447 35 C N 2.181 121.531 119.300 0.084 0.000 2.419 35 C HA -0.161 4.410 4.460 0.184 0.000 0.283 35 C C 1.595 176.648 174.990 0.105 0.000 1.373 35 C CA 1.927 61.016 59.018 0.119 0.000 1.781 35 C CB -1.799 25.969 27.740 0.046 0.000 1.886 35 C HN 0.729 8.968 8.230 0.016 0.000 0.520 36 V N 1.139 121.065 119.914 0.020 0.000 2.867 36 V HA -0.227 4.073 4.120 -0.017 -0.190 0.260 36 V C 1.220 177.233 176.094 -0.134 0.000 1.099 36 V CA 2.631 64.896 62.300 -0.058 0.000 1.122 36 V CB -0.594 31.159 31.823 -0.117 0.000 0.708 36 V HN -0.553 7.881 8.190 0.008 -0.240 0.490 37 H N -2.801 116.240 119.070 -0.048 0.000 2.456 37 H HA -0.198 4.309 4.556 -0.082 0.000 0.296 37 H C 0.483 175.738 175.328 -0.123 0.000 1.079 37 H CA 3.490 59.486 56.048 -0.086 0.000 1.322 37 H CB 0.050 29.751 29.762 -0.102 0.000 1.388 37 H HN -0.448 7.839 8.280 0.061 0.030 0.538 38 C N -6.637 112.616 119.300 -0.078 0.000 3.931 38 C HA 0.225 4.570 4.460 -0.192 0.000 0.378 38 C C -1.782 172.949 174.990 -0.432 0.000 1.554 38 C CA -0.163 58.691 59.018 -0.273 0.000 1.926 38 C CB 2.003 29.502 27.740 -0.401 0.000 2.837 38 C HN -0.387 7.784 8.230 -0.052 0.028 0.701 39 H N -0.633 118.428 119.070 -0.014 0.000 2.717 39 H HA 0.878 5.639 4.556 -0.027 -0.221 0.366 39 H C -2.167 173.145 175.328 -0.027 0.000 1.132 39 H CA -1.426 54.607 56.048 -0.025 0.000 1.180 39 H CB 3.431 33.175 29.762 -0.030 0.000 1.678 39 H HN -0.197 8.069 8.280 -0.023 0.000 0.537 40 D N 2.078 122.541 120.400 0.105 0.000 2.460 40 D HA 0.310 4.976 4.640 0.044 0.000 0.232 40 D C -1.358 174.981 176.300 0.065 0.000 1.079 40 D CA -0.863 53.172 54.000 0.057 0.000 0.864 40 D CB 0.817 41.636 40.800 0.031 0.000 1.048 40 D HN -0.058 8.377 8.370 0.108 0.000 0.523 41 A N 5.427 128.289 122.820 0.070 0.000 2.564 41 A HA 0.299 4.690 4.320 0.119 0.000 0.279 41 A C 0.317 177.959 177.584 0.096 0.000 1.232 41 A CA -0.177 51.924 52.037 0.107 0.000 0.950 41 A CB 0.773 19.849 19.000 0.128 0.000 1.138 41 A HN 0.448 8.634 8.150 0.059 0.000 0.526 42 T N 2.315 116.900 114.554 0.052 0.000 2.674 42 T HA -0.442 3.916 4.350 0.014 0.000 0.265 42 T C 1.798 176.517 174.700 0.030 0.000 1.039 42 T CA 5.747 67.862 62.100 0.026 0.000 1.150 42 T CB -0.295 68.580 68.868 0.012 0.000 0.864 42 T HN -0.511 7.940 8.240 0.043 -0.185 0.427 43 E N -1.383 118.845 120.200 0.047 0.000 2.152 43 E HA -0.316 4.218 4.350 0.024 -0.170 0.192 43 E C 1.377 178.021 176.600 0.072 0.000 0.983 43 E CA 2.750 59.176 56.400 0.044 0.000 0.818 43 E CB -0.165 29.560 29.700 0.041 0.000 0.758 43 E HN 0.238 8.628 8.360 0.050 0.000 0.467 44 H N 0.328 119.395 119.070 -0.005 0.000 2.290 44 H HA -0.280 4.393 4.556 -0.003 -0.119 0.298 44 H C 1.801 177.126 175.328 -0.006 0.000 1.087 44 H CA 2.967 59.013 56.048 -0.004 0.000 1.291 44 H CB -0.282 29.479 29.762 -0.001 0.000 1.369 44 H HN -0.405 7.990 8.280 0.192 0.000 0.492 45 V N -1.301 118.532 119.914 -0.135 0.000 2.490 45 V HA -0.327 3.594 4.120 -0.332 0.000 0.250 45 V C 1.435 177.450 176.094 -0.132 0.000 1.061 45 V CA 3.134 65.314 62.300 -0.199 0.000 1.064 45 V CB -0.882 30.879 31.823 -0.103 0.000 0.670 45 V HN -0.155 8.030 8.190 -0.009 0.000 0.461 46 E N -3.496 116.661 120.200 -0.071 0.000 2.274 46 E HA -0.066 4.253 4.350 -0.052 0.000 0.194 46 E C 1.355 177.925 176.600 -0.050 0.000 0.996 46 E CA 1.741 58.112 56.400 -0.049 0.000 0.840 46 E CB 0.002 29.688 29.700 -0.024 0.000 0.772 46 E HN -0.324 7.992 8.360 -0.046 0.016 0.491 47 T N -7.595 106.924 114.554 -0.058 0.000 2.958 47 T HA 0.192 4.522 4.350 -0.033 0.000 0.256 47 T C -0.007 174.660 174.700 -0.055 0.000 0.983 47 T CA -0.152 61.926 62.100 -0.037 0.000 0.924 47 T CB 1.472 70.340 68.868 -0.000 0.000 1.136 47 T HN -0.476 7.569 8.240 -0.073 0.151 0.506 48 A N 3.550 126.296 122.820 -0.123 0.000 2.351 48 A HA 0.346 4.778 4.320 -0.061 -0.149 0.257 48 A C -0.586 176.933 177.584 -0.109 0.000 1.087 48 A CA -0.786 51.171 52.037 -0.134 0.000 0.798 48 A CB 1.141 19.942 19.000 -0.332 0.000 1.033 48 A HN -0.252 7.787 8.150 -0.185 0.000 0.488 49 S N 1.169 116.823 115.700 -0.077 0.000 2.751 49 S HA 0.238 4.657 4.470 -0.085 0.000 0.310 49 S C 1.715 176.265 174.600 -0.083 0.000 1.128 49 S CA -1.023 57.132 58.200 -0.075 0.000 0.931 49 S CB 2.465 65.635 63.200 -0.050 0.000 1.177 49 S HN -0.091 8.186 8.310 -0.055 0.000 0.530 50 S N -0.034 115.616 115.700 -0.082 0.000 2.500 50 S HA -0.138 4.255 4.470 -0.128 0.000 0.239 50 S C 1.080 175.641 174.600 -0.065 0.000 0.989 50 S CA 2.179 60.324 58.200 -0.092 0.000 0.951 50 S CB -0.851 62.301 63.200 -0.080 0.000 0.759 50 S HN 0.518 8.784 8.310 -0.074 0.000 0.523 51 R N 0.009 120.482 120.500 -0.044 0.000 2.535 51 R HA 0.284 4.609 4.340 -0.025 0.000 0.323 51 R C -1.435 174.855 176.300 -0.017 0.000 0.979 51 R CA -0.407 55.677 56.100 -0.027 0.000 1.120 51 R CB 1.663 31.948 30.300 -0.024 0.000 1.306 51 R HN -0.607 7.581 8.270 -0.044 0.055 0.540 52 R N 0.135 120.626 120.500 -0.015 0.000 2.512 52 R HA 0.285 4.626 4.340 0.001 0.000 0.291 52 R C -0.826 175.489 176.300 0.025 0.000 1.097 52 R CA -0.263 55.836 56.100 -0.001 0.000 0.940 52 R CB 2.488 32.782 30.300 -0.010 0.000 1.198 52 R HN -0.638 7.618 8.270 -0.022 0.000 0.429 53 M N 5.344 124.976 119.600 0.054 0.000 2.149 53 M HA -0.279 4.335 4.480 0.222 0.000 0.261 53 M C -0.163 176.243 176.300 0.176 0.000 1.064 53 M CA 2.601 57.987 55.300 0.143 0.000 1.102 53 M CB 0.052 32.699 32.600 0.078 0.000 1.369 53 M HN 0.504 8.815 8.290 0.035 0.000 0.408 54 G N -2.859 105.990 108.800 0.083 0.000 2.566 54 G HA2 -0.374 3.610 3.960 0.040 0.000 0.280 54 G HA3 -0.374 3.627 3.960 0.069 0.000 0.280 54 G C -0.540 174.418 174.900 0.097 0.000 1.225 54 G CA -0.390 44.753 45.100 0.073 0.000 0.966 54 G HN -0.315 7.981 8.290 0.050 0.023 0.560 55 E N 2.631 122.894 120.200 0.105 0.000 2.384 55 E HA -0.147 4.232 4.350 0.048 0.000 0.266 55 E C -0.268 176.384 176.600 0.086 0.000 1.012 55 E CA -0.234 56.214 56.400 0.080 0.000 0.901 55 E CB 0.767 30.509 29.700 0.070 0.000 0.967 55 E HN -0.187 8.231 8.360 0.097 0.000 0.435 56 R N 3.664 124.169 120.500 0.008 0.000 2.316 56 R HA 0.016 4.276 4.340 -0.133 0.000 0.314 56 R C -1.598 174.649 176.300 -0.087 0.000 1.069 56 R CA -1.953 54.104 56.100 -0.072 0.000 0.959 56 R CB 0.314 30.585 30.300 -0.048 0.000 0.987 56 R HN 0.288 8.563 8.270 0.009 0.000 0.446 57 P HA 0.025 4.512 4.420 -0.032 -0.086 0.274 57 P C -1.755 175.522 177.300 -0.037 0.000 1.231 57 P CA -0.383 62.644 63.100 -0.121 0.000 0.790 57 P CB 1.231 32.775 31.700 -0.261 0.000 0.951 58 V N 1.130 121.060 119.914 0.026 0.000 2.546 58 V HA 0.140 4.287 4.120 0.046 0.000 0.284 58 V C -0.097 176.059 176.094 0.103 0.000 1.050 58 V CA -0.044 62.288 62.300 0.052 0.000 0.981 58 V CB 0.906 32.756 31.823 0.045 0.000 0.990 58 V HN 0.119 8.330 8.190 0.034 0.000 0.474 59 T N 8.163 122.771 114.554 0.090 0.000 2.792 59 T HA 0.559 5.104 4.350 0.028 -0.177 0.280 59 T C -0.463 174.227 174.700 -0.017 0.000 0.990 59 T CA -0.813 61.317 62.100 0.049 0.000 0.960 59 T CB 1.007 69.924 68.868 0.082 0.000 0.939 59 T HN 0.148 8.432 8.240 0.074 0.000 0.439 60 R N 6.748 127.195 120.500 -0.088 0.000 2.442 60 R HA 0.004 4.352 4.340 0.013 0.000 0.291 60 R C -0.149 176.146 176.300 -0.008 0.000 1.069 60 R CA 0.757 56.834 56.100 -0.038 0.000 1.022 60 R CB 0.574 30.834 30.300 -0.068 0.000 0.976 60 R HN 0.540 8.712 8.270 -0.163 0.000 0.443 61 M N 0.483 120.135 119.600 0.088 0.000 2.308 61 M HA 0.121 4.825 4.480 0.373 0.000 0.269 61 M C -1.144 175.164 176.300 0.013 0.000 1.040 61 M CA -2.316 53.124 55.300 0.235 0.000 1.024 61 M CB -0.130 32.677 32.600 0.346 0.000 1.465 61 M HN 0.255 8.607 8.290 0.103 0.000 0.517 62 D N -1.789 118.461 120.400 -0.251 0.000 2.372 62 D HA -0.143 3.611 4.640 -1.477 0.000 0.243 62 D C 1.082 177.200 176.300 -0.303 0.000 1.121 62 D CA -0.210 53.373 54.000 -0.695 0.000 0.898 62 D CB 0.915 41.431 40.800 -0.474 0.000 1.202 62 D HN -0.542 7.748 8.370 -0.134 0.000 0.428 63 L N 0.383 121.454 121.223 -0.253 0.000 2.291 63 L HA -0.192 4.104 4.340 -0.072 0.000 0.214 63 L C 1.945 178.758 176.870 -0.093 0.000 1.120 63 L CA 2.765 57.575 54.840 -0.051 0.000 0.799 63 L CB -0.113 42.036 42.059 0.151 0.000 0.925 63 L HN 0.491 8.532 8.230 -0.315 0.000 0.446 64 E N -0.964 119.114 120.200 -0.204 0.000 2.409 64 E HA -0.324 3.688 4.350 -0.564 0.000 0.198 64 E C 1.192 177.662 176.600 -0.217 0.000 1.024 64 E CA 2.273 58.469 56.400 -0.339 0.000 0.861 64 E CB -0.742 28.783 29.700 -0.291 0.000 0.788 64 E HN 0.017 8.305 8.360 -0.178 -0.034 0.521 65 A N -1.416 121.322 122.820 -0.137 0.000 2.019 65 A HA -0.160 4.117 4.320 -0.072 0.000 0.219 65 A C 0.702 178.239 177.584 -0.079 0.000 1.164 65 A CA 2.532 54.519 52.037 -0.083 0.000 0.644 65 A CB -0.335 18.630 19.000 -0.058 0.000 0.805 65 A HN -0.530 7.614 8.150 -0.132 -0.072 0.449 66 C N -3.137 116.119 119.300 -0.072 0.000 2.611 66 C HA 0.047 4.498 4.460 -0.015 0.000 0.282 66 C C 1.214 176.164 174.990 -0.067 0.000 1.321 66 C CA 0.599 59.607 59.018 -0.016 0.000 1.747 66 C CB -0.149 27.634 27.740 0.072 0.000 2.124 66 C HN -0.626 7.536 8.230 -0.078 0.021 0.531 67 A N 0.068 122.770 122.820 -0.198 0.000 2.067 67 A HA -0.254 3.976 4.320 -0.150 0.000 0.219 67 A C 0.942 178.379 177.584 -0.245 0.000 1.158 67 A CA 2.613 54.468 52.037 -0.304 0.000 0.661 67 A CB -1.005 17.448 19.000 -0.912 0.000 0.801 67 A HN -0.382 7.510 8.150 -0.256 0.104 0.452 68 T N -2.405 112.016 114.554 -0.222 0.000 2.720 68 T HA -0.220 4.030 4.350 -0.166 0.000 0.268 68 T C 1.377 175.953 174.700 -0.207 0.000 1.037 68 T CA 3.333 65.325 62.100 -0.180 0.000 1.144 68 T CB -0.283 68.512 68.868 -0.121 0.000 0.864 68 T HN -0.347 7.738 8.240 -0.214 0.026 0.444 69 C N -1.728 117.386 119.300 -0.310 0.000 3.065 69 C HA 0.254 4.516 4.460 -0.330 0.000 0.285 69 C C 0.213 174.875 174.990 -0.547 0.000 1.257 69 C CA -0.865 57.879 59.018 -0.458 0.000 1.691 69 C CB 0.403 27.750 27.740 -0.654 0.000 2.089 69 C HN -0.600 7.436 8.230 -0.323 0.000 0.630 70 H N -0.103 118.900 119.070 -0.112 0.000 2.535 70 H HA 0.333 4.823 4.556 -0.110 0.000 0.232 70 H C -0.131 175.144 175.328 -0.088 0.000 1.405 70 H CA -1.591 54.394 56.048 -0.105 0.000 1.224 70 H CB -0.968 28.733 29.762 -0.102 0.000 1.763 70 H HN -0.397 7.672 8.280 -0.181 0.102 0.529 71 T N 2.891 117.434 114.554 -0.019 0.000 2.746 71 T HA -0.309 4.114 4.350 0.038 -0.050 0.267 71 T C 1.194 175.895 174.700 0.002 0.000 1.039 71 T CA 4.727 66.828 62.100 0.001 0.000 1.142 71 T CB 0.089 68.933 68.868 -0.041 0.000 0.866 71 T HN 0.298 8.501 8.240 -0.061 0.000 0.444 72 A N 0.300 123.031 122.820 -0.148 0.000 1.902 72 A HA -0.479 3.685 4.320 -0.261 0.000 0.217 72 A C 2.080 179.526 177.584 -0.230 0.000 1.181 72 A CA 3.272 55.094 52.037 -0.358 0.000 0.623 72 A CB -0.688 17.750 19.000 -0.937 0.000 0.818 72 A HN 0.437 8.488 8.150 -0.165 0.000 0.443 73 Q N -0.936 118.765 119.800 -0.166 0.000 2.079 73 Q HA -0.235 4.055 4.340 -0.083 0.000 0.200 73 Q C 2.363 178.333 176.000 -0.051 0.000 0.974 73 Q CA 3.143 58.833 55.803 -0.189 0.000 0.840 73 Q CB -0.206 28.237 28.738 -0.492 0.000 0.898 73 Q HN -0.290 7.883 8.270 -0.161 0.000 0.430 74 F N 1.874 121.771 119.950 -0.090 0.000 2.102 74 F HA -0.408 4.148 4.527 0.049 0.000 0.298 74 F C 1.184 177.033 175.800 0.083 0.000 1.105 74 F CA 3.510 61.520 58.000 0.016 0.000 1.239 74 F CB 0.313 39.307 39.000 -0.010 0.000 0.991 74 F HN -0.394 8.014 8.300 0.180 0.000 0.474 75 N N -2.059 116.728 118.700 0.145 0.000 2.244 75 N HA -0.366 4.346 4.740 -0.047 0.000 0.183 75 N C 1.842 177.332 175.510 -0.033 0.000 1.016 75 N CA 2.852 55.919 53.050 0.028 0.000 0.866 75 N CB -0.448 38.095 38.487 0.094 0.000 0.980 75 N HN 0.103 8.614 8.380 0.219 0.000 0.430 76 S N 1.030 116.761 115.700 0.051 0.000 2.383 76 S HA -0.164 4.549 4.470 0.061 -0.206 0.227 76 S C 1.916 176.547 174.600 0.053 0.000 1.026 76 S CA 2.773 61.032 58.200 0.099 0.000 0.981 76 S CB -0.318 63.038 63.200 0.259 0.000 0.818 76 S HN -0.544 7.812 8.310 0.077 0.000 0.472 77 F N 1.883 121.789 119.950 -0.074 0.000 2.134 77 F HA -0.148 4.615 4.527 -0.003 -0.237 0.299 77 F C 1.631 177.294 175.800 -0.227 0.000 1.097 77 F CA 2.701 60.637 58.000 -0.107 0.000 1.264 77 F CB 0.260 39.174 39.000 -0.144 0.000 1.001 77 F HN -0.427 7.982 8.300 0.183 0.000 0.479 78 V N -1.994 117.545 119.914 -0.625 0.000 3.461 78 V HA -0.181 3.330 4.120 -1.016 0.000 0.267 78 V C -0.805 174.986 176.094 -0.506 0.000 1.186 78 V CA -0.219 61.640 62.300 -0.735 0.000 1.154 78 V CB 0.068 31.497 31.823 -0.656 0.000 0.802 78 V HN -0.646 7.277 8.190 -0.445 0.000 0.474 79 E N -0.495 119.488 120.200 -0.361 0.000 2.502 79 E HA -0.203 4.014 4.350 -0.221 0.000 0.261 79 E C -0.610 175.798 176.600 -0.320 0.000 0.974 79 E CA 0.511 56.754 56.400 -0.262 0.000 0.936 79 E CB 1.290 30.889 29.700 -0.168 0.000 0.926 79 E HN -0.663 7.465 8.360 -0.318 0.041 0.459 80 V N 5.059 124.786 119.914 -0.313 0.000 2.407 80 V HA -0.025 3.928 4.120 -0.279 0.000 0.278 80 V C -0.656 175.170 176.094 -0.446 0.000 1.037 80 V CA -0.383 61.709 62.300 -0.346 0.000 0.900 80 V CB 0.541 32.183 31.823 -0.302 0.000 0.983 80 V HN 0.010 8.030 8.190 -0.284 0.000 0.459 81 R N 6.678 126.997 120.500 -0.301 0.000 2.308 81 R HA 0.192 4.387 4.340 -0.242 0.000 0.325 81 R C 0.831 176.993 176.300 -0.229 0.000 1.161 81 R CA -0.644 55.308 56.100 -0.247 0.000 1.022 81 R CB -0.298 29.898 30.300 -0.173 0.000 1.091 81 R HN -0.022 8.111 8.270 -0.228 0.000 0.497 82 H N 5.515 124.556 119.070 -0.048 0.000 2.491 82 H HA -0.267 4.266 4.556 -0.038 0.000 0.290 82 H C 0.750 176.022 175.328 -0.093 0.000 1.050 82 H CA 2.935 58.954 56.048 -0.049 0.000 1.309 82 H CB 0.112 29.857 29.762 -0.029 0.000 1.392 82 H HN 0.290 8.398 8.280 -0.287 0.000 0.554 83 E N -2.223 117.951 120.200 -0.044 0.000 2.418 83 E HA -0.132 4.123 4.350 -0.158 0.000 0.197 83 E C -0.300 176.066 176.600 -0.390 0.000 1.026 83 E CA 1.081 57.375 56.400 -0.176 0.000 0.862 83 E CB -0.538 29.082 29.700 -0.134 0.000 0.799 83 E HN 0.231 8.538 8.360 -0.046 0.025 0.518 84 S N 1.132 116.672 115.700 -0.266 0.000 2.485 84 S HA 0.058 4.321 4.470 -0.345 0.000 0.312 84 S C -0.431 174.045 174.600 -0.207 0.000 1.102 84 S CA -0.277 57.762 58.200 -0.269 0.000 1.066 84 S CB -0.752 62.352 63.200 -0.160 0.000 1.102 84 S HN -0.836 7.224 8.310 -0.184 0.139 0.519 85 H N 6.516 125.563 119.070 -0.040 0.000 3.140 85 H HA -0.079 4.458 4.556 -0.032 0.000 0.316 85 H C -0.886 174.410 175.328 -0.054 0.000 0.986 85 H CA -1.390 54.633 56.048 -0.040 0.000 1.397 85 H CB -0.805 28.931 29.762 -0.042 0.000 1.377 85 H HN -0.300 7.555 8.280 -0.709 0.000 0.585 86 P HA 0.197 4.587 4.420 -0.050 0.000 0.287 86 P C -0.625 176.675 177.300 -0.000 0.000 1.270 86 P CA -0.572 62.513 63.100 -0.026 0.000 0.844 86 P CB 1.304 32.947 31.700 -0.094 0.000 1.068 87 R N -1.713 118.783 120.500 -0.008 0.000 3.405 87 R HA -0.381 3.973 4.340 0.023 0.000 0.258 87 R C -1.440 174.874 176.300 0.023 0.000 1.030 87 R CA 0.494 56.609 56.100 0.024 0.000 0.691 87 R CB -1.129 29.210 30.300 0.065 0.000 1.093 87 R HN 0.332 8.585 8.270 -0.027 0.000 0.448 88 L N 0.341 121.567 121.223 0.006 0.000 2.259 88 L HA 0.202 4.538 4.340 -0.006 0.000 0.288 88 L C -1.353 175.500 176.870 -0.029 0.000 1.051 88 L CA -1.682 53.154 54.840 -0.007 0.000 0.824 88 L CB 0.071 42.132 42.059 0.004 0.000 1.206 88 L HN -0.122 8.109 8.230 0.001 0.000 0.429 89 E N 7.347 127.540 120.200 -0.012 0.000 2.344 89 E HA -0.154 4.312 4.350 -0.017 -0.127 0.270 89 E C -0.481 176.095 176.600 -0.041 0.000 1.021 89 E CA 0.138 56.533 56.400 -0.009 0.000 0.887 89 E CB 0.160 29.882 29.700 0.037 0.000 0.997 89 E HN 0.554 8.913 8.360 -0.000 0.000 0.429 90 K N 5.321 125.655 120.400 -0.110 0.000 2.217 90 K HA -0.107 4.137 4.320 -0.127 0.000 0.202 90 K C 0.543 177.119 176.600 -0.040 0.000 1.051 90 K CA 2.222 58.415 56.287 -0.158 0.000 0.952 90 K CB 0.449 32.704 32.500 -0.408 0.000 0.736 90 K HN 0.226 8.390 8.250 -0.143 0.000 0.453 91 A N -2.490 120.368 122.820 0.062 0.000 2.916 91 A HA 0.297 4.997 4.320 0.232 -0.241 0.254 91 A C -0.680 176.980 177.584 0.128 0.000 1.544 91 A CA -0.726 51.426 52.037 0.191 0.000 1.224 91 A CB -0.815 18.387 19.000 0.336 0.000 1.012 91 A HN -0.634 7.872 8.150 0.076 -0.310 0.636 92 T N -3.405 111.199 114.554 0.083 0.000 2.906 92 T HA 0.343 4.732 4.350 0.066 0.000 0.295 92 T C -1.492 173.246 174.700 0.062 0.000 1.075 92 T CA -2.174 59.962 62.100 0.060 0.000 1.005 92 T CB 0.971 69.856 68.868 0.029 0.000 1.136 92 T HN -0.682 7.521 8.240 0.068 0.078 0.498 93 P HA -0.032 4.433 4.420 0.076 0.000 0.223 93 P C -0.145 177.189 177.300 0.056 0.000 1.151 93 P CA 1.665 64.800 63.100 0.058 0.000 0.787 93 P CB -0.029 31.695 31.700 0.039 0.000 0.788 94 T N -9.710 104.860 114.554 0.025 0.000 3.122 94 T HA 0.054 4.409 4.350 0.008 0.000 0.250 94 T C -0.026 174.664 174.700 -0.016 0.000 1.067 94 T CA -0.330 61.770 62.100 -0.000 0.000 0.966 94 T CB -0.627 68.224 68.868 -0.028 0.000 1.002 94 T HN -0.135 8.084 8.240 0.016 0.031 0.542 95 S N 1.840 117.545 115.700 0.009 0.000 2.841 95 S HA 0.193 4.642 4.470 -0.037 0.000 0.274 95 S C -0.002 174.624 174.600 0.043 0.000 1.044 95 S CA -1.420 56.774 58.200 -0.009 0.000 0.952 95 S CB 1.278 64.461 63.200 -0.028 0.000 1.331 95 S HN -0.559 7.723 8.310 0.031 0.046 0.610 96 R N -0.694 119.818 120.500 0.021 0.000 2.119 96 R HA 0.086 4.500 4.340 0.124 0.000 0.222 96 R C 0.306 176.715 176.300 0.183 0.000 1.088 96 R CA 1.064 57.213 56.100 0.083 0.000 0.984 96 R CB 0.417 30.706 30.300 -0.019 0.000 0.884 96 R HN 0.162 8.414 8.270 -0.030 0.000 0.447 97 S N -1.379 114.406 115.700 0.142 0.000 2.293 97 S HA 0.663 5.456 4.470 0.324 -0.129 0.154 97 S C -2.339 172.413 174.600 0.253 0.000 1.602 97 S CA -2.258 56.095 58.200 0.255 0.000 1.260 97 S CB 0.302 63.655 63.200 0.256 0.000 1.270 97 S HN -0.524 7.837 8.310 0.086 0.000 0.416 98 P HA -0.108 4.545 4.420 0.139 -0.149 0.219 98 P C -0.165 177.226 177.300 0.152 0.000 1.146 98 P CA 1.639 64.830 63.100 0.152 0.000 0.808 98 P CB 0.397 32.165 31.700 0.115 0.000 0.779 99 M N -4.777 114.920 119.600 0.163 0.000 2.655 99 M HA 0.161 4.697 4.480 0.094 0.000 0.311 99 M C -0.290 176.126 176.300 0.194 0.000 1.229 99 M CA -0.738 54.628 55.300 0.110 0.000 0.972 99 M CB -0.314 32.284 32.600 -0.004 0.000 1.366 99 M HN -0.284 8.421 8.290 0.177 -0.309 0.500 100 F N 2.520 122.564 119.950 0.156 0.000 2.134 100 F HA -0.415 4.314 4.527 0.337 0.000 0.299 100 F C 0.827 176.741 175.800 0.189 0.000 1.097 100 F CA 4.028 62.178 58.000 0.250 0.000 1.264 100 F CB 0.278 39.452 39.000 0.290 0.000 1.001 100 F HN -0.552 7.962 8.300 0.459 0.061 0.479 101 D N -2.118 118.373 120.400 0.152 0.000 2.117 101 D HA -0.386 4.215 4.640 -0.065 0.000 0.197 101 D C 2.013 178.296 176.300 -0.028 0.000 0.987 101 D CA 4.272 58.276 54.000 0.006 0.000 0.829 101 D CB -0.242 40.578 40.800 0.035 0.000 0.961 101 D HN 0.380 8.883 8.370 0.221 0.000 0.460 102 K N -0.621 119.789 120.400 0.016 0.000 2.057 102 K HA -0.240 4.100 4.320 0.034 0.000 0.206 102 K C 2.585 179.262 176.600 0.128 0.000 1.050 102 K CA 2.657 58.967 56.287 0.038 0.000 0.935 102 K CB -0.284 32.221 32.500 0.009 0.000 0.715 102 K HN -0.526 7.745 8.250 0.034 0.000 0.439 103 L N -1.476 119.791 121.223 0.073 0.000 2.179 103 L HA -0.083 4.377 4.340 0.201 0.000 0.208 103 L C 1.932 179.014 176.870 0.355 0.000 1.096 103 L CA 2.604 57.535 54.840 0.151 0.000 0.779 103 L CB 0.297 42.245 42.059 -0.184 0.000 0.922 103 L HN -0.599 7.643 8.230 0.020 0.000 0.443 104 I N -2.781 117.809 120.570 0.034 0.000 3.883 104 I HA -0.063 4.231 4.170 0.208 0.000 0.326 104 I C -1.590 174.453 176.117 -0.124 0.000 1.283 104 I CA -1.973 59.266 61.300 -0.101 0.000 1.161 104 I CB 0.479 37.985 38.000 -0.823 0.000 1.012 104 I HN 0.002 8.131 8.210 -0.135 0.000 0.421 105 A N 0.458 123.196 122.820 -0.136 0.000 2.580 105 A HA -0.241 3.957 4.320 -0.203 0.000 0.244 105 A C 0.655 178.105 177.584 -0.223 0.000 1.045 105 A CA 2.003 53.893 52.037 -0.246 0.000 0.761 105 A CB -0.375 18.451 19.000 -0.290 0.000 0.962 105 A HN -0.500 7.559 8.150 -0.060 0.054 0.512 106 G N 2.082 110.810 108.800 -0.119 0.000 2.218 106 G HA2 -0.252 3.716 3.960 0.014 0.000 0.216 106 G HA3 -0.252 3.803 3.960 0.159 0.000 0.216 106 G C -0.900 173.974 174.900 -0.042 0.000 0.994 106 G CA -0.023 45.093 45.100 0.027 0.000 0.637 106 G HN 0.420 8.629 8.290 -0.137 0.000 0.505 107 H N 1.544 120.340 119.070 -0.457 0.000 2.499 107 H HA 0.337 4.603 4.556 -0.484 0.000 0.340 107 H C 0.670 175.912 175.328 -0.143 0.000 1.148 107 H CA -0.995 54.696 56.048 -0.595 0.000 1.215 107 H CB 3.197 32.210 29.762 -1.249 0.000 1.529 107 H HN -0.337 7.760 8.280 -0.304 0.000 0.510 108 G N 4.423 112.982 108.800 -0.402 0.000 2.462 108 G HA2 -0.278 3.879 3.960 0.327 0.000 0.220 108 G HA3 -0.278 3.690 3.960 0.013 0.000 0.220 108 G C 1.518 176.684 174.900 0.443 0.000 1.121 108 G CA 1.821 46.994 45.100 0.122 0.000 0.758 108 G HN 0.698 8.391 8.290 -0.994 0.000 0.559 109 F N 1.946 122.076 119.950 0.300 0.000 2.408 109 F HA -0.134 4.545 4.527 0.255 0.000 0.300 109 F C 2.012 177.967 175.800 0.259 0.000 1.090 109 F CA 0.282 58.454 58.000 0.286 0.000 1.427 109 F CB -0.887 38.278 39.000 0.276 0.000 1.070 109 F HN -0.517 8.423 8.300 1.111 0.027 0.549 110 A N -0.354 122.605 122.820 0.231 0.000 2.024 110 A HA -0.267 4.099 4.320 0.076 0.000 0.220 110 A C 1.383 178.919 177.584 -0.080 0.000 1.164 110 A CA 2.300 54.333 52.037 -0.006 0.000 0.643 110 A CB -0.772 18.080 19.000 -0.246 0.000 0.806 110 A HN -0.591 7.642 8.150 0.175 0.022 0.451 111 F N -3.306 116.712 119.950 0.114 0.000 2.259 111 F HA -0.173 4.398 4.527 0.074 0.000 0.298 111 F C 0.627 176.481 175.800 0.091 0.000 1.088 111 F CA 2.837 60.885 58.000 0.080 0.000 1.358 111 F CB 0.897 39.924 39.000 0.044 0.000 1.040 111 F HN -0.700 7.758 8.300 0.309 0.028 0.505 112 E N -2.942 117.407 120.200 0.249 0.000 2.649 112 E HA 0.068 4.696 4.350 0.185 -0.167 0.308 112 E C -2.378 174.313 176.600 0.152 0.000 1.017 112 E CA 0.230 56.738 56.400 0.180 0.000 0.848 112 E CB 2.042 31.823 29.700 0.135 0.000 1.240 112 E HN -0.765 7.752 8.360 0.262 0.000 0.421 113 H N 6.577 125.666 119.070 0.031 0.000 3.162 113 H HA 0.255 4.701 4.556 -0.183 0.000 0.309 113 H C -2.726 172.576 175.328 -0.045 0.000 1.156 113 H CA -0.857 55.151 56.048 -0.067 0.000 1.586 113 H CB 1.634 31.418 29.762 0.036 0.000 1.740 113 H HN 0.143 9.004 8.280 0.216 -0.451 0.525 114 A N 6.353 129.147 122.820 -0.042 0.000 2.279 114 A HA 0.463 4.899 4.320 -0.111 -0.182 0.303 114 A C -0.016 177.456 177.584 -0.187 0.000 1.108 114 A CA -1.141 50.836 52.037 -0.101 0.000 0.830 114 A CB 1.874 20.863 19.000 -0.019 0.000 1.106 114 A HN 0.154 8.323 8.150 0.031 0.000 0.493 115 E N 1.296 121.406 120.200 -0.150 0.000 2.418 115 E HA -0.021 4.228 4.350 -0.167 0.000 0.261 115 E C -1.454 175.111 176.600 -0.059 0.000 1.070 115 E CA -1.342 54.986 56.400 -0.120 0.000 0.931 115 E CB -0.080 29.576 29.700 -0.073 0.000 0.954 115 E HN -0.315 7.974 8.360 -0.118 0.000 0.439 116 P HA -0.006 4.414 4.420 -0.001 0.000 0.272 116 P C -1.481 175.800 177.300 -0.030 0.000 1.230 116 P CA 0.213 63.304 63.100 -0.016 0.000 0.788 116 P CB 0.612 32.308 31.700 -0.006 0.000 0.949 117 R N 1.037 121.529 120.500 -0.013 0.000 3.045 117 R HA 0.327 4.637 4.340 -0.051 0.000 0.245 117 R C -0.659 175.647 176.300 0.010 0.000 1.333 117 R CA -1.865 54.226 56.100 -0.015 0.000 1.036 117 R CB 1.472 31.759 30.300 -0.021 0.000 1.340 117 R HN 0.016 8.293 8.270 0.011 0.000 0.488 118 S N -1.464 114.262 115.700 0.043 0.000 2.563 118 S HA 0.131 4.492 4.470 -0.182 0.000 0.284 118 S C 1.707 176.299 174.600 -0.012 0.000 1.331 118 S CA 0.716 58.878 58.200 -0.064 0.000 1.047 118 S CB 0.498 63.636 63.200 -0.103 0.000 0.859 118 S HN 0.217 8.576 8.310 0.082 0.000 0.514 119 H N 4.201 123.173 119.070 -0.164 0.000 2.426 119 H HA -0.354 4.170 4.556 -0.054 0.000 0.298 119 H C 2.093 177.284 175.328 -0.228 0.000 1.107 119 H CA 3.166 59.130 56.048 -0.140 0.000 1.298 119 H CB 0.087 29.818 29.762 -0.051 0.000 1.377 119 H HN 0.725 8.879 8.280 -0.211 0.000 0.519 120 A N -0.914 121.661 122.820 -0.409 0.000 1.986 120 A HA -0.261 3.817 4.320 -0.403 0.000 0.220 120 A C 0.852 178.192 177.584 -0.407 0.000 1.171 120 A CA 2.253 53.963 52.037 -0.545 0.000 0.640 120 A CB -0.543 17.929 19.000 -0.879 0.000 0.811 120 A HN 0.419 8.233 8.150 -0.529 0.019 0.451 121 F N -5.204 114.707 119.950 -0.064 0.000 2.732 121 F HA 0.120 4.636 4.527 -0.019 0.000 0.303 121 F C 0.866 176.636 175.800 -0.050 0.000 1.110 121 F CA 0.051 58.033 58.000 -0.030 0.000 1.355 121 F CB -0.526 38.475 39.000 0.002 0.000 1.081 121 F HN -0.803 7.410 8.300 -0.092 0.032 0.565 122 M N 0.191 119.827 119.600 0.060 0.000 2.159 122 M HA -0.349 4.150 4.480 0.032 0.000 0.263 122 M C 0.888 177.117 176.300 -0.118 0.000 1.063 122 M CA 4.630 59.924 55.300 -0.010 0.000 1.110 122 M CB -0.486 32.084 32.600 -0.049 0.000 1.374 122 M HN -0.442 7.815 8.290 0.030 0.051 0.411 123 L N -1.934 119.164 121.223 -0.208 0.000 2.068 123 L HA -0.174 3.853 4.340 -0.522 0.000 0.204 123 L C 1.070 177.626 176.870 -0.524 0.000 1.076 123 L CA 2.809 57.377 54.840 -0.454 0.000 0.753 123 L CB -0.239 41.539 42.059 -0.468 0.000 0.910 123 L HN -0.208 7.922 8.230 -0.166 0.000 0.439 124 V N -5.010 114.741 119.914 -0.271 0.000 2.407 124 V HA -0.465 3.487 4.120 -0.280 0.000 0.248 124 V C 1.817 177.805 176.094 -0.177 0.000 1.055 124 V CA 3.043 65.201 62.300 -0.235 0.000 1.049 124 V CB -1.049 30.690 31.823 -0.141 0.000 0.662 124 V HN -0.354 7.732 8.190 -0.175 0.000 0.455 125 D N 0.299 120.677 120.400 -0.037 0.000 2.144 125 D HA -0.274 4.372 4.640 0.010 0.000 0.200 125 D C 1.895 178.189 176.300 -0.009 0.000 0.978 125 D CA 3.421 57.426 54.000 0.007 0.000 0.833 125 D CB -0.589 40.248 40.800 0.062 0.000 0.961 125 D HN 0.038 8.416 8.370 0.013 0.000 0.470 126 H N 1.584 120.573 119.070 -0.135 0.000 2.352 126 H HA -0.286 4.252 4.556 -0.031 0.000 0.299 126 H C 2.048 177.434 175.328 0.097 0.000 1.097 126 H CA 3.307 59.296 56.048 -0.099 0.000 1.311 126 H CB 0.082 29.689 29.762 -0.259 0.000 1.377 126 H HN -0.660 7.617 8.280 -0.005 0.000 0.504 127 F N -4.382 115.487 119.950 -0.136 0.000 2.186 127 F HA -0.171 4.267 4.527 -0.149 0.000 0.299 127 F C 1.217 176.993 175.800 -0.039 0.000 1.090 127 F CA 1.995 59.884 58.000 -0.184 0.000 1.307 127 F CB 0.305 39.018 39.000 -0.479 0.000 1.019 127 F HN -0.510 7.592 8.300 -0.190 0.085 0.489 128 V N -8.949 110.988 119.914 0.038 0.000 3.590 128 V HA 0.218 4.505 4.120 0.013 -0.159 0.265 128 V C 0.393 176.498 176.094 0.018 0.000 1.239 128 V CA -0.849 61.433 62.300 -0.029 0.000 1.117 128 V CB -0.114 31.568 31.823 -0.236 0.000 0.818 128 V HN -0.775 7.397 8.190 -0.031 0.000 0.451 129 V N 1.562 121.493 119.914 0.027 0.000 2.788 129 V HA -0.291 3.853 4.120 0.040 0.000 0.307 129 V C 0.737 176.855 176.094 0.040 0.000 1.069 129 V CA 1.305 63.623 62.300 0.029 0.000 1.173 129 V CB 0.526 32.349 31.823 0.001 0.000 0.925 129 V HN -0.641 7.560 8.190 0.018 0.000 0.492 130 D N 7.073 127.509 120.400 0.060 0.000 2.263 130 D HA -0.207 4.469 4.640 0.060 0.000 0.208 130 D C 1.644 177.966 176.300 0.036 0.000 0.971 130 D CA 3.516 57.559 54.000 0.073 0.000 0.867 130 D CB -0.127 40.752 40.800 0.131 0.000 0.929 130 D HN 0.207 8.963 8.370 0.072 -0.343 0.492 131 R N -3.579 116.936 120.500 0.025 0.000 2.297 131 R HA -0.085 4.237 4.340 -0.029 0.000 0.197 131 R C 0.185 176.427 176.300 -0.097 0.000 0.943 131 R CA 2.025 58.117 56.100 -0.014 0.000 1.038 131 R CB -0.638 29.676 30.300 0.024 0.000 0.957 131 R HN 0.059 8.307 8.270 0.022 0.035 0.484 132 A N -0.523 122.236 122.820 -0.101 0.000 1.909 132 A HA 0.071 4.227 4.320 -0.274 0.000 0.210 132 A C -0.426 176.917 177.584 -0.402 0.000 1.273 132 A CA 1.909 53.798 52.037 -0.246 0.000 0.654 132 A CB 1.477 20.348 19.000 -0.214 0.000 0.945 132 A HN -0.552 7.514 8.150 -0.048 0.055 0.471 133 Y N -4.128 116.130 120.300 -0.070 0.000 2.715 133 Y HA 0.376 5.056 4.550 -0.067 -0.170 0.255 133 Y C 0.408 176.248 175.900 -0.100 0.000 1.139 133 Y CA -1.757 56.283 58.100 -0.100 0.000 1.151 133 Y CB 0.691 39.039 38.460 -0.187 0.000 1.201 133 Y HN -0.320 8.023 8.280 0.105 0.000 0.556 134 G N 0.227 109.041 108.800 0.023 0.000 2.203 134 G HA2 -0.467 3.471 3.960 -0.036 0.000 0.263 134 G HA3 -0.467 3.747 3.960 0.077 -0.208 0.263 134 G C -0.005 174.968 174.900 0.121 0.000 1.012 134 G CA 0.824 45.950 45.100 0.043 0.000 0.749 134 G HN 0.253 8.522 8.290 -0.035 0.000 0.512 135 G N -3.240 105.591 108.800 0.052 0.000 2.155 135 G HA2 -0.479 3.482 3.960 0.001 0.000 0.257 135 G HA3 -0.479 3.512 3.960 0.052 0.000 0.257 135 G C 0.163 174.973 174.900 -0.151 0.000 0.983 135 G CA 0.544 45.651 45.100 0.011 0.000 0.676 135 G HN 0.177 8.472 8.290 0.040 0.019 0.528 136 R N -0.816 119.485 120.500 -0.332 0.000 2.091 136 R HA -0.265 3.262 4.340 -1.355 0.000 0.238 136 R C -0.720 175.164 176.300 -0.692 0.000 1.136 136 R CA 2.867 58.424 56.100 -0.905 0.000 0.959 136 R CB 0.767 30.432 30.300 -1.059 0.000 0.856 136 R HN -0.443 7.559 8.270 -0.200 0.148 0.437 137 F N -4.991 114.804 119.950 -0.260 0.000 2.420 137 F HA 0.942 5.550 4.527 -0.241 -0.226 0.342 137 F C -0.377 175.276 175.800 -0.245 0.000 1.113 137 F CA -2.480 55.367 58.000 -0.255 0.000 1.059 137 F CB 0.810 39.626 39.000 -0.307 0.000 1.128 137 F HN -0.304 7.755 8.300 -0.403 0.000 0.475 138 Q N -0.607 119.154 119.800 -0.065 0.000 2.456 138 Q HA 0.264 4.472 4.340 -0.220 0.000 0.284 138 Q C -1.037 174.816 176.000 -0.246 0.000 1.061 138 Q CA -2.064 53.630 55.803 -0.182 0.000 0.799 138 Q CB 4.405 33.055 28.738 -0.148 0.000 1.445 138 Q HN 0.188 8.445 8.270 -0.023 0.000 0.411 139 F N 0.759 120.576 119.950 -0.222 0.000 2.595 139 F HA -0.162 4.412 4.527 -0.154 -0.139 0.359 139 F C 1.849 177.536 175.800 -0.189 0.000 1.147 139 F CA 2.059 59.933 58.000 -0.209 0.000 1.341 139 F CB 0.229 39.071 39.000 -0.264 0.000 1.104 139 F HN 0.394 8.555 8.300 -0.231 0.000 0.603 140 K N 1.126 121.580 120.400 0.091 0.000 2.103 140 K HA -0.378 3.951 4.320 0.015 0.000 0.207 140 K C -0.270 176.338 176.600 0.014 0.000 1.048 140 K CA 2.640 58.949 56.287 0.037 0.000 0.930 140 K CB 0.386 32.919 32.500 0.055 0.000 0.716 140 K HN 0.308 8.647 8.250 0.150 0.000 0.444 141 N N -5.544 113.162 118.700 0.010 0.000 3.020 141 N HA 0.041 4.759 4.740 -0.038 0.000 0.248 141 N C -0.512 174.969 175.510 -0.048 0.000 1.480 141 N CA -1.276 51.772 53.050 -0.003 0.000 0.874 141 N CB 0.334 38.865 38.487 0.073 0.000 1.433 141 N HN -0.745 7.656 8.380 0.038 0.001 0.530 142 W N -1.790 119.515 121.300 0.008 0.000 2.699 142 W HA -0.088 4.536 4.660 -0.059 0.000 0.249 142 W C 1.601 178.058 176.519 -0.104 0.000 1.280 142 W CA 2.111 59.428 57.345 -0.047 0.000 1.345 142 W CB 0.068 29.510 29.460 -0.030 0.000 1.128 142 W HN 0.488 8.870 8.180 0.337 0.000 0.642 143 Q N -0.619 119.238 119.800 0.095 0.000 2.230 143 Q HA -0.252 4.102 4.340 0.023 0.000 0.202 143 Q C 1.955 177.916 176.000 -0.064 0.000 0.963 143 Q CA 2.743 58.558 55.803 0.019 0.000 0.866 143 Q CB -0.373 28.383 28.738 0.031 0.000 0.931 143 Q HN -0.324 8.180 8.270 0.109 -0.169 0.452 144 K N -1.742 118.591 120.400 -0.112 0.000 2.439 144 K HA -0.074 4.214 4.320 -0.052 0.000 0.197 144 K C 1.710 178.054 176.600 -0.426 0.000 1.041 144 K CA 1.354 57.554 56.287 -0.145 0.000 0.970 144 K CB -0.667 31.838 32.500 0.009 0.000 0.773 144 K HN -0.553 7.720 8.250 -0.089 -0.076 0.479 145 V N -5.865 113.642 119.914 -0.678 0.000 2.720 145 V HA -0.198 3.030 4.120 -1.487 0.000 0.256 145 V C 1.083 176.923 176.094 -0.425 0.000 1.082 145 V CA 2.914 64.683 62.300 -0.885 0.000 1.101 145 V CB -1.583 29.856 31.823 -0.641 0.000 0.693 145 V HN -0.386 7.438 8.190 -0.526 0.050 0.479 146 T N -5.348 109.116 114.554 -0.150 0.000 3.088 146 T HA -0.173 4.227 4.350 0.083 0.000 0.259 146 T C 0.413 175.259 174.700 0.244 0.000 1.122 146 T CA 1.412 63.550 62.100 0.063 0.000 1.095 146 T CB -0.168 68.729 68.868 0.048 0.000 0.930 146 T HN -0.565 7.551 8.240 -0.148 0.036 0.508 147 D N 3.641 124.170 120.400 0.214 0.000 2.563 147 D HA 0.185 4.897 4.640 0.120 0.000 0.222 147 D C 0.699 177.078 176.300 0.131 0.000 1.145 147 D CA -1.714 52.383 54.000 0.160 0.000 1.001 147 D CB -0.451 40.408 40.800 0.098 0.000 1.049 147 D HN -0.546 7.858 8.370 0.147 0.053 0.515 148 G N 2.509 111.276 108.800 -0.056 0.000 2.404 148 G HA2 -0.344 2.987 3.960 -1.048 0.000 0.215 148 G HA3 -0.344 3.214 3.960 -0.669 0.000 0.215 148 G C 0.760 175.475 174.900 -0.308 0.000 1.174 148 G CA 2.380 47.139 45.100 -0.569 0.000 0.780 148 G HN -0.242 8.063 8.290 0.026 0.000 0.537 149 M N 1.932 121.445 119.600 -0.147 0.000 2.159 149 M HA -0.205 4.233 4.480 -0.069 0.000 0.263 149 M C 1.970 178.274 176.300 0.006 0.000 1.063 149 M CA 1.574 56.844 55.300 -0.050 0.000 1.110 149 M CB -0.428 32.179 32.600 0.011 0.000 1.374 149 M HN -0.106 8.119 8.290 -0.110 0.000 0.411 150 G N -2.233 106.577 108.800 0.016 0.000 2.418 150 G HA2 -0.387 3.605 3.960 0.053 0.000 0.217 150 G HA3 -0.387 3.753 3.960 0.055 -0.147 0.217 150 G C 0.514 175.434 174.900 0.034 0.000 1.158 150 G CA 1.870 46.996 45.100 0.044 0.000 0.771 150 G HN -0.164 8.446 8.290 0.015 -0.311 0.545 151 A N 1.724 124.552 122.820 0.013 0.000 1.908 151 A HA -0.278 4.041 4.320 -0.002 0.000 0.218 151 A C 1.846 179.417 177.584 -0.021 0.000 1.181 151 A CA 2.855 54.886 52.037 -0.009 0.000 0.627 151 A CB -0.491 18.508 19.000 -0.002 0.000 0.818 151 A HN -0.515 7.639 8.150 0.008 0.000 0.445 152 V N -1.126 118.779 119.914 -0.014 0.000 2.358 152 V HA -0.372 3.804 4.120 0.094 0.000 0.246 152 V C 2.058 178.274 176.094 0.203 0.000 1.047 152 V CA 3.596 65.949 62.300 0.087 0.000 1.035 152 V CB -0.814 31.053 31.823 0.073 0.000 0.658 152 V HN -0.506 7.649 8.190 -0.060 0.000 0.452 153 R N -0.370 120.225 120.500 0.158 0.000 2.096 153 R HA -0.240 4.226 4.340 0.210 0.000 0.235 153 R C 0.570 176.989 176.300 0.197 0.000 1.127 153 R CA 2.083 58.293 56.100 0.183 0.000 0.968 153 R CB 1.010 31.380 30.300 0.117 0.000 0.861 153 R HN -0.332 8.006 8.270 0.113 0.000 0.440 154 G N -6.554 102.288 108.800 0.071 0.000 2.380 154 G HA2 -0.027 4.020 3.960 -0.154 0.000 0.305 154 G HA3 -0.027 3.891 3.960 -0.069 0.000 0.305 154 G C -1.606 173.197 174.900 -0.162 0.000 1.672 154 G CA -0.114 44.940 45.100 -0.076 0.000 0.904 154 G HN -0.647 7.671 8.290 0.046 0.000 0.686 155 A N 4.042 126.656 122.820 -0.343 0.000 1.917 155 A HA -0.168 3.913 4.320 -0.399 0.000 0.219 155 A C 1.114 178.288 177.584 -0.683 0.000 1.182 155 A CA 3.123 54.812 52.037 -0.580 0.000 0.633 155 A CB 0.180 18.689 19.000 -0.818 0.000 0.819 155 A HN 0.365 8.193 8.150 -0.362 0.105 0.448 156 W N -7.580 113.639 121.300 -0.135 0.000 3.180 156 W HA 0.019 4.558 4.660 -0.203 0.000 0.254 156 W C 0.749 177.216 176.519 -0.087 0.000 1.318 156 W CA -0.000 57.249 57.345 -0.160 0.000 1.608 156 W CB -0.350 28.994 29.460 -0.194 0.000 1.124 156 W HN -0.052 7.863 8.180 -0.420 0.013 0.694 157 T N -5.170 109.408 114.554 0.039 0.000 3.067 157 T HA -0.032 4.360 4.350 0.071 0.000 0.261 157 T C 0.717 175.443 174.700 0.044 0.000 1.110 157 T CA 1.427 63.558 62.100 0.050 0.000 1.113 157 T CB 0.127 69.023 68.868 0.047 0.000 0.917 157 T HN -0.359 7.716 8.240 -0.018 0.154 0.499 158 V N -5.849 114.073 119.914 0.012 0.000 3.502 158 V HA 0.277 4.454 4.120 0.094 0.000 0.288 158 V C -1.554 174.564 176.094 0.040 0.000 1.461 158 V CA -0.074 62.270 62.300 0.073 0.000 1.029 158 V CB 1.012 32.938 31.823 0.172 0.000 0.843 158 V HN -0.607 7.521 8.190 -0.050 0.032 0.438 159 L N -1.234 119.934 121.223 -0.091 0.000 2.313 159 L HA 0.838 5.236 4.340 -0.153 -0.149 0.268 159 L C 0.113 177.013 176.870 0.050 0.000 1.010 159 L CA -1.769 52.984 54.840 -0.145 0.000 0.814 159 L CB 3.078 44.864 42.059 -0.454 0.000 1.304 159 L HN -0.700 7.465 8.230 -0.108 0.000 0.441 160 T N -4.487 110.096 114.554 0.047 0.000 2.924 160 T HA 0.332 4.743 4.350 0.102 0.000 0.291 160 T C -2.131 172.657 174.700 0.146 0.000 1.045 160 T CA -1.845 60.304 62.100 0.083 0.000 1.015 160 T CB 2.573 71.450 68.868 0.015 0.000 1.103 160 T HN 0.551 8.784 8.240 -0.011 0.000 0.496 161 D N 1.111 121.562 120.400 0.085 0.000 2.308 161 D HA 0.239 5.098 4.640 0.150 -0.129 0.242 161 D C 0.122 176.331 176.300 -0.152 0.000 1.059 161 D CA -1.887 52.137 54.000 0.040 0.000 0.830 161 D CB 2.555 43.357 40.800 0.003 0.000 1.161 161 D HN 0.096 8.483 8.370 0.029 0.000 0.494 162 A N 4.977 127.578 122.820 -0.365 0.000 2.019 162 A HA -0.200 3.982 4.320 -0.230 0.000 0.219 162 A C 0.107 177.555 177.584 -0.226 0.000 1.164 162 A CA 1.635 53.438 52.037 -0.390 0.000 0.644 162 A CB 0.560 19.076 19.000 -0.806 0.000 0.805 162 A HN 0.392 8.233 8.150 -0.515 0.000 0.449 163 D N -4.600 115.670 120.400 -0.217 0.000 2.527 163 D HA 0.418 5.054 4.640 -0.007 0.000 0.242 163 D C -2.203 174.072 176.300 -0.041 0.000 1.285 163 D CA -1.920 52.064 54.000 -0.027 0.000 0.886 163 D CB 0.908 41.806 40.800 0.163 0.000 1.402 163 D HN -0.558 7.893 8.370 -0.308 -0.265 0.528 164 P HA -0.003 4.497 4.420 -0.088 -0.133 0.228 164 P C -0.211 177.070 177.300 -0.032 0.000 1.151 164 P CA 1.079 64.140 63.100 -0.065 0.000 0.770 164 P CB 0.345 32.000 31.700 -0.076 0.000 0.786 165 E N -4.200 115.996 120.200 -0.006 0.000 2.489 165 E HA 0.018 4.368 4.350 -0.001 0.000 0.193 165 E C -0.236 176.376 176.600 0.020 0.000 1.057 165 E CA -0.321 56.082 56.400 0.006 0.000 0.866 165 E CB 0.115 29.821 29.700 0.011 0.000 0.916 165 E HN -0.220 8.315 8.360 0.001 -0.175 0.500 166 S N -2.173 113.547 115.700 0.033 0.000 2.570 166 S HA 0.412 4.906 4.470 0.039 0.000 0.286 166 S C -0.729 173.902 174.600 0.052 0.000 1.099 166 S CA -1.140 57.088 58.200 0.047 0.000 0.913 166 S CB 2.710 65.948 63.200 0.064 0.000 1.085 166 S HN -0.516 7.771 8.310 0.033 0.042 0.480 167 S N -1.400 114.337 115.700 0.060 0.000 2.701 167 S HA 0.080 4.594 4.470 0.073 0.000 0.242 167 S C -1.090 173.564 174.600 0.091 0.000 1.025 167 S CA -0.256 57.990 58.200 0.077 0.000 1.016 167 S CB 0.696 63.949 63.200 0.088 0.000 0.977 167 S HN 0.296 8.640 8.310 0.057 0.000 0.546 168 D N 0.963 121.408 120.400 0.075 0.000 2.304 168 D HA -0.023 4.659 4.640 0.070 0.000 0.247 168 D C -0.439 175.908 176.300 0.077 0.000 1.089 168 D CA -0.711 53.328 54.000 0.064 0.000 0.910 168 D CB 0.768 41.585 40.800 0.029 0.000 1.199 168 D HN -0.652 7.758 8.370 0.066 0.000 0.426 169 Q N 0.196 120.037 119.800 0.068 0.000 2.281 169 Q HA -0.072 4.325 4.340 0.096 0.000 0.267 169 Q C -0.336 175.666 176.000 0.004 0.000 1.053 169 Q CA 0.855 56.693 55.803 0.058 0.000 0.905 169 Q CB 0.112 28.870 28.738 0.034 0.000 1.195 169 Q HN 0.376 8.685 8.270 0.065 0.000 0.398 170 R N 1.816 122.316 120.500 -0.000 0.000 2.734 170 R HA 0.356 4.630 4.340 -0.110 0.000 0.271 170 R C -2.108 174.104 176.300 -0.146 0.000 1.021 170 R CA -1.874 54.150 56.100 -0.126 0.000 0.893 170 R CB 2.039 32.192 30.300 -0.244 0.000 1.244 170 R HN 0.034 8.353 8.270 0.081 0.000 0.464 171 R N 0.574 120.953 120.500 -0.203 0.000 2.267 171 R HA 0.017 4.459 4.340 -0.037 -0.124 0.319 171 R C -0.783 175.359 176.300 -0.264 0.000 1.067 171 R CA 1.028 57.044 56.100 -0.140 0.000 0.936 171 R CB 0.220 30.447 30.300 -0.121 0.000 1.006 171 R HN 0.461 8.608 8.270 -0.204 0.000 0.452 172 F N 4.519 124.429 119.950 -0.068 0.000 2.582 172 F HA 0.032 4.532 4.527 -0.045 0.000 0.290 172 F C 0.032 175.816 175.800 -0.027 0.000 1.115 172 F CA 1.776 59.746 58.000 -0.051 0.000 1.445 172 F CB 1.095 40.055 39.000 -0.067 0.000 1.126 172 F HN 0.847 9.224 8.300 0.312 0.109 0.574 173 L N -2.119 119.190 121.223 0.144 0.000 2.342 173 L HA 0.393 4.788 4.340 0.091 0.000 0.271 173 L C 0.283 177.187 176.870 0.057 0.000 1.008 173 L CA -1.345 53.552 54.840 0.095 0.000 0.818 173 L CB 2.497 44.618 42.059 0.102 0.000 1.296 173 L HN -0.706 7.612 8.230 0.147 0.000 0.427 174 S N 0.267 116.003 115.700 0.060 0.000 2.368 174 S HA -0.201 4.287 4.470 0.029 0.000 0.225 174 S C 1.036 175.688 174.600 0.086 0.000 1.030 174 S CA 2.128 60.361 58.200 0.055 0.000 0.999 174 S CB -0.066 63.170 63.200 0.061 0.000 0.844 174 S HN 0.293 8.644 8.310 0.068 0.000 0.459 175 Q N 2.089 121.971 119.800 0.135 0.000 3.035 175 Q HA 0.289 4.842 4.340 0.355 0.000 0.354 175 Q C -1.307 174.850 176.000 0.261 0.000 1.247 175 Q CA -0.872 55.091 55.803 0.268 0.000 1.068 175 Q CB -1.570 27.319 28.738 0.251 0.000 1.424 175 Q HN 0.519 8.864 8.270 0.124 0.000 0.486 176 T N -4.974 109.567 114.554 -0.022 0.000 2.887 176 T HA 0.447 4.839 4.350 -0.091 -0.097 0.292 176 T C -2.461 171.799 174.700 -0.733 0.000 1.087 176 T CA -1.769 60.206 62.100 -0.208 0.000 1.009 176 T CB 3.476 72.301 68.868 -0.073 0.000 1.203 176 T HN -0.720 7.414 8.240 -0.077 0.059 0.518 177 A N -2.398 120.037 122.820 -0.641 0.000 2.435 177 A HA 0.490 4.434 4.320 -0.627 0.000 0.296 177 A C -1.474 175.941 177.584 -0.282 0.000 1.147 177 A CA -1.025 50.653 52.037 -0.599 0.000 0.775 177 A CB 2.762 21.369 19.000 -0.655 0.000 1.340 177 A HN 0.116 8.023 8.150 -0.405 0.000 0.427 178 T N -4.108 110.311 114.554 -0.224 0.000 3.416 178 T HA 0.276 4.668 4.350 -0.187 -0.154 0.245 178 T C 0.018 174.620 174.700 -0.163 0.000 1.081 178 T CA -1.056 60.941 62.100 -0.172 0.000 1.190 178 T CB -1.727 67.072 68.868 -0.115 0.000 1.068 178 T HN 0.012 8.116 8.240 -0.228 0.000 0.580 179 A N 1.354 124.078 122.820 -0.160 0.000 2.119 179 A HA -0.019 4.260 4.320 -0.068 0.000 0.216 179 A C -0.425 177.108 177.584 -0.084 0.000 1.152 179 A CA 0.769 52.753 52.037 -0.088 0.000 0.708 179 A CB 0.074 19.058 19.000 -0.025 0.000 0.805 179 A HN -0.223 7.826 8.150 -0.170 0.000 0.460 180 A N -2.194 120.478 122.820 -0.247 0.000 2.483 180 A HA -0.118 4.177 4.320 -0.041 0.000 0.238 180 A C -0.819 176.728 177.584 -0.062 0.000 1.070 180 A CA 0.382 52.278 52.037 -0.236 0.000 0.770 180 A CB 0.690 19.153 19.000 -0.896 0.000 1.008 180 A HN -0.479 7.407 8.150 -0.380 0.036 0.497 181 N N 1.167 119.927 118.700 0.100 0.000 2.825 181 N HA 0.269 5.107 4.740 0.163 0.000 0.253 181 N C -1.818 173.841 175.510 0.248 0.000 1.426 181 N CA -1.555 51.594 53.050 0.166 0.000 0.851 181 N CB -0.184 38.391 38.487 0.147 0.000 1.470 181 N HN -0.622 7.849 8.380 0.151 0.000 0.517 182 P HA -0.078 4.683 4.420 0.570 0.000 0.222 182 P C 0.528 177.978 177.300 0.250 0.000 1.147 182 P CA 1.746 65.085 63.100 0.399 0.000 0.790 182 P CB 0.139 32.036 31.700 0.329 0.000 0.780 183 V N -1.540 118.525 119.914 0.252 0.000 2.407 183 V HA -0.462 3.763 4.120 0.174 0.000 0.248 183 V C 1.880 177.985 176.094 0.019 0.000 1.055 183 V CA 3.893 66.302 62.300 0.182 0.000 1.049 183 V CB -1.123 30.852 31.823 0.253 0.000 0.662 183 V HN -0.268 8.265 8.190 0.270 -0.181 0.455 184 C N -0.437 118.889 119.300 0.042 0.000 2.391 184 C HA -0.313 4.108 4.460 -0.064 0.000 0.276 184 C C 2.130 176.935 174.990 -0.310 0.000 1.217 184 C CA 3.623 62.591 59.018 -0.083 0.000 1.766 184 C CB -2.127 25.623 27.740 0.016 0.000 2.046 184 C HN -0.484 7.963 8.230 0.117 -0.147 0.475 185 L N -1.942 119.072 121.223 -0.349 0.000 2.265 185 L HA -0.276 3.670 4.340 -0.657 0.000 0.215 185 L C 2.331 178.965 176.870 -0.394 0.000 1.117 185 L CA 2.120 56.649 54.840 -0.519 0.000 0.782 185 L CB -1.568 40.094 42.059 -0.661 0.000 0.914 185 L HN -0.456 7.622 8.230 -0.219 0.021 0.441 186 N N -1.143 117.365 118.700 -0.319 0.000 2.453 186 N HA -0.188 4.508 4.740 -0.074 0.000 0.183 186 N C 0.205 175.611 175.510 -0.174 0.000 1.041 186 N CA 3.047 55.980 53.050 -0.194 0.000 0.900 186 N CB 0.214 38.574 38.487 -0.211 0.000 0.961 186 N HN -0.458 7.698 8.380 -0.321 0.031 0.443 187 C N -3.907 115.252 119.300 -0.234 0.000 2.688 187 C HA 0.205 4.540 4.460 -0.207 0.000 0.297 187 C C 0.303 175.122 174.990 -0.286 0.000 1.308 187 C CA -0.933 57.936 59.018 -0.248 0.000 1.726 187 C CB -1.463 26.102 27.740 -0.293 0.000 1.982 187 C HN -0.426 7.613 8.230 -0.270 0.028 0.604 188 K N -2.731 117.480 120.400 -0.314 0.000 2.436 188 K HA 0.271 4.413 4.320 -0.296 0.000 0.198 188 K C -0.986 175.447 176.600 -0.277 0.000 1.174 188 K CA -0.436 55.651 56.287 -0.333 0.000 0.951 188 K CB 2.503 34.709 32.500 -0.491 0.000 1.040 188 K HN -0.129 7.762 8.250 -0.315 0.170 0.536 189 T N -0.968 113.450 114.554 -0.227 0.000 2.840 189 T HA 0.362 4.606 4.350 -0.177 0.000 0.317 189 T C -2.406 172.251 174.700 -0.072 0.000 1.401 189 T CA -0.188 61.819 62.100 -0.155 0.000 1.028 189 T CB 2.161 70.945 68.868 -0.139 0.000 1.317 189 T HN -0.369 7.745 8.240 -0.210 0.000 0.495 190 Q N 1.122 120.858 119.800 -0.106 0.000 2.129 190 Q HA 0.459 4.546 4.340 -0.422 0.000 0.274 190 Q C 0.464 176.480 176.000 0.027 0.000 0.854 190 Q CA -1.031 54.673 55.803 -0.165 0.000 1.123 190 Q CB 0.971 29.655 28.738 -0.090 0.000 1.226 190 Q HN 0.465 9.036 8.270 -0.141 -0.386 0.454 191 D N 1.256 121.745 120.400 0.147 0.000 2.221 191 D HA -0.272 4.551 4.640 0.306 0.000 0.204 191 D C -0.202 176.248 176.300 0.251 0.000 0.982 191 D CA 3.210 57.357 54.000 0.245 0.000 0.857 191 D CB -0.275 40.652 40.800 0.212 0.000 0.934 191 D HN -0.420 8.030 8.370 0.132 0.000 0.475 192 H N -7.295 111.891 119.070 0.195 0.000 2.524 192 H HA 0.082 4.875 4.556 0.394 0.000 0.280 192 H C 0.565 176.073 175.328 0.300 0.000 1.018 192 H CA -1.065 55.181 56.048 0.329 0.000 1.165 192 H CB -1.549 28.487 29.762 0.456 0.000 1.411 192 H HN -0.242 8.132 8.280 0.225 0.040 0.569 193 I N 1.586 122.076 120.570 -0.132 0.000 2.315 193 I HA -0.420 3.644 4.170 -0.177 0.000 0.251 193 I C -0.602 175.558 176.117 0.073 0.000 1.125 193 I CA 3.118 64.362 61.300 -0.094 0.000 1.392 193 I CB 0.090 38.044 38.000 -0.076 0.000 1.065 193 I HN -0.628 7.442 8.210 -0.114 0.071 0.424 194 L N -6.084 115.228 121.223 0.150 0.000 2.592 194 L HA -0.073 4.440 4.340 0.290 0.000 0.227 194 L C -0.217 176.901 176.870 0.413 0.000 1.127 194 L CA 0.202 55.192 54.840 0.251 0.000 0.884 194 L CB -0.632 41.508 42.059 0.135 0.000 1.065 194 L HN -0.213 8.085 8.230 0.141 0.017 0.457 195 D N -2.763 117.916 120.400 0.465 0.000 2.513 195 D HA 0.269 5.171 4.640 0.436 0.000 0.222 195 D C -2.287 174.384 176.300 0.619 0.000 1.210 195 D CA -0.136 54.175 54.000 0.518 0.000 0.825 195 D CB 2.268 43.389 40.800 0.536 0.000 1.037 195 D HN -0.191 8.275 8.370 0.450 0.173 0.506 196 W N 0.008 121.484 121.300 0.294 0.000 2.830 196 W HA 0.444 5.388 4.660 0.183 -0.174 0.335 196 W C -2.720 173.643 176.519 -0.261 0.000 1.043 196 W CA -1.117 56.316 57.345 0.147 0.000 1.239 196 W CB 2.957 32.620 29.460 0.340 0.000 1.378 196 W HN -0.823 7.655 8.180 0.497 0.000 0.456 197 A N 5.839 128.331 122.820 -0.546 0.000 2.332 197 A HA 0.015 3.691 4.320 -1.276 -0.122 0.258 197 A C -0.807 176.478 177.584 -0.498 0.000 1.087 197 A CA -0.917 50.676 52.037 -0.739 0.000 0.802 197 A CB 1.858 20.652 19.000 -0.343 0.000 1.042 197 A HN 0.449 8.341 8.150 -0.430 0.000 0.489 198 Y N 2.412 122.479 120.300 -0.388 0.000 2.865 198 Y HA -0.462 4.044 4.550 -0.074 0.000 0.338 198 Y C 0.248 176.056 175.900 -0.154 0.000 1.269 198 Y CA 2.626 60.627 58.100 -0.165 0.000 1.585 198 Y CB 0.292 38.691 38.460 -0.102 0.000 1.224 198 Y HN -0.125 8.044 8.280 -0.185 0.000 0.554 199 M N 3.916 123.261 119.600 -0.425 0.000 2.931 199 M HA -0.492 3.939 4.480 -0.239 -0.094 0.190 199 M C 0.707 176.858 176.300 -0.249 0.000 0.626 199 M CA 0.659 55.765 55.300 -0.323 0.000 0.722 199 M CB -2.323 30.043 32.600 -0.390 0.000 2.597 199 M HN 0.339 8.612 8.290 -0.353 -0.195 0.299 200 G N -2.692 105.672 108.800 -0.727 0.000 2.147 200 G HA2 -0.514 2.077 3.960 -2.282 0.000 0.244 200 G HA3 -0.514 2.687 3.960 -1.265 0.000 0.244 200 G C -0.925 173.598 174.900 -0.628 0.000 1.005 200 G CA 0.221 44.518 45.100 -1.339 0.000 0.713 200 G HN 0.388 8.101 8.290 -0.849 0.067 0.515 201 D N 0.679 120.850 120.400 -0.381 0.000 2.400 201 D HA -0.039 4.509 4.640 -0.153 0.000 0.238 201 D C -0.305 175.907 176.300 -0.146 0.000 1.157 201 D CA 0.668 54.559 54.000 -0.182 0.000 0.889 201 D CB 0.563 41.319 40.800 -0.072 0.000 1.199 201 D HN -0.875 7.239 8.370 -0.362 0.039 0.436 202 E N 1.219 121.374 120.200 -0.074 0.000 2.413 202 E HA -0.115 4.213 4.350 -0.037 0.000 0.263 202 E C -0.934 175.704 176.600 0.064 0.000 1.015 202 E CA 1.480 57.866 56.400 -0.024 0.000 0.916 202 E CB 0.257 29.942 29.700 -0.025 0.000 0.947 202 E HN 0.216 8.535 8.360 -0.068 0.000 0.440 203 H N 4.576 123.637 119.070 -0.015 0.000 3.123 203 H HA 0.046 4.624 4.556 0.036 0.000 0.346 203 H C 0.703 176.048 175.328 0.028 0.000 1.138 203 H CA -0.040 56.034 56.048 0.044 0.000 1.273 203 H CB 1.603 31.456 29.762 0.152 0.000 1.926 203 H HN -0.243 8.105 8.280 0.114 0.000 0.524 204 E N 4.523 124.762 120.200 0.065 0.000 2.160 204 E HA -0.183 4.180 4.350 0.021 0.000 0.195 204 E C 0.137 176.807 176.600 0.115 0.000 0.991 204 E CA 2.015 58.451 56.400 0.060 0.000 0.810 204 E CB -0.354 29.326 29.700 -0.033 0.000 0.742 204 E HN 0.390 8.640 8.360 -0.183 0.000 0.466 205 A N -2.513 120.480 122.820 0.288 0.000 2.251 205 A HA 0.081 4.334 4.320 -0.113 0.000 0.209 205 A C -0.819 176.702 177.584 -0.105 0.000 1.187 205 A CA 0.107 52.089 52.037 -0.090 0.000 0.823 205 A CB 0.904 19.602 19.000 -0.503 0.000 0.846 205 A HN -0.409 8.201 8.150 0.807 0.025 0.486 206 A N -1.643 121.272 122.820 0.159 0.000 2.260 206 A HA 0.148 4.654 4.320 0.310 0.000 0.308 206 A C -0.573 177.016 177.584 0.009 0.000 1.254 206 A CA -0.834 51.333 52.037 0.216 0.000 0.874 206 A CB 0.528 19.679 19.000 0.251 0.000 1.153 206 A HN -0.706 7.425 8.150 0.232 0.158 0.527 207 K N 5.204 125.540 120.400 -0.107 0.000 2.097 207 K HA -0.108 3.966 4.320 -0.409 0.000 0.205 207 K C 0.265 176.500 176.600 -0.609 0.000 1.050 207 K CA 1.920 57.923 56.287 -0.473 0.000 0.938 207 K CB 0.432 32.509 32.500 -0.705 0.000 0.718 207 K HN 0.358 8.591 8.250 -0.029 0.000 0.442 208 W N -3.263 118.074 121.300 0.061 0.000 2.761 208 W HA 0.154 4.737 4.660 -0.127 0.000 0.340 208 W C -1.406 175.044 176.519 -0.115 0.000 1.072 208 W CA -1.747 55.552 57.345 -0.077 0.000 1.215 208 W CB 2.559 31.860 29.460 -0.266 0.000 1.420 208 W HN -0.537 7.680 8.180 0.098 0.022 0.519 209 S N -0.732 115.003 115.700 0.058 0.000 2.688 209 S HA 0.457 4.445 4.470 -0.803 0.000 0.275 209 S C 0.713 175.252 174.600 -0.102 0.000 1.175 209 S CA -0.424 57.596 58.200 -0.300 0.000 0.818 209 S CB 2.847 65.924 63.200 -0.205 0.000 1.157 209 S HN 0.379 8.774 8.310 0.142 0.000 0.482 210 R N 0.326 120.721 120.500 -0.175 0.000 2.139 210 R HA -0.235 4.247 4.340 0.237 0.000 0.243 210 R C 0.932 177.286 176.300 0.089 0.000 1.145 210 R CA 3.167 59.309 56.100 0.071 0.000 0.976 210 R CB 0.216 30.535 30.300 0.032 0.000 0.866 210 R HN 0.146 8.211 8.270 -0.343 0.000 0.449 211 T N -7.863 106.717 114.554 0.043 0.000 3.122 211 T HA 0.176 4.568 4.350 0.069 0.000 0.250 211 T C 0.656 175.413 174.700 0.095 0.000 1.067 211 T CA -0.892 61.245 62.100 0.061 0.000 0.966 211 T CB 0.006 68.892 68.868 0.031 0.000 1.002 211 T HN -0.664 7.549 8.240 0.003 0.028 0.542 212 S N 2.372 118.151 115.700 0.132 0.000 2.580 212 S HA -0.087 4.504 4.470 0.201 0.000 0.266 212 S C 0.137 174.864 174.600 0.211 0.000 1.354 212 S CA 0.787 59.112 58.200 0.208 0.000 1.008 212 S CB 0.576 63.965 63.200 0.316 0.000 0.898 212 S HN -0.506 7.829 8.310 0.123 0.049 0.555 213 E N 1.679 122.028 120.200 0.249 0.000 2.159 213 E HA 0.027 4.488 4.350 0.187 0.000 0.272 213 E C 0.288 177.049 176.600 0.268 0.000 1.138 213 E CA -0.263 56.273 56.400 0.226 0.000 0.915 213 E CB -0.666 29.160 29.700 0.210 0.000 1.028 213 E HN 0.380 8.909 8.360 0.281 0.000 0.423 214 V N 6.570 126.646 119.914 0.271 0.000 2.469 214 V HA -0.302 4.064 4.120 0.410 0.000 0.251 214 V C 0.424 176.760 176.094 0.403 0.000 1.064 214 V CA 2.951 65.473 62.300 0.370 0.000 1.066 214 V CB 0.004 32.041 31.823 0.356 0.000 0.667 214 V HN 0.709 9.039 8.190 0.234 0.000 0.461 215 V N -0.994 119.127 119.914 0.344 0.000 2.343 215 V HA -0.516 3.831 4.120 0.378 0.000 0.247 215 V C 1.984 178.178 176.094 0.167 0.000 1.051 215 V CA 4.393 66.867 62.300 0.290 0.000 1.036 215 V CB -0.817 31.125 31.823 0.197 0.000 0.654 215 V HN 0.423 8.779 8.190 0.297 0.012 0.451 216 E N -0.528 119.780 120.200 0.179 0.000 2.077 216 E HA -0.372 nan 4.350 nan 0.000 0.193 216 E C 2.273 178.901 176.600 0.047 0.000 0.989 216 E CA 2.614 59.126 56.400 0.188 0.000 0.800 216 E CB -0.301 29.622 29.700 0.371 0.000 0.746 216 E HN -0.696 7.792 8.360 0.214 0.000 0.452 217 F N 0.059 119.753 119.950 -0.427 0.000 2.102 217 F HA -0.349 2.872 4.527 -2.177 0.000 0.298 217 F C 1.592 177.110 175.800 -0.471 0.000 1.105 217 F CA 1.555 58.897 58.000 -1.097 0.000 1.239 217 F CB -0.123 38.367 39.000 -0.850 0.000 0.991 217 F HN -0.573 7.770 8.300 0.072 0.000 0.474 218 A N -0.315 122.409 122.820 -0.160 0.000 1.917 218 A HA -0.428 3.874 4.320 -0.031 0.000 0.219 218 A C 2.162 179.647 177.584 -0.165 0.000 1.182 218 A CA 3.203 55.168 52.037 -0.120 0.000 0.633 218 A CB -0.761 18.156 19.000 -0.138 0.000 0.819 218 A HN 0.230 8.393 8.150 0.023 0.000 0.448 219 R N -3.901 116.411 120.500 -0.312 0.000 2.241 219 R HA -0.217 3.484 4.340 -1.066 0.000 0.224 219 R C 1.101 177.248 176.300 -0.255 0.000 1.101 219 R CA 2.232 58.001 56.100 -0.552 0.000 0.995 219 R CB -0.158 29.852 30.300 -0.482 0.000 0.870 219 R HN -0.688 7.435 8.270 -0.245 0.000 0.463 220 D N -3.014 117.348 120.400 -0.062 0.000 2.339 220 D HA 0.056 4.749 4.640 0.087 0.000 0.217 220 D C -0.729 175.623 176.300 0.086 0.000 1.050 220 D CA 0.863 54.915 54.000 0.086 0.000 0.856 220 D CB 0.657 41.644 40.800 0.311 0.000 0.922 220 D HN -0.459 7.701 8.370 -0.103 0.148 0.518 221 L N -2.700 118.566 121.223 0.072 0.000 2.346 221 L HA 0.174 4.523 4.340 0.014 0.000 0.274 221 L C -1.621 175.297 176.870 0.080 0.000 1.007 221 L CA -0.860 53.997 54.840 0.029 0.000 0.818 221 L CB 2.338 44.312 42.059 -0.141 0.000 1.284 221 L HN -0.689 7.553 8.230 0.121 0.060 0.424 222 N N -1.410 117.204 118.700 -0.144 0.000 2.509 222 N HA 0.229 4.806 4.740 -0.273 0.000 0.254 222 N C -0.925 174.309 175.510 -0.461 0.000 1.064 222 N CA 0.633 53.455 53.050 -0.381 0.000 0.865 222 N CB 3.780 41.888 38.487 -0.632 0.000 1.659 222 N HN 0.417 9.036 8.380 -0.162 -0.336 0.495 223 H N 1.394 120.437 119.070 -0.044 0.000 2.457 223 H HA 0.596 5.118 4.556 -0.056 0.000 0.335 223 H C -2.437 172.820 175.328 -0.118 0.000 1.115 223 H CA -2.033 53.978 56.048 -0.062 0.000 1.219 223 H CB 1.006 30.749 29.762 -0.031 0.000 1.471 223 H HN -0.290 8.121 8.280 -0.258 -0.286 0.491 224 P HA 0.215 4.776 4.420 -0.130 -0.218 0.281 224 P C -0.411 176.828 177.300 -0.102 0.000 1.249 224 P CA -1.222 61.839 63.100 -0.066 0.000 0.810 224 P CB 1.577 33.267 31.700 -0.018 0.000 1.008 225 L N -0.751 120.359 121.223 -0.188 0.000 3.995 225 L HA -0.412 3.736 4.340 -0.320 0.000 0.513 225 L C -1.718 174.882 176.870 -0.450 0.000 1.147 225 L CA 0.615 55.274 54.840 -0.302 0.000 0.703 225 L CB -1.329 40.577 42.059 -0.254 0.000 1.306 225 L HN -0.241 7.871 8.230 -0.195 0.000 0.779 226 N N -1.669 116.725 118.700 -0.510 0.000 2.395 226 N HA -0.176 4.228 4.740 -0.561 0.000 0.246 226 N C 1.673 176.744 175.510 -0.733 0.000 1.246 226 N CA 0.802 53.411 53.050 -0.735 0.000 0.879 226 N CB 0.876 38.551 38.487 -1.352 0.000 1.098 226 N HN -0.416 7.682 8.380 -0.470 0.000 0.444 227 C N 0.004 118.978 119.300 -0.545 0.000 2.411 227 C HA -0.221 4.059 4.460 -0.300 0.000 0.279 227 C C 1.575 176.474 174.990 -0.151 0.000 1.288 227 C CA 2.887 61.737 59.018 -0.280 0.000 1.764 227 C CB -0.966 26.719 27.740 -0.092 0.000 1.974 227 C HN 0.867 8.815 8.230 -0.471 0.000 0.498 228 F N -3.319 116.596 119.950 -0.057 0.000 2.802 228 F HA 0.268 4.987 4.527 0.013 -0.184 0.300 228 F C 1.023 176.774 175.800 -0.082 0.000 1.168 228 F CA -1.282 56.693 58.000 -0.041 0.000 1.433 228 F CB -2.193 36.771 39.000 -0.061 0.000 1.115 228 F HN -0.443 7.488 8.300 -0.588 0.016 0.582 229 M N 0.990 120.440 119.600 -0.251 0.000 2.296 229 M HA -0.398 4.055 4.480 -0.045 0.000 0.265 229 M C 0.078 176.304 176.300 -0.124 0.000 1.064 229 M CA 4.189 59.395 55.300 -0.156 0.000 1.109 229 M CB -0.112 32.331 32.600 -0.261 0.000 1.396 229 M HN -0.215 7.637 8.290 -0.472 0.154 0.430 230 C N -6.728 112.441 119.300 -0.218 0.000 3.392 230 C HA 0.506 5.051 4.460 -0.203 -0.207 0.301 230 C C -1.002 173.774 174.990 -0.356 0.000 1.354 230 C CA -1.419 57.401 59.018 -0.331 0.000 1.732 230 C CB 1.045 28.473 27.740 -0.520 0.000 2.269 230 C HN -0.800 7.256 8.230 -0.253 0.022 0.673 231 H N -0.991 118.094 119.070 0.024 0.000 2.744 231 H HA 0.495 5.214 4.556 0.007 -0.158 0.339 231 H C -1.559 173.797 175.328 0.047 0.000 1.004 231 H CA -1.787 54.272 56.048 0.018 0.000 1.257 231 H CB 1.671 31.430 29.762 -0.006 0.000 1.552 231 H HN -0.608 7.678 8.280 0.010 0.000 0.522 232 D N 4.048 124.536 120.400 0.147 0.000 2.417 232 D HA 0.120 4.819 4.640 0.099 0.000 0.250 232 D C -0.321 176.011 176.300 0.053 0.000 1.166 232 D CA -0.875 53.186 54.000 0.101 0.000 0.881 232 D CB 2.342 43.214 40.800 0.120 0.000 1.164 232 D HN 0.115 8.566 8.370 0.135 0.000 0.467 233 P HA -0.011 4.483 4.420 0.122 0.000 0.225 233 P C -0.115 177.190 177.300 0.008 0.000 1.156 233 P CA 1.456 64.516 63.100 -0.067 0.000 0.787 233 P CB 0.309 31.823 31.700 -0.311 0.000 0.802 234 H N -2.830 116.392 119.070 0.253 0.000 2.370 234 H HA -0.025 4.802 4.556 0.452 0.000 0.304 234 H C 2.083 177.539 175.328 0.213 0.000 1.055 234 H CA 3.509 59.751 56.048 0.323 0.000 1.373 234 H CB 1.086 31.018 29.762 0.284 0.000 1.423 234 H HN -0.118 8.318 8.280 -0.111 -0.223 0.533 235 S N -2.361 113.462 115.700 0.204 0.000 2.501 235 S HA 0.187 4.814 4.470 0.063 -0.119 0.220 235 S C 0.320 174.861 174.600 -0.098 0.000 0.997 235 S CA 0.768 59.007 58.200 0.064 0.000 0.919 235 S CB 0.719 63.965 63.200 0.078 0.000 0.778 235 S HN -0.248 8.487 8.310 0.210 -0.299 0.523 236 A N 1.042 123.744 122.820 -0.197 0.000 3.153 236 A HA -0.335 3.887 4.320 -0.371 -0.125 0.265 236 A C -0.039 177.463 177.584 -0.137 0.000 1.212 236 A CA 1.022 52.831 52.037 -0.381 0.000 1.018 236 A CB -1.721 16.783 19.000 -0.827 0.000 1.130 236 A HN -0.035 8.053 8.150 -0.104 0.000 0.873 237 G N -1.330 107.454 108.800 -0.025 0.000 2.562 237 G HA2 0.241 4.213 3.960 0.022 0.000 0.275 237 G HA3 0.241 4.222 3.960 0.036 0.000 0.275 237 G C -2.845 172.113 174.900 0.097 0.000 1.196 237 G CA -2.198 42.923 45.100 0.034 0.000 0.908 237 G HN -0.462 7.765 8.290 -0.009 0.058 0.524 238 P HA 0.391 5.048 4.420 0.125 -0.162 0.276 238 P C -1.156 176.186 177.300 0.069 0.000 1.230 238 P CA -0.490 62.670 63.100 0.099 0.000 0.776 238 P CB 0.775 32.528 31.700 0.088 0.000 0.888 239 R N -2.298 118.227 120.500 0.041 0.000 2.747 239 R HA 0.708 5.201 4.340 0.053 -0.122 0.272 239 R C -2.135 174.174 176.300 0.014 0.000 1.032 239 R CA -1.498 54.629 56.100 0.045 0.000 0.896 239 R CB 3.767 34.111 30.300 0.073 0.000 1.253 239 R HN -0.022 8.254 8.270 0.009 0.000 0.461 240 V N -6.984 112.945 119.914 0.025 0.000 2.864 240 V HA 0.862 5.203 4.120 -0.009 -0.227 0.314 240 V C -0.455 175.655 176.094 0.027 0.000 1.073 240 V CA -2.869 59.436 62.300 0.008 0.000 0.956 240 V CB 3.666 35.488 31.823 -0.001 0.000 1.023 240 V HN 0.167 8.380 8.190 0.037 0.000 0.435 241 V N -4.645 115.278 119.914 0.015 0.000 3.556 241 V HA 0.534 4.690 4.120 0.059 0.000 0.287 241 V C -0.145 175.953 176.094 0.007 0.000 1.422 241 V CA -0.775 61.545 62.300 0.034 0.000 1.038 241 V CB 0.985 32.840 31.823 0.052 0.000 0.850 241 V HN 0.364 8.887 8.190 -0.005 -0.337 0.437 242 R N 3.131 123.606 120.500 -0.041 0.000 2.351 242 R HA -0.043 4.249 4.340 -0.080 0.000 0.318 242 R C 0.612 176.813 176.300 -0.165 0.000 1.055 242 R CA -0.948 55.094 56.100 -0.098 0.000 0.968 242 R CB -0.037 30.203 30.300 -0.100 0.000 0.974 242 R HN -0.765 7.661 8.270 -0.043 -0.181 0.439 243 D N 8.004 128.327 120.400 -0.128 0.000 2.116 243 D HA -0.270 4.369 4.640 -0.003 0.000 0.193 243 D C 1.776 177.803 176.300 -0.456 0.000 0.998 243 D CA 3.395 57.270 54.000 -0.208 0.000 0.836 243 D CB -0.895 39.746 40.800 -0.266 0.000 0.951 243 D HN 0.212 8.540 8.370 -0.069 0.000 0.449 244 G N -1.004 107.396 108.800 -0.666 0.000 2.450 244 G HA2 -0.276 3.269 3.960 -0.692 0.000 0.220 244 G HA3 -0.276 2.813 3.960 -1.452 0.000 0.220 244 G C 1.239 175.375 174.900 -1.273 0.000 1.130 244 G CA 1.713 46.179 45.100 -1.057 0.000 0.760 244 G HN 0.246 8.186 8.290 -0.583 0.000 0.557 245 L N 1.989 122.478 121.223 -1.224 0.000 2.044 245 L HA -0.175 3.739 4.340 -0.711 0.000 0.205 245 L C 1.482 178.082 176.870 -0.451 0.000 1.075 245 L CA 2.300 56.707 54.840 -0.720 0.000 0.747 245 L CB -0.025 41.821 42.059 -0.355 0.000 0.903 245 L HN -0.881 6.671 8.230 -1.103 0.016 0.435 246 I N -0.593 119.816 120.570 -0.269 0.000 2.208 246 I HA -0.560 3.549 4.170 -0.102 0.000 0.245 246 I C 2.219 178.299 176.117 -0.061 0.000 1.097 246 I CA 4.388 65.634 61.300 -0.090 0.000 1.363 246 I CB -0.592 37.454 38.000 0.077 0.000 1.051 246 I HN -0.546 7.509 8.210 -0.258 0.000 0.413 247 N N -0.222 118.420 118.700 -0.097 0.000 2.120 247 N HA -0.395 4.571 4.740 0.080 -0.179 0.188 247 N C 1.549 176.994 175.510 -0.109 0.000 1.024 247 N CA 3.703 56.719 53.050 -0.057 0.000 0.852 247 N CB 0.424 38.811 38.487 -0.166 0.000 1.003 247 N HN -0.146 8.111 8.380 -0.193 0.006 0.424 248 A N 0.224 122.902 122.820 -0.236 0.000 1.873 248 A HA -0.261 4.005 4.320 -0.090 0.000 0.215 248 A C 1.883 179.358 177.584 -0.182 0.000 1.186 248 A CA 3.267 55.175 52.037 -0.214 0.000 0.616 248 A CB -0.195 18.584 19.000 -0.368 0.000 0.823 248 A HN -0.576 7.372 8.150 -0.337 0.000 0.442 249 V N -2.066 117.671 119.914 -0.296 0.000 2.307 249 V HA -0.332 3.759 4.120 -0.048 0.000 0.245 249 V C 2.358 178.442 176.094 -0.017 0.000 1.045 249 V CA 4.491 66.709 62.300 -0.136 0.000 1.024 249 V CB -0.487 31.244 31.823 -0.154 0.000 0.651 249 V HN -0.319 7.645 8.190 -0.377 0.000 0.449 250 V N -1.013 118.883 119.914 -0.030 0.000 2.484 250 V HA -0.316 3.813 4.120 0.015 0.000 0.236 250 V C 2.577 178.680 176.094 0.016 0.000 1.062 250 V CA 3.830 66.132 62.300 0.003 0.000 1.081 250 V CB -0.165 31.655 31.823 -0.005 0.000 0.751 250 V HN 0.116 8.271 8.190 -0.057 0.000 0.484 251 D N 1.565 121.979 120.400 0.024 0.000 2.123 251 D HA -0.180 4.481 4.640 0.034 0.000 0.196 251 D C 1.993 178.319 176.300 0.042 0.000 0.992 251 D CA 3.090 57.115 54.000 0.042 0.000 0.833 251 D CB -0.321 40.526 40.800 0.079 0.000 0.954 251 D HN -0.518 7.867 8.370 0.025 0.000 0.455 252 R N -3.986 116.540 120.500 0.043 0.000 2.310 252 R HA 0.100 4.477 4.340 0.062 0.000 0.202 252 R C 0.392 176.733 176.300 0.068 0.000 0.933 252 R CA -0.241 55.895 56.100 0.061 0.000 1.054 252 R CB 0.236 30.582 30.300 0.078 0.000 0.985 252 R HN -0.484 7.804 8.270 0.030 0.000 0.489 253 G N -1.417 107.418 108.800 0.057 0.000 2.203 253 G HA2 -0.315 3.677 3.960 0.053 0.000 0.263 253 G HA3 -0.315 3.678 3.960 0.054 0.000 0.263 253 G C 0.401 175.350 174.900 0.082 0.000 1.012 253 G CA 1.026 46.162 45.100 0.060 0.000 0.749 253 G HN -0.421 7.718 8.290 0.046 0.179 0.512 254 L N -1.306 119.989 121.223 0.121 0.000 2.313 254 L HA -0.176 4.238 4.340 0.124 0.000 0.214 254 L C 0.009 176.987 176.870 0.179 0.000 1.119 254 L CA 0.458 55.403 54.840 0.175 0.000 0.809 254 L CB 0.058 42.320 42.059 0.339 0.000 0.933 254 L HN -0.793 7.483 8.230 0.117 0.025 0.449 255 G N -5.080 103.828 108.800 0.180 0.000 2.781 255 G HA2 -0.377 3.674 3.960 0.151 0.000 0.683 255 G HA3 -0.377 3.673 3.960 0.149 0.000 0.683 255 G C 0.047 175.140 174.900 0.321 0.000 1.390 255 G CA -0.445 44.767 45.100 0.185 0.000 0.850 255 G HN -0.608 7.771 8.290 0.148 0.000 0.557 256 T N -3.478 111.242 114.554 0.277 0.000 2.951 256 T HA -0.257 4.347 4.350 0.423 0.000 0.268 256 T C -0.259 174.428 174.700 -0.022 0.000 1.073 256 T CA 2.061 64.332 62.100 0.285 0.000 1.134 256 T CB 0.261 69.286 68.868 0.262 0.000 0.884 256 T HN 0.402 8.789 8.240 0.245 0.000 0.479 257 Y N -0.239 120.085 120.300 0.041 0.000 2.681 257 Y HA 0.418 4.645 4.550 -0.539 0.000 0.347 257 Y C -1.941 173.721 175.900 -0.396 0.000 1.029 257 Y CA -2.801 55.132 58.100 -0.280 0.000 1.279 257 Y CB 0.068 38.452 38.460 -0.127 0.000 1.096 257 Y HN -0.534 7.880 8.280 0.256 0.020 0.580 258 P HA -0.008 4.417 4.420 -0.265 -0.165 0.221 258 P C -0.437 176.543 177.300 -0.535 0.000 1.145 258 P CA 1.104 63.898 63.100 -0.510 0.000 0.795 258 P CB 0.435 31.714 31.700 -0.702 0.000 0.775 259 H N -5.397 113.481 119.070 -0.320 0.000 2.539 259 H HA 0.145 4.639 4.556 -0.102 0.000 0.269 259 H C -0.682 174.598 175.328 -0.079 0.000 0.980 259 H CA 0.327 56.285 56.048 -0.149 0.000 1.152 259 H CB 0.119 29.806 29.762 -0.125 0.000 1.407 259 H HN -0.230 7.767 8.280 -0.417 0.032 0.564 260 D N -0.321 120.078 120.400 -0.002 0.000 2.330 260 D HA 0.417 5.060 4.640 0.006 0.000 0.249 260 D C -1.956 174.348 176.300 0.007 0.000 1.306 260 D CA -2.644 51.359 54.000 0.006 0.000 0.956 260 D CB 1.287 42.079 40.800 -0.014 0.000 1.261 260 D HN -0.400 7.792 8.370 -0.034 0.158 0.544 261 P HA -0.066 4.368 4.420 0.024 0.000 0.220 261 P C 0.904 178.213 177.300 0.014 0.000 1.148 261 P CA 1.728 64.835 63.100 0.013 0.000 0.803 261 P CB 0.631 32.335 31.700 0.007 0.000 0.782 262 V N -0.627 119.284 119.914 -0.004 0.000 2.307 262 V HA -0.375 3.744 4.120 -0.002 0.000 0.245 262 V C 2.003 178.082 176.094 -0.024 0.000 1.045 262 V CA 4.653 66.946 62.300 -0.012 0.000 1.024 262 V CB -0.669 31.142 31.823 -0.021 0.000 0.651 262 V HN -0.344 7.943 8.190 -0.009 -0.102 0.449 263 K N -0.630 119.730 120.400 -0.068 0.000 2.097 263 K HA -0.358 3.879 4.320 -0.138 0.000 0.205 263 K C 2.356 178.939 176.600 -0.030 0.000 1.050 263 K CA 3.446 59.642 56.287 -0.152 0.000 0.938 263 K CB -0.231 32.035 32.500 -0.390 0.000 0.718 263 K HN -0.407 8.077 8.250 -0.073 -0.277 0.442 264 S N -0.263 115.491 115.700 0.090 0.000 2.383 264 S HA -0.199 4.478 4.470 0.345 0.000 0.229 264 S C 1.546 176.224 174.600 0.131 0.000 1.030 264 S CA 3.310 61.630 58.200 0.200 0.000 1.002 264 S CB -0.632 62.664 63.200 0.160 0.000 0.829 264 S HN -0.286 8.063 8.310 0.066 0.000 0.467 265 E N 0.029 120.273 120.200 0.073 0.000 2.107 265 E HA -0.295 4.092 4.350 0.062 0.000 0.191 265 E C 2.546 179.177 176.600 0.052 0.000 0.982 265 E CA 2.366 58.799 56.400 0.055 0.000 0.809 265 E CB -0.192 29.529 29.700 0.034 0.000 0.756 265 E HN -0.592 7.711 8.360 0.054 0.089 0.459 266 Q N -1.689 118.133 119.800 0.038 0.000 2.187 266 Q HA -0.161 4.197 4.340 0.030 0.000 0.199 266 Q C 1.560 177.595 176.000 0.058 0.000 0.957 266 Q CA 1.894 57.715 55.803 0.031 0.000 0.857 266 Q CB 0.816 29.556 28.738 0.002 0.000 0.929 266 Q HN -0.578 7.707 8.270 0.025 0.000 0.453 267 Q N -2.135 117.720 119.800 0.093 0.000 2.628 267 Q HA 0.225 4.645 4.340 0.133 0.000 0.397 267 Q C -0.647 175.481 176.000 0.214 0.000 0.916 267 Q CA -1.231 54.668 55.803 0.159 0.000 1.071 267 Q CB 0.812 29.669 28.738 0.199 0.000 1.367 267 Q HN -0.398 7.929 8.270 0.095 0.000 0.404 268 G N -0.759 108.129 108.800 0.147 0.000 2.568 268 G HA2 0.262 4.355 3.960 0.164 0.000 0.293 268 G HA3 0.262 4.287 3.960 0.109 0.000 0.293 268 G C -2.736 172.230 174.900 0.109 0.000 1.347 268 G CA -1.790 43.390 45.100 0.135 0.000 1.039 268 G HN -0.111 8.522 8.290 0.116 -0.273 0.523 269 M N -1.298 118.353 119.600 0.084 0.000 2.386 269 M HA 0.737 5.441 4.480 0.064 -0.185 0.293 269 M C -1.217 175.106 176.300 0.039 0.000 1.120 269 M CA -0.617 54.720 55.300 0.061 0.000 0.909 269 M CB 4.200 36.831 32.600 0.052 0.000 1.661 269 M HN 0.108 8.446 8.290 0.080 0.000 0.452 270 T N 7.148 121.720 114.554 0.031 0.000 2.772 270 T HA 0.393 4.748 4.350 0.008 0.000 0.288 270 T C -1.470 173.230 174.700 -0.001 0.000 0.994 270 T CA -0.578 61.529 62.100 0.012 0.000 0.951 270 T CB 0.961 69.836 68.868 0.011 0.000 0.933 270 T HN 0.513 8.775 8.240 0.036 0.000 0.447 271 K N 7.661 128.048 120.400 -0.022 0.000 2.339 271 K HA 0.201 4.690 4.320 -0.029 -0.186 0.286 271 K C -0.745 175.810 176.600 -0.075 0.000 1.050 271 K CA 0.245 56.503 56.287 -0.047 0.000 0.956 271 K CB 0.754 33.208 32.500 -0.077 0.000 0.990 271 K HN 0.287 8.523 8.250 -0.023 0.000 0.475 272 V N 8.944 128.812 119.914 -0.076 0.000 2.448 272 V HA 0.262 4.266 4.120 -0.194 0.000 0.295 272 V C -1.230 174.720 176.094 -0.240 0.000 1.025 272 V CA -0.705 61.493 62.300 -0.170 0.000 0.859 272 V CB 2.506 34.240 31.823 -0.148 0.000 0.988 272 V HN 0.374 8.545 8.190 -0.032 0.000 0.431 273 T N 7.746 122.096 114.554 -0.339 0.000 2.895 273 T HA 0.684 5.129 4.350 -0.109 -0.160 0.283 273 T C -0.784 173.649 174.700 -0.446 0.000 1.014 273 T CA -0.532 61.418 62.100 -0.250 0.000 1.037 273 T CB 1.419 70.189 68.868 -0.163 0.000 1.006 273 T HN 0.096 8.137 8.240 -0.331 0.000 0.468 274 F N 3.432 123.399 119.950 0.028 0.000 2.495 274 F HA 0.332 4.899 4.527 0.067 0.000 0.327 274 F C -0.970 174.909 175.800 0.130 0.000 1.103 274 F CA -1.644 56.405 58.000 0.081 0.000 0.949 274 F CB 3.665 42.731 39.000 0.110 0.000 1.142 274 F HN 0.426 8.907 8.300 0.302 0.000 0.457 275 Q N 1.716 121.670 119.800 0.257 0.000 2.215 275 Q HA 0.493 5.114 4.340 0.229 -0.143 0.256 275 Q C -0.204 175.895 176.000 0.165 0.000 0.972 275 Q CA -0.816 55.107 55.803 0.199 0.000 0.889 275 Q CB 2.828 31.632 28.738 0.111 0.000 1.281 275 Q HN 0.236 8.642 8.270 0.226 0.000 0.456 276 R N 0.174 120.743 120.500 0.115 0.000 2.409 276 R HA 0.315 4.644 4.340 -0.019 0.000 0.313 276 R C 0.294 176.616 176.300 0.037 0.000 0.953 276 R CA -1.284 54.813 56.100 -0.006 0.000 0.849 276 R CB 0.922 31.089 30.300 -0.221 0.000 1.171 276 R HN 0.497 8.869 8.270 0.169 0.000 0.458 277 G N 6.831 115.641 108.800 0.016 0.000 2.611 277 G HA2 -0.431 3.535 3.960 0.009 0.000 0.301 277 G HA3 -0.431 3.536 3.960 0.011 0.000 0.301 277 G C -0.363 174.555 174.900 0.030 0.000 1.233 277 G CA 1.230 46.340 45.100 0.017 0.000 0.993 277 G HN 0.207 8.501 8.290 0.006 0.000 0.553 278 R N 4.032 124.548 120.500 0.025 0.000 2.310 278 R HA -0.030 4.324 4.340 0.022 0.000 0.202 278 R C -0.210 176.117 176.300 0.045 0.000 0.933 278 R CA 0.078 56.193 56.100 0.025 0.000 1.054 278 R CB 0.165 30.470 30.300 0.009 0.000 0.985 278 R HN 0.291 8.572 8.270 0.018 0.000 0.489 279 E N -0.457 119.791 120.200 0.080 0.000 2.183 279 E HA 0.246 4.646 4.350 0.082 0.000 0.271 279 E C -1.267 175.458 176.600 0.207 0.000 0.919 279 E CA -2.207 54.264 56.400 0.119 0.000 0.781 279 E CB 1.931 31.692 29.700 0.103 0.000 1.140 279 E HN -0.544 7.810 8.360 0.089 0.060 0.402 280 D N 3.255 123.762 120.400 0.178 0.000 2.506 280 D HA -0.210 4.529 4.640 0.164 0.000 0.234 280 D C -1.130 175.384 176.300 0.357 0.000 1.143 280 D CA 1.882 55.996 54.000 0.190 0.000 0.871 280 D CB 0.162 41.016 40.800 0.089 0.000 1.190 280 D HN 0.404 8.849 8.370 0.126 0.000 0.459 281 F N 4.680 124.679 119.950 0.082 0.000 2.347 281 F HA 0.214 4.604 4.527 -0.228 0.000 0.266 281 F C -2.081 173.714 175.800 -0.008 0.000 0.884 281 F CA 0.143 58.092 58.000 -0.086 0.000 1.123 281 F CB 3.454 42.358 39.000 -0.160 0.000 1.098 281 F HN 0.262 8.738 8.300 0.293 0.000 0.803 282 R N -3.669 116.776 120.500 -0.092 0.000 2.888 282 R HA 0.378 4.615 4.340 -0.171 0.000 0.264 282 R C -2.864 173.501 176.300 0.108 0.000 1.045 282 R CA -1.807 54.217 56.100 -0.126 0.000 0.962 282 R CB 3.169 33.337 30.300 -0.221 0.000 1.210 282 R HN -0.614 7.771 8.270 0.191 0.000 0.479 283 A N -1.317 121.577 122.820 0.123 0.000 2.587 283 A HA 1.086 5.711 4.320 0.223 -0.172 0.293 283 A C -2.083 175.613 177.584 0.187 0.000 1.087 283 A CA -1.297 50.809 52.037 0.114 0.000 0.692 283 A CB 3.390 22.240 19.000 -0.250 0.000 1.291 283 A HN 0.212 8.450 8.150 0.148 0.000 0.407 284 I N -6.198 114.495 120.570 0.205 0.000 3.145 284 I HA 0.581 4.830 4.170 0.131 0.000 0.313 284 I C -2.054 174.120 176.117 0.095 0.000 1.122 284 I CA -2.730 58.668 61.300 0.164 0.000 0.987 284 I CB 3.785 41.921 38.000 0.226 0.000 1.236 284 I HN 0.311 8.647 8.210 0.209 0.000 0.453 285 G N 0.140 108.983 108.800 0.072 0.000 2.660 285 G HA2 0.574 4.729 3.960 0.035 0.000 0.305 285 G HA3 0.574 4.553 3.960 0.032 0.000 0.305 285 G C -1.906 173.028 174.900 0.056 0.000 1.329 285 G CA -0.999 44.128 45.100 0.046 0.000 1.000 285 G HN 0.293 8.627 8.290 0.072 0.000 0.514 286 L N 6.765 128.022 121.223 0.058 0.000 2.360 286 L HA 0.089 4.471 4.340 0.071 0.000 0.276 286 L C -0.435 176.470 176.870 0.059 0.000 1.121 286 L CA -0.050 54.828 54.840 0.063 0.000 0.845 286 L CB 0.492 42.588 42.059 0.061 0.000 1.143 286 L HN 0.355 8.615 8.230 0.050 0.000 0.452 287 L N 3.432 124.694 121.223 0.066 0.000 2.350 287 L HA 0.042 4.583 4.340 0.079 -0.154 0.275 287 L C 0.105 177.019 176.870 0.072 0.000 1.099 287 L CA -0.008 54.878 54.840 0.075 0.000 0.808 287 L CB 0.575 42.684 42.059 0.083 0.000 1.149 287 L HN -0.062 8.208 8.230 0.066 0.000 0.442 288 D N 1.047 121.494 120.400 0.078 0.000 2.178 288 D HA -0.155 4.519 4.640 0.058 0.000 0.201 288 D C 0.084 176.425 176.300 0.068 0.000 0.980 288 D CA 2.445 56.486 54.000 0.068 0.000 0.842 288 D CB 0.540 41.382 40.800 0.071 0.000 0.948 288 D HN 0.176 8.599 8.370 0.088 0.000 0.472 289 T N -6.708 107.896 114.554 0.084 0.000 2.865 289 T HA 0.241 4.632 4.350 0.069 0.000 0.294 289 T C -1.379 173.374 174.700 0.089 0.000 1.119 289 T CA -2.300 59.848 62.100 0.081 0.000 1.007 289 T CB 3.136 72.056 68.868 0.086 0.000 1.225 289 T HN -0.801 7.477 8.240 0.096 0.021 0.515 290 A N 1.352 124.222 122.820 0.084 0.000 3.037 290 A HA 0.047 4.418 4.320 0.084 0.000 0.272 290 A C -0.766 176.874 177.584 0.092 0.000 1.723 290 A CA -0.438 51.650 52.037 0.085 0.000 1.413 290 A CB -0.687 18.363 19.000 0.084 0.000 1.112 290 A HN 0.256 8.452 8.150 0.077 0.000 0.606 291 D N 2.819 123.287 120.400 0.113 0.000 2.441 291 D HA 0.073 4.806 4.640 0.155 0.000 0.221 291 D C 0.709 177.089 176.300 0.133 0.000 1.156 291 D CA -1.050 53.042 54.000 0.153 0.000 0.896 291 D CB 0.956 41.888 40.800 0.220 0.000 1.028 291 D HN -0.621 7.789 8.370 0.112 0.027 0.509 292 S N 7.101 122.863 115.700 0.105 0.000 2.419 292 S HA -0.352 4.141 4.470 0.038 0.000 0.235 292 S C 1.667 176.322 174.600 0.092 0.000 1.019 292 S CA 2.761 61.000 58.200 0.065 0.000 0.982 292 S CB -0.387 62.828 63.200 0.025 0.000 0.789 292 S HN 0.287 8.659 8.310 0.102 0.000 0.490 293 N N 2.876 121.679 118.700 0.171 0.000 2.104 293 N HA -0.222 4.601 4.740 0.139 0.000 0.190 293 N C 2.204 177.837 175.510 0.205 0.000 1.024 293 N CA 2.850 56.026 53.050 0.211 0.000 0.853 293 N CB -0.431 38.289 38.487 0.390 0.000 1.008 293 N HN -0.370 8.314 8.380 0.214 -0.176 0.424 294 V N 0.204 120.241 119.914 0.205 0.000 2.535 294 V HA -0.295 3.990 4.120 0.275 0.000 0.246 294 V C 1.451 177.624 176.094 0.132 0.000 1.045 294 V CA 2.842 65.264 62.300 0.203 0.000 1.058 294 V CB -0.508 31.427 31.823 0.186 0.000 0.689 294 V HN -0.732 7.578 8.190 0.208 0.005 0.461 295 M N -0.947 118.702 119.600 0.083 0.000 2.080 295 M HA -0.517 3.971 4.480 0.013 0.000 0.260 295 M C 2.717 179.037 176.300 0.033 0.000 1.068 295 M CA 4.432 59.747 55.300 0.025 0.000 1.109 295 M CB -0.142 32.441 32.600 -0.029 0.000 1.342 295 M HN -0.612 7.729 8.290 0.086 0.000 0.405 296 C N -2.716 116.612 119.300 0.047 0.000 2.446 296 C HA -0.198 4.296 4.460 0.057 0.000 0.279 296 C C 1.698 176.767 174.990 0.132 0.000 1.366 296 C CA 2.629 61.683 59.018 0.060 0.000 1.763 296 C CB -2.260 25.467 27.740 -0.021 0.000 1.929 296 C HN -0.066 8.193 8.230 0.048 0.000 0.509 297 A N -1.922 120.999 122.820 0.169 0.000 2.239 297 A HA -0.229 4.231 4.320 0.233 0.000 0.209 297 A C 0.422 178.158 177.584 0.254 0.000 1.171 297 A CA 1.213 53.405 52.037 0.258 0.000 0.768 297 A CB -1.008 18.275 19.000 0.472 0.000 0.790 297 A HN -0.501 7.729 8.150 0.169 0.021 0.478 298 Q N -3.444 116.457 119.800 0.167 0.000 2.170 298 Q HA -0.326 4.164 4.340 0.250 0.000 0.203 298 Q C 0.088 176.190 176.000 0.170 0.000 0.976 298 Q CA 2.699 58.605 55.803 0.172 0.000 0.858 298 Q CB 0.455 29.217 28.738 0.040 0.000 0.907 298 Q HN -0.482 7.813 8.270 0.120 0.047 0.433 299 C N -7.261 112.050 119.300 0.018 0.000 3.276 299 C HA 0.283 4.636 4.460 -0.179 0.000 0.512 299 C C 0.769 175.565 174.990 -0.323 0.000 1.376 299 C CA -0.359 58.546 59.018 -0.188 0.000 2.319 299 C CB 2.591 30.149 27.740 -0.304 0.000 3.330 299 C HN -0.684 7.552 8.230 0.046 0.022 0.596 300 H N 3.769 122.755 119.070 -0.139 0.000 2.768 300 H HA 0.149 4.561 4.556 -0.240 0.000 0.219 300 H C -1.670 173.640 175.328 -0.031 0.000 1.898 300 H CA 0.772 56.740 56.048 -0.133 0.000 1.313 300 H CB -2.223 27.466 29.762 -0.122 0.000 1.701 300 H HN -0.211 8.124 8.280 0.091 0.000 0.534 301 V N -6.149 113.803 119.914 0.063 0.000 3.159 301 V HA 0.611 4.902 4.120 -0.049 -0.201 0.308 301 V C -1.512 174.578 176.094 -0.007 0.000 1.190 301 V CA -3.796 58.486 62.300 -0.030 0.000 1.037 301 V CB 3.721 35.430 31.823 -0.190 0.000 1.060 301 V HN -0.652 7.511 8.190 0.061 0.063 0.437 302 E N 2.902 123.019 120.200 -0.139 0.000 2.313 302 E HA 0.244 4.572 4.350 -0.248 -0.126 0.276 302 E C -1.232 175.465 176.600 0.162 0.000 1.031 302 E CA -0.994 55.314 56.400 -0.153 0.000 0.857 302 E CB 1.696 31.160 29.700 -0.394 0.000 1.040 302 E HN -0.131 8.537 8.360 -0.165 -0.407 0.408 303 Y N 2.159 122.509 120.300 0.083 0.000 2.638 303 Y HA 0.748 5.592 4.550 0.258 -0.139 0.335 303 Y C -1.968 174.135 175.900 0.339 0.000 1.155 303 Y CA -2.258 55.949 58.100 0.179 0.000 1.046 303 Y CB 2.661 41.084 38.460 -0.063 0.000 1.303 303 Y HN -0.445 7.684 8.280 -0.252 0.000 0.460 304 N N 0.672 119.532 118.700 0.267 0.000 2.430 304 N HA 0.359 5.238 4.740 0.030 -0.121 0.292 304 N C -1.096 174.649 175.510 0.392 0.000 1.051 304 N CA -1.273 51.857 53.050 0.133 0.000 0.917 304 N CB 2.783 41.192 38.487 -0.129 0.000 1.164 304 N HN 0.190 8.742 8.380 0.287 0.000 0.484 305 C N -0.636 118.902 119.300 0.398 0.000 3.181 305 C HA 0.624 5.477 4.460 0.358 -0.178 0.216 305 C C -2.022 173.160 174.990 0.320 0.000 1.834 305 C CA -2.900 56.391 59.018 0.454 0.000 1.208 305 C CB -0.012 28.123 27.740 0.660 0.000 2.103 305 C HN 0.528 8.916 8.230 0.263 0.000 0.579 306 N N -1.552 117.291 118.700 0.238 0.000 3.521 306 N HA 0.231 5.076 4.740 0.175 0.000 0.228 306 N C -3.639 171.989 175.510 0.196 0.000 1.328 306 N CA -0.632 52.540 53.050 0.203 0.000 0.907 306 N CB -0.425 38.194 38.487 0.219 0.000 1.487 306 N HN -0.617 7.891 8.380 0.213 0.000 0.503 307 P HA 0.313 4.885 4.420 0.091 -0.098 0.276 307 P C -0.977 176.310 177.300 -0.022 0.000 1.261 307 P CA -0.587 62.539 63.100 0.043 0.000 0.800 307 P CB 1.001 32.661 31.700 -0.066 0.000 1.066 308 G N -3.325 105.294 108.800 -0.302 0.000 2.677 308 G HA2 0.578 4.094 3.960 -0.739 0.000 0.283 308 G HA3 0.578 4.005 3.960 -1.050 -0.097 0.283 308 G C -2.549 171.573 174.900 -1.297 0.000 1.221 308 G CA 0.655 45.261 45.100 -0.824 0.000 0.851 308 G HN 0.020 8.135 8.290 -0.291 0.000 0.504 309 Y N -3.587 116.084 120.300 -1.047 0.000 2.588 309 Y HA 0.619 5.046 4.550 -0.502 -0.178 0.343 309 Y C -1.215 174.244 175.900 -0.735 0.000 1.065 309 Y CA -1.379 56.204 58.100 -0.862 0.000 1.038 309 Y CB 4.706 42.476 38.460 -1.151 0.000 1.297 309 Y HN 0.133 7.547 8.280 -1.444 0.000 0.467 310 Q N -0.602 119.132 119.800 -0.110 0.000 2.261 310 Q HA 0.435 5.023 4.340 0.052 -0.217 0.252 310 Q C 1.187 177.359 176.000 0.286 0.000 0.915 310 Q CA -0.918 54.924 55.803 0.065 0.000 0.915 310 Q CB 1.307 30.096 28.738 0.085 0.000 1.204 310 Q HN 0.292 8.552 8.270 -0.017 0.000 0.421 311 L N 3.498 124.922 121.223 0.335 0.000 2.083 311 L HA -0.402 4.166 4.340 0.380 0.000 0.209 311 L C 1.116 178.073 176.870 0.144 0.000 1.083 311 L CA 2.682 57.695 54.840 0.289 0.000 0.752 311 L CB -0.184 41.974 42.059 0.165 0.000 0.899 311 L HN 0.485 8.963 8.230 0.279 -0.080 0.433 312 S N -1.402 114.370 115.700 0.120 0.000 2.348 312 S HA -0.196 4.307 4.470 0.054 0.000 0.221 312 S C 0.757 175.400 174.600 0.072 0.000 1.033 312 S CA 2.436 60.681 58.200 0.074 0.000 1.010 312 S CB -0.032 63.208 63.200 0.065 0.000 0.891 312 S HN -0.164 8.480 8.310 0.129 -0.256 0.442 313 D N -2.392 118.062 120.400 0.091 0.000 2.525 313 D HA -0.008 4.669 4.640 0.063 0.000 0.231 313 D C 0.402 176.762 176.300 0.099 0.000 1.216 313 D CA -0.827 53.220 54.000 0.077 0.000 0.813 313 D CB 0.337 41.173 40.800 0.059 0.000 1.108 313 D HN -0.675 7.759 8.370 0.107 0.000 0.524 314 G N 0.635 109.531 108.800 0.159 0.000 2.189 314 G HA2 -0.375 3.846 3.960 0.291 0.000 0.267 314 G HA3 -0.375 3.670 3.960 0.142 0.000 0.267 314 G C 0.074 175.071 174.900 0.161 0.000 0.975 314 G CA 0.694 45.905 45.100 0.185 0.000 0.644 314 G HN -0.131 8.276 8.290 0.195 0.000 0.537 315 S N -0.059 115.715 115.700 0.124 0.000 2.585 315 S HA -0.054 4.489 4.470 0.122 0.000 0.273 315 S C 0.470 175.134 174.600 0.105 0.000 1.339 315 S CA 0.185 58.451 58.200 0.110 0.000 1.028 315 S CB 1.322 64.561 63.200 0.064 0.000 0.906 315 S HN -0.533 8.058 8.310 0.105 -0.217 0.528 316 R N 0.119 120.663 120.500 0.073 0.000 2.570 316 R HA -0.119 4.184 4.340 -0.289 -0.136 0.277 316 R C 0.211 176.432 176.300 -0.132 0.000 1.039 316 R CA 0.878 56.911 56.100 -0.112 0.000 1.065 316 R CB 0.332 30.582 30.300 -0.084 0.000 0.964 316 R HN 0.230 8.552 8.270 0.087 0.000 0.428 317 V N 4.143 123.918 119.914 -0.232 0.000 2.313 317 V HA 0.166 4.268 4.120 -0.030 0.000 0.278 317 V C -0.845 175.210 176.094 -0.065 0.000 1.017 317 V CA -0.661 61.594 62.300 -0.075 0.000 0.823 317 V CB 0.827 32.683 31.823 0.055 0.000 1.010 317 V HN 0.387 8.216 8.190 -0.416 0.111 0.443 318 G N 4.369 113.149 108.800 -0.033 0.000 2.535 318 G HA2 0.170 4.105 3.960 -0.041 0.000 0.303 318 G HA3 0.170 4.119 3.960 -0.019 0.000 0.303 318 G C 0.641 175.554 174.900 0.021 0.000 1.237 318 G CA -0.974 44.115 45.100 -0.020 0.000 0.986 318 G HN 0.166 8.443 8.290 -0.022 0.000 0.494 319 M N -0.491 119.128 119.600 0.030 0.000 2.279 319 M HA -0.315 4.206 4.480 0.068 0.000 0.264 319 M C 0.865 177.186 176.300 0.036 0.000 1.062 319 M CA 1.632 56.964 55.300 0.053 0.000 1.099 319 M CB -1.202 31.440 32.600 0.069 0.000 1.394 319 M HN 0.410 8.714 8.290 0.024 0.000 0.426 320 D N -5.606 114.806 120.400 0.020 0.000 2.263 320 D HA -0.235 4.406 4.640 0.000 0.000 0.208 320 D C 0.379 176.679 176.300 -0.001 0.000 0.971 320 D CA 1.807 55.810 54.000 0.006 0.000 0.867 320 D CB -0.934 39.868 40.800 0.003 0.000 0.929 320 D HN 0.215 8.579 8.370 0.018 0.017 0.492 321 D N 0.731 121.136 120.400 0.007 0.000 2.304 321 D HA 0.032 4.671 4.640 -0.003 0.000 0.250 321 D C 0.732 177.027 176.300 -0.009 0.000 1.107 321 D CA 0.009 54.011 54.000 0.003 0.000 0.885 321 D CB 2.020 42.830 40.800 0.017 0.000 1.192 321 D HN -0.507 7.732 8.370 0.015 0.140 0.436 322 R N 6.462 126.948 120.500 -0.024 0.000 2.139 322 R HA -0.347 3.971 4.340 -0.037 0.000 0.243 322 R C 2.151 178.416 176.300 -0.058 0.000 1.145 322 R CA 2.179 58.257 56.100 -0.038 0.000 0.976 322 R CB -0.188 30.090 30.300 -0.038 0.000 0.866 322 R HN 0.627 8.883 8.270 -0.022 0.000 0.449 323 R N -2.801 117.640 120.500 -0.099 0.000 2.241 323 R HA -0.275 3.872 4.340 -0.321 0.000 0.224 323 R C 0.718 176.887 176.300 -0.219 0.000 1.101 323 R CA 2.344 58.302 56.100 -0.236 0.000 0.995 323 R CB -0.340 29.813 30.300 -0.245 0.000 0.870 323 R HN -0.284 8.252 8.270 -0.074 -0.310 0.463 324 A N -4.208 118.579 122.820 -0.056 0.000 2.168 324 A HA -0.117 4.344 4.320 0.014 -0.132 0.215 324 A C -1.181 176.453 177.584 0.084 0.000 1.152 324 A CA 0.715 52.769 52.037 0.027 0.000 0.716 324 A CB 0.840 19.889 19.000 0.082 0.000 0.794 324 A HN -0.481 7.616 8.150 -0.023 0.039 0.465 325 N N -2.258 116.485 118.700 0.071 0.000 2.623 325 N HA 0.229 5.240 4.740 0.205 -0.148 0.256 325 N C -1.846 173.737 175.510 0.122 0.000 1.045 325 N CA -0.488 52.643 53.050 0.135 0.000 0.863 325 N CB 0.835 39.397 38.487 0.126 0.000 1.182 325 N HN -0.768 7.590 8.380 0.027 0.038 0.523 326 H N 6.427 125.521 119.070 0.041 0.000 2.947 326 H HA 0.257 4.762 4.556 -0.085 0.000 0.354 326 H C -2.376 173.075 175.328 0.205 0.000 1.085 326 H CA -0.399 55.606 56.048 -0.072 0.000 1.253 326 H CB 3.449 32.956 29.762 -0.424 0.000 1.757 326 H HN -0.001 8.449 8.280 0.284 0.000 0.523 327 F N 6.181 125.825 119.950 -0.510 0.000 2.391 327 F HA 0.214 4.749 4.527 0.013 0.000 0.359 327 F C 0.208 175.744 175.800 -0.439 0.000 1.122 327 F CA -2.857 54.998 58.000 -0.242 0.000 1.120 327 F CB -0.456 38.487 39.000 -0.095 0.000 1.142 327 F HN 0.577 8.758 8.300 -0.199 0.000 0.483 328 F N 3.252 123.283 119.950 0.135 0.000 2.186 328 F HA -0.157 4.468 4.527 0.164 0.000 0.299 328 F C 1.017 177.086 175.800 0.448 0.000 1.090 328 F CA 2.527 60.679 58.000 0.254 0.000 1.307 328 F CB 0.784 40.010 39.000 0.377 0.000 1.019 328 F HN -0.121 8.474 8.300 0.492 0.000 0.489 329 W N -2.766 118.794 121.300 0.434 0.000 5.963 329 W HA -0.402 4.584 4.660 0.544 0.000 0.400 329 W C -2.404 174.503 176.519 0.646 0.000 1.530 329 W CA -0.175 57.479 57.345 0.515 0.000 1.004 329 W CB -1.481 28.216 29.460 0.395 0.000 2.706 329 W HN -0.147 8.503 8.180 0.783 0.000 1.495 330 A N -0.798 122.403 122.820 0.635 0.000 2.422 330 A HA 0.223 4.890 4.320 0.579 0.000 0.302 330 A C -1.753 176.155 177.584 0.541 0.000 1.041 330 A CA -1.240 51.147 52.037 0.583 0.000 0.708 330 A CB 2.885 22.190 19.000 0.509 0.000 1.257 330 A HN -0.585 7.937 8.150 0.620 0.000 0.414 331 N N 2.209 121.208 118.700 0.498 0.000 2.317 331 N HA -0.149 4.727 4.740 0.227 0.000 0.245 331 N C 1.429 176.809 175.510 -0.216 0.000 1.294 331 N CA -0.697 52.483 53.050 0.216 0.000 0.924 331 N CB 0.367 39.005 38.487 0.252 0.000 1.186 331 N HN -0.094 8.646 8.380 0.600 0.000 0.495 332 V N -1.242 118.106 119.914 -0.944 0.000 2.392 332 V HA -0.219 2.643 4.120 -2.098 0.000 0.249 332 V C 1.220 176.997 176.094 -0.529 0.000 1.059 332 V CA 2.457 63.829 62.300 -1.547 0.000 1.051 332 V CB -0.341 30.262 31.823 -2.034 0.000 0.658 332 V HN 0.497 8.162 8.190 -0.876 0.000 0.455 333 F N -3.557 116.371 119.950 -0.037 0.000 2.780 333 F HA -0.019 4.654 4.527 0.244 0.000 0.299 333 F C 1.090 176.990 175.800 0.165 0.000 1.146 333 F CA 0.279 58.355 58.000 0.127 0.000 1.428 333 F CB -0.445 38.591 39.000 0.061 0.000 1.115 333 F HN -0.547 7.735 8.300 -0.249 -0.132 0.583 334 D N -2.465 118.113 120.400 0.296 0.000 2.407 334 D HA 0.125 4.928 4.640 0.271 0.000 0.208 334 D C 0.422 176.885 176.300 0.272 0.000 1.083 334 D CA 0.342 54.512 54.000 0.284 0.000 0.844 334 D CB 0.995 41.977 40.800 0.304 0.000 0.967 334 D HN -0.490 8.017 8.370 0.227 -0.001 0.506 335 Y N 1.976 122.349 120.300 0.121 0.000 2.163 335 Y HA -0.489 4.168 4.550 0.179 0.000 0.288 335 Y C 0.595 176.583 175.900 0.147 0.000 1.136 335 Y CA 4.242 62.411 58.100 0.115 0.000 1.147 335 Y CB 0.191 38.663 38.460 0.020 0.000 0.987 335 Y HN -0.588 7.860 8.280 0.280 0.000 0.509 336 K N -1.211 119.346 120.400 0.261 0.000 2.063 336 K HA -0.460 4.018 4.320 0.263 0.000 0.208 336 K C 1.753 178.404 176.600 0.085 0.000 1.048 336 K CA 3.716 60.131 56.287 0.213 0.000 0.928 336 K CB -0.472 32.190 32.500 0.269 0.000 0.713 336 K HN 0.316 8.766 8.250 0.334 0.000 0.442 337 E N -0.839 119.432 120.200 0.118 0.000 2.077 337 E HA -0.275 4.306 4.350 0.086 -0.180 0.193 337 E C 1.990 178.653 176.600 0.106 0.000 0.989 337 E CA 2.949 59.412 56.400 0.106 0.000 0.800 337 E CB -0.403 29.374 29.700 0.129 0.000 0.746 337 E HN -0.024 8.432 8.360 0.159 0.000 0.452 338 A N -1.315 121.574 122.820 0.115 0.000 1.933 338 A HA -0.251 4.199 4.320 0.217 0.000 0.218 338 A C 1.990 179.702 177.584 0.215 0.000 1.175 338 A CA 2.814 54.968 52.037 0.195 0.000 0.628 338 A CB -0.637 18.545 19.000 0.305 0.000 0.814 338 A HN -0.435 7.705 8.150 0.108 0.075 0.444 339 A N -2.258 120.583 122.820 0.035 0.000 1.929 339 A HA -0.364 4.201 4.320 0.409 0.000 0.216 339 A C 1.953 179.648 177.584 0.185 0.000 1.176 339 A CA 2.456 54.592 52.037 0.164 0.000 0.628 339 A CB -0.354 18.648 19.000 0.003 0.000 0.816 339 A HN -0.139 7.926 8.150 -0.143 0.000 0.444 340 Q N -1.584 118.279 119.800 0.105 0.000 2.124 340 Q HA -0.381 4.012 4.340 0.088 0.000 0.202 340 Q C 3.267 179.324 176.000 0.095 0.000 0.977 340 Q CA 3.151 59.004 55.803 0.084 0.000 0.850 340 Q CB -0.104 28.659 28.738 0.042 0.000 0.901 340 Q HN -0.206 8.108 8.270 0.073 0.000 0.429 341 E N 0.321 120.584 120.200 0.103 0.000 2.118 341 E HA -0.275 4.123 4.350 0.079 0.000 0.195 341 E C 1.448 178.089 176.600 0.068 0.000 0.992 341 E CA 2.718 59.172 56.400 0.091 0.000 0.804 341 E CB -0.027 29.740 29.700 0.112 0.000 0.741 341 E HN -0.210 8.218 8.360 0.114 0.000 0.458 342 I N -10.402 110.207 120.570 0.065 0.000 3.928 342 I HA 0.308 4.471 4.170 -0.011 0.000 0.335 342 I C -1.269 174.913 176.117 0.108 0.000 1.325 342 I CA -1.244 60.060 61.300 0.006 0.000 1.107 342 I CB 0.188 38.057 38.000 -0.219 0.000 1.014 342 I HN -0.926 7.345 8.210 0.101 0.000 0.400 343 D N 0.586 121.077 120.400 0.152 0.000 2.812 343 D HA -0.386 4.352 4.640 0.165 0.000 0.237 343 D C -2.400 174.065 176.300 0.275 0.000 1.162 343 D CA 1.448 55.554 54.000 0.177 0.000 0.740 343 D CB -1.300 39.572 40.800 0.119 0.000 1.000 343 D HN -0.405 7.867 8.370 0.139 0.182 0.416 344 F N 0.638 120.680 119.950 0.153 0.000 2.596 344 F HA 0.679 5.464 4.527 0.109 -0.192 0.311 344 F C -2.880 173.120 175.800 0.333 0.000 1.116 344 F CA -0.859 57.244 58.000 0.172 0.000 0.957 344 F CB 3.636 42.718 39.000 0.137 0.000 1.250 344 F HN -0.730 7.807 8.300 0.395 0.000 0.444 345 F N 0.733 120.482 119.950 -0.336 0.000 2.664 345 F HA 0.444 5.061 4.527 0.150 0.000 0.317 345 F C -2.271 173.300 175.800 -0.382 0.000 1.108 345 F CA -1.802 56.121 58.000 -0.129 0.000 0.957 345 F CB 2.633 41.660 39.000 0.046 0.000 1.365 345 F HN 0.489 8.312 8.300 -0.795 0.000 0.475 346 D N 0.640 121.148 120.400 0.180 0.000 2.269 346 D HA 0.110 4.771 4.640 0.035 0.000 0.220 346 D C -0.445 176.119 176.300 0.439 0.000 0.962 346 D CA 3.955 58.098 54.000 0.238 0.000 0.884 346 D CB 2.426 43.498 40.800 0.453 0.000 1.023 346 D HN -0.115 8.499 8.370 0.407 0.000 0.484 347 F N -4.106 116.044 119.950 0.334 0.000 2.686 347 F HA 0.370 5.082 4.527 0.308 0.000 0.311 347 F C -2.582 173.388 175.800 0.282 0.000 1.128 347 F CA -1.716 56.461 58.000 0.295 0.000 0.946 347 F CB 1.675 40.814 39.000 0.232 0.000 1.336 347 F HN -0.604 7.998 8.300 0.502 0.000 0.457 348 R N 0.786 121.353 120.500 0.111 0.000 2.294 348 R HA 0.404 4.785 4.340 -0.277 -0.208 0.319 348 R C -0.221 176.027 176.300 -0.088 0.000 0.984 348 R CA -1.433 54.593 56.100 -0.122 0.000 0.861 348 R CB 1.206 31.459 30.300 -0.079 0.000 1.104 348 R HN 0.404 8.803 8.270 0.216 0.000 0.451 349 H N 6.014 124.872 119.070 -0.355 0.000 3.001 349 H HA -0.146 4.596 4.556 0.064 -0.148 0.334 349 H C 0.816 176.125 175.328 -0.032 0.000 1.034 349 H CA 1.648 57.612 56.048 -0.139 0.000 1.420 349 H CB 2.137 31.766 29.762 -0.222 0.000 1.405 349 H HN -0.020 8.069 8.280 -0.319 0.000 0.593 350 A N 8.327 130.944 122.820 -0.337 0.000 2.015 350 A HA -0.179 4.100 4.320 -0.069 0.000 0.219 350 A C 0.433 177.989 177.584 -0.046 0.000 1.163 350 A CA 2.770 54.716 52.037 -0.152 0.000 0.646 350 A CB 0.123 19.021 19.000 -0.169 0.000 0.806 350 A HN 0.424 8.098 8.150 -0.615 0.107 0.448 351 T N -2.237 112.361 114.554 0.073 0.000 3.045 351 T HA 0.153 4.548 4.350 0.074 0.000 0.239 351 T C 1.562 176.295 174.700 0.056 0.000 1.008 351 T CA 2.365 64.547 62.100 0.137 0.000 1.143 351 T CB 0.854 69.846 68.868 0.206 0.000 0.894 351 T HN -0.521 7.768 8.240 0.125 0.026 0.451 352 T N -1.775 112.767 114.554 -0.020 0.000 3.054 352 T HA 0.044 3.826 4.350 -0.947 0.000 0.259 352 T C 1.166 175.634 174.700 -0.388 0.000 1.092 352 T CA 1.240 62.899 62.100 -0.734 0.000 1.121 352 T CB 1.110 69.146 68.868 -1.387 0.000 0.912 352 T HN -0.476 7.996 8.240 0.387 0.000 0.489 353 G N 2.545 111.262 108.800 -0.138 0.000 2.189 353 G HA2 -0.484 3.505 3.960 -0.079 0.000 0.267 353 G HA3 -0.484 3.431 3.960 -0.075 0.000 0.267 353 G C -0.971 173.826 174.900 -0.172 0.000 0.975 353 G CA 0.268 45.304 45.100 -0.107 0.000 0.644 353 G HN -0.223 8.041 8.290 -0.043 0.000 0.537 354 A N 0.720 123.393 122.820 -0.245 0.000 2.462 354 A HA 0.018 4.192 4.320 -0.244 0.000 0.243 354 A C -0.876 176.432 177.584 -0.460 0.000 1.076 354 A CA -0.377 51.472 52.037 -0.313 0.000 0.773 354 A CB 0.885 19.676 19.000 -0.349 0.000 1.010 354 A HN -0.629 7.309 8.150 -0.262 0.055 0.493 355 A N 3.535 126.022 122.820 -0.555 0.000 2.492 355 A HA 0.075 3.923 4.320 -0.984 -0.119 0.254 355 A C -0.806 176.398 177.584 -0.633 0.000 1.091 355 A CA 0.361 51.825 52.037 -0.955 0.000 0.768 355 A CB 0.076 18.143 19.000 -1.554 0.000 1.028 355 A HN 0.325 8.185 8.150 -0.483 0.000 0.498 356 L N 3.195 124.038 121.223 -0.633 0.000 2.371 356 L HA 0.560 4.472 4.340 -0.713 0.000 0.262 356 L C -2.652 174.003 176.870 -0.358 0.000 1.006 356 L CA -3.303 51.089 54.840 -0.745 0.000 0.818 356 L CB 3.381 44.623 42.059 -1.360 0.000 1.354 356 L HN 0.258 8.154 8.230 -0.555 0.000 0.415 357 P HA 0.213 4.863 4.420 0.179 -0.123 0.281 357 P C -1.673 175.615 177.300 -0.021 0.000 1.249 357 P CA -1.531 61.543 63.100 -0.044 0.000 0.810 357 P CB 0.842 32.502 31.700 -0.066 0.000 1.008 358 K N 1.949 122.372 120.400 0.037 0.000 2.307 358 K HA 0.166 4.546 4.320 -0.138 -0.143 0.263 358 K C -0.480 175.919 176.600 -0.335 0.000 0.973 358 K CA -1.660 54.515 56.287 -0.187 0.000 0.846 358 K CB 1.537 33.785 32.500 -0.420 0.000 1.100 358 K HN -0.064 8.549 8.250 0.112 -0.296 0.438 359 L N 5.700 126.663 121.223 -0.433 0.000 2.343 359 L HA 0.211 4.342 4.340 -0.630 -0.169 0.275 359 L C 0.225 176.706 176.870 -0.648 0.000 1.056 359 L CA -1.520 52.959 54.840 -0.601 0.000 0.804 359 L CB 0.888 42.551 42.059 -0.659 0.000 1.203 359 L HN 0.188 8.510 8.230 -0.369 -0.313 0.440 360 Q N -0.984 118.382 119.800 -0.723 0.000 2.305 360 Q HA 0.248 4.212 4.340 -0.627 0.000 0.271 360 Q C -1.292 174.161 176.000 -0.912 0.000 1.046 360 Q CA -1.572 53.757 55.803 -0.791 0.000 0.798 360 Q CB 4.022 32.291 28.738 -0.781 0.000 1.286 360 Q HN 0.134 8.167 8.270 -0.748 -0.212 0.435 361 H N -1.419 117.500 119.070 -0.252 0.000 1.799 361 H HA -0.297 4.271 4.556 -0.245 -0.159 0.315 361 H C -1.564 173.578 175.328 -0.310 0.000 0.805 361 H CA -0.771 55.142 56.048 -0.226 0.000 1.047 361 H CB -1.824 27.893 29.762 -0.075 0.000 1.526 361 H HN 0.470 8.499 8.280 -0.419 0.000 0.272 362 P HA 0.320 4.666 4.420 -0.381 -0.154 0.211 362 P C -0.750 176.385 177.300 -0.276 0.000 1.833 362 P CA -0.970 61.803 63.100 -0.546 0.000 0.938 362 P CB -0.536 30.349 31.700 -1.359 0.000 1.808 363 E N 2.690 122.843 120.200 -0.078 0.000 2.077 363 E HA -0.292 4.322 4.350 0.105 -0.202 0.193 363 E C 1.748 178.284 176.600 -0.107 0.000 0.989 363 E CA 3.676 60.078 56.400 0.004 0.000 0.800 363 E CB -0.632 29.091 29.700 0.039 0.000 0.746 363 E HN -0.395 7.907 8.360 -0.004 0.056 0.452 364 A N -1.051 121.671 122.820 -0.163 0.000 1.877 364 A HA -0.359 3.852 4.320 -0.181 0.000 0.216 364 A C 1.896 178.972 177.584 -0.847 0.000 1.186 364 A CA 3.772 55.630 52.037 -0.298 0.000 0.620 364 A CB -0.477 18.448 19.000 -0.124 0.000 0.822 364 A HN -0.233 7.856 8.150 -0.102 0.000 0.443 365 E N -5.465 114.206 120.200 -0.882 0.000 2.274 365 E HA -0.251 2.440 4.350 -2.764 0.000 0.194 365 E C 1.462 177.809 176.600 -0.422 0.000 0.996 365 E CA 2.466 58.111 56.400 -1.258 0.000 0.840 365 E CB -0.559 28.802 29.700 -0.565 0.000 0.772 365 E HN 0.444 8.468 8.360 -0.560 0.000 0.491 366 T N 0.628 115.131 114.554 -0.085 0.000 2.851 366 T HA -0.036 4.624 4.350 0.279 -0.143 0.262 366 T C 0.534 175.376 174.700 0.235 0.000 1.043 366 T CA 3.249 65.476 62.100 0.211 0.000 1.140 366 T CB 0.128 69.194 68.868 0.330 0.000 0.872 366 T HN -0.661 7.487 8.240 -0.114 0.023 0.446 367 F N 0.527 120.458 119.950 -0.031 0.000 2.216 367 F HA -0.173 4.430 4.527 0.127 0.000 0.300 367 F C 0.159 176.067 175.800 0.180 0.000 1.085 367 F CA 0.573 58.600 58.000 0.044 0.000 1.326 367 F CB 0.763 39.714 39.000 -0.081 0.000 1.027 367 F HN -0.607 7.779 8.300 0.143 0.000 0.497 368 W N -1.907 119.417 121.300 0.040 0.000 2.409 368 W HA -0.382 4.243 4.660 -0.058 0.000 0.338 368 W C 0.937 177.397 176.519 -0.099 0.000 1.273 368 W CA 1.272 58.591 57.345 -0.043 0.000 1.299 368 W CB -2.015 27.453 29.460 0.014 0.000 1.192 368 W HN -0.805 7.336 8.180 -0.065 0.000 0.565 369 G N 1.910 110.768 108.800 0.097 0.000 2.205 369 G HA2 -0.408 3.552 3.960 -0.001 0.000 0.261 369 G HA3 -0.408 3.559 3.960 0.011 0.000 0.261 369 G C -0.824 174.058 174.900 -0.030 0.000 0.980 369 G CA 0.023 45.130 45.100 0.011 0.000 0.632 369 G HN 0.327 9.029 8.290 0.087 -0.360 0.533 370 S N -1.478 114.174 115.700 -0.081 0.000 2.589 370 S HA 0.093 4.548 4.470 -0.025 0.000 0.265 370 S C 1.094 175.630 174.600 -0.107 0.000 1.342 370 S CA -0.754 57.401 58.200 -0.076 0.000 1.005 370 S CB 1.898 65.069 63.200 -0.048 0.000 0.909 370 S HN -0.685 7.478 8.310 -0.125 0.072 0.555 371 V N 1.986 121.841 119.914 -0.098 0.000 2.332 371 V HA -0.424 3.630 4.120 -0.110 0.000 0.248 371 V C 1.824 177.836 176.094 -0.136 0.000 1.055 371 V CA 4.174 66.389 62.300 -0.142 0.000 1.038 371 V CB -0.448 31.253 31.823 -0.205 0.000 0.651 371 V HN 0.526 8.664 8.190 -0.086 0.000 0.450 372 H N -2.828 116.251 119.070 0.016 0.000 2.321 372 H HA -0.368 4.259 4.556 0.118 0.000 0.300 372 H C 1.717 177.046 175.328 0.001 0.000 1.087 372 H CA 4.157 60.268 56.048 0.104 0.000 1.319 372 H CB -0.214 29.751 29.762 0.339 0.000 1.379 372 H HN -0.421 7.842 8.280 -0.028 0.000 0.501 373 E N -0.184 119.864 120.200 -0.254 0.000 2.077 373 E HA -0.293 4.114 4.350 -0.166 -0.156 0.193 373 E C 2.947 179.494 176.600 -0.088 0.000 0.989 373 E CA 2.754 58.937 56.400 -0.362 0.000 0.800 373 E CB -0.272 28.930 29.700 -0.830 0.000 0.746 373 E HN -0.615 7.475 8.360 -0.450 0.000 0.452 374 R N -2.573 117.873 120.500 -0.090 0.000 2.148 374 R HA -0.151 4.157 4.340 -0.054 0.000 0.227 374 R C 1.882 178.164 176.300 -0.031 0.000 1.103 374 R CA 1.816 57.884 56.100 -0.054 0.000 0.983 374 R CB -0.389 29.878 30.300 -0.055 0.000 0.874 374 R HN -0.064 8.137 8.270 -0.116 0.000 0.451 375 N N -3.371 115.325 118.700 -0.006 0.000 2.383 375 N HA 0.020 4.757 4.740 -0.005 0.000 0.192 375 N C 0.183 175.722 175.510 0.049 0.000 1.141 375 N CA 0.389 53.448 53.050 0.015 0.000 0.851 375 N CB 0.503 39.001 38.487 0.018 0.000 0.976 375 N HN -0.647 7.614 8.380 0.000 0.120 0.465 376 G N -1.102 107.734 108.800 0.061 0.000 2.141 376 G HA2 -0.466 3.530 3.960 0.059 0.000 0.242 376 G HA3 -0.466 3.525 3.960 0.050 0.000 0.242 376 G C -0.427 174.564 174.900 0.152 0.000 0.982 376 G CA 0.401 45.547 45.100 0.077 0.000 0.662 376 G HN -0.394 7.757 8.290 0.050 0.170 0.527 377 V N -0.002 120.051 119.914 0.231 0.000 2.732 377 V HA 0.029 4.407 4.120 0.214 -0.130 0.297 377 V C -1.035 175.313 176.094 0.423 0.000 1.060 377 V CA -0.205 62.274 62.300 0.297 0.000 1.038 377 V CB 0.190 32.231 31.823 0.364 0.000 1.003 377 V HN -0.632 7.660 8.190 0.235 0.040 0.481 378 A N 2.304 125.289 122.820 0.274 0.000 2.479 378 A HA 0.676 5.378 4.320 0.360 -0.166 0.296 378 A C 1.081 178.658 177.584 -0.012 0.000 1.121 378 A CA -2.009 50.159 52.037 0.217 0.000 0.743 378 A CB 3.007 22.126 19.000 0.198 0.000 1.323 378 A HN -0.047 8.496 8.150 0.187 -0.281 0.415 379 C N -0.647 118.576 119.300 -0.128 0.000 2.401 379 C HA -0.385 3.927 4.460 -0.246 0.000 0.276 379 C C 2.054 177.026 174.990 -0.029 0.000 1.233 379 C CA 3.625 62.549 59.018 -0.156 0.000 1.753 379 C CB -1.851 25.795 27.740 -0.156 0.000 2.029 379 C HN 0.347 8.714 8.230 -0.093 -0.193 0.478 380 A N -0.791 122.020 122.820 -0.015 0.000 2.019 380 A HA -0.364 3.952 4.320 -0.006 0.000 0.219 380 A C 2.161 179.731 177.584 -0.023 0.000 1.164 380 A CA 3.058 55.088 52.037 -0.013 0.000 0.644 380 A CB -0.863 18.126 19.000 -0.018 0.000 0.805 380 A HN -0.007 8.134 8.150 -0.007 0.005 0.449 381 D N -1.708 118.681 120.400 -0.018 0.000 2.178 381 D HA -0.222 4.410 4.640 -0.013 0.000 0.201 381 D C 0.739 176.997 176.300 -0.070 0.000 0.980 381 D CA 3.356 57.344 54.000 -0.020 0.000 0.842 381 D CB -0.087 40.725 40.800 0.020 0.000 0.948 381 D HN -0.265 8.081 8.370 -0.004 0.021 0.472 382 C N -4.299 114.912 119.300 -0.149 0.000 2.674 382 C HA 0.131 4.461 4.460 -0.216 0.000 0.276 382 C C -0.092 174.666 174.990 -0.388 0.000 1.300 382 C CA 1.043 59.880 59.018 -0.302 0.000 1.732 382 C CB 0.521 27.993 27.740 -0.447 0.000 2.076 382 C HN -0.678 7.452 8.230 -0.146 0.013 0.548 383 H N -4.818 114.199 119.070 -0.089 0.000 3.046 383 H HA 0.448 5.089 4.556 -0.100 -0.144 0.262 383 H C -0.475 174.800 175.328 -0.089 0.000 1.044 383 H CA 0.055 56.043 56.048 -0.101 0.000 1.209 383 H CB 2.444 32.128 29.762 -0.129 0.000 1.507 383 H HN -0.412 7.833 8.280 -0.058 0.000 0.507 384 M N -1.126 118.481 119.600 0.012 0.000 3.951 384 M HA 0.383 4.851 4.480 -0.020 0.000 0.444 384 M C -2.984 173.288 176.300 -0.046 0.000 1.957 384 M CA -1.852 53.430 55.300 -0.030 0.000 0.521 384 M CB 1.515 34.068 32.600 -0.077 0.000 1.436 384 M HN -0.430 7.751 8.290 -0.005 0.106 0.525 385 P HA 0.134 4.528 4.420 -0.042 0.000 0.274 385 P C -0.752 176.505 177.300 -0.072 0.000 1.246 385 P CA -1.362 61.707 63.100 -0.051 0.000 0.795 385 P CB 0.538 32.207 31.700 -0.051 0.000 1.006 386 K N -0.968 119.391 120.400 -0.069 0.000 2.436 386 K HA -0.180 4.188 4.320 -0.128 -0.124 0.275 386 K C 0.281 176.787 176.600 -0.157 0.000 0.999 386 K CA 0.825 57.048 56.287 -0.107 0.000 0.980 386 K CB 0.278 32.740 32.500 -0.063 0.000 0.919 386 K HN 0.027 8.248 8.250 -0.049 0.000 0.484 387 V N -1.793 117.946 119.914 -0.290 0.000 2.811 387 V HA 0.098 4.095 4.120 -0.204 0.000 0.302 387 V C -0.999 175.004 176.094 -0.151 0.000 1.063 387 V CA -0.407 61.725 62.300 -0.280 0.000 1.088 387 V CB 0.442 31.952 31.823 -0.521 0.000 0.982 387 V HN -0.102 7.845 8.190 -0.406 0.000 0.485 388 Q N 3.623 123.370 119.800 -0.088 0.000 2.333 388 Q HA 0.312 4.628 4.340 -0.039 0.000 0.265 388 Q C -1.363 174.622 176.000 -0.023 0.000 0.989 388 Q CA -0.524 55.253 55.803 -0.043 0.000 0.842 388 Q CB 1.013 29.735 28.738 -0.027 0.000 1.262 388 Q HN 0.031 8.252 8.270 -0.082 0.000 0.451 389 L N 3.345 124.564 121.223 -0.007 0.000 2.386 389 L HA 0.285 4.634 4.340 0.015 0.000 0.271 389 L C 0.631 177.511 176.870 0.016 0.000 0.993 389 L CA -0.547 54.301 54.840 0.014 0.000 0.819 389 L CB 2.227 44.307 42.059 0.035 0.000 1.294 389 L HN 0.174 8.401 8.230 -0.006 0.000 0.414 390 E N 0.957 121.168 120.200 0.018 0.000 2.077 390 E HA -0.174 4.184 4.350 0.014 0.000 0.193 390 E C -0.109 176.503 176.600 0.020 0.000 0.989 390 E CA 1.558 57.968 56.400 0.017 0.000 0.800 390 E CB 0.419 30.129 29.700 0.016 0.000 0.746 390 E HN 0.278 8.649 8.360 0.019 0.000 0.452 391 N N -1.424 117.291 118.700 0.025 0.000 2.500 391 N HA 0.128 4.883 4.740 0.025 0.000 0.291 391 N C -1.405 174.128 175.510 0.037 0.000 1.092 391 N CA 0.162 53.229 53.050 0.028 0.000 0.890 391 N CB 0.776 39.277 38.487 0.024 0.000 1.466 391 N HN -0.283 8.114 8.380 0.028 0.000 0.507 392 G N 0.652 109.477 108.800 0.042 0.000 2.321 392 G HA2 -0.146 3.846 3.960 0.054 0.000 0.298 392 G HA3 -0.146 3.856 3.960 0.070 0.000 0.298 392 G C -2.191 172.748 174.900 0.065 0.000 1.385 392 G CA -0.162 44.973 45.100 0.058 0.000 0.856 392 G HN -0.092 8.220 8.290 0.037 0.000 0.584 393 K N 0.652 121.104 120.400 0.086 0.000 2.276 393 K HA 0.138 4.504 4.320 0.076 0.000 0.285 393 K C -0.598 176.091 176.600 0.149 0.000 1.062 393 K CA -0.491 55.854 56.287 0.098 0.000 0.918 393 K CB 0.510 33.065 32.500 0.091 0.000 1.055 393 K HN -0.051 8.252 8.250 0.089 0.000 0.477 394 V N 5.807 125.785 119.914 0.106 0.000 2.740 394 V HA -0.033 4.117 4.120 0.049 0.000 0.303 394 V C -0.835 175.362 176.094 0.171 0.000 1.054 394 V CA 0.455 62.804 62.300 0.080 0.000 1.106 394 V CB 0.343 32.181 31.823 0.025 0.000 0.957 394 V HN 0.329 8.566 8.190 0.079 0.000 0.486 395 Y N 3.820 124.149 120.300 0.048 0.000 2.644 395 Y HA 0.358 4.943 4.550 0.057 0.000 0.338 395 Y C -2.046 173.902 175.900 0.080 0.000 1.119 395 Y CA -2.769 55.368 58.100 0.063 0.000 1.060 395 Y CB 1.341 39.841 38.460 0.065 0.000 1.294 395 Y HN -0.480 7.705 8.280 -0.159 0.000 0.472 396 T N 2.201 116.869 114.554 0.190 0.000 2.743 396 T HA -0.044 4.286 4.350 -0.032 0.000 0.293 396 T C -0.785 174.057 174.700 0.235 0.000 0.945 396 T CA 0.002 62.166 62.100 0.106 0.000 1.030 396 T CB -0.231 68.724 68.868 0.143 0.000 0.912 396 T HN -0.093 8.356 8.240 0.347 0.000 0.483 397 S N 5.580 121.292 115.700 0.021 0.000 2.549 397 S HA -0.177 4.465 4.470 0.286 0.000 0.286 397 S C 0.244 174.977 174.600 0.222 0.000 1.314 397 S CA 0.963 59.254 58.200 0.153 0.000 1.062 397 S CB 0.422 63.632 63.200 0.017 0.000 0.865 397 S HN -0.041 8.212 8.310 -0.095 0.000 0.498 398 H N 5.274 124.446 119.070 0.171 0.000 2.487 398 H HA 0.245 4.896 4.556 0.158 0.000 0.290 398 H C -0.676 174.751 175.328 0.164 0.000 1.081 398 H CA -0.834 55.321 56.048 0.179 0.000 1.116 398 H CB 0.248 30.141 29.762 0.219 0.000 1.560 398 H HN -0.047 8.530 8.280 0.495 0.000 0.548 399 S N 1.272 117.064 115.700 0.154 0.000 2.642 399 S HA 0.325 4.842 4.470 0.010 -0.041 0.309 399 S C -0.807 173.789 174.600 -0.007 0.000 1.125 399 S CA -0.898 57.322 58.200 0.034 0.000 1.055 399 S CB -0.895 62.296 63.200 -0.014 0.000 1.157 399 S HN -0.792 7.544 8.310 0.139 0.057 0.513 400 Q N 7.950 127.736 119.800 -0.023 0.000 2.344 400 Q HA 0.202 4.769 4.340 -0.021 -0.239 0.253 400 Q C -0.492 175.395 176.000 -0.188 0.000 1.050 400 Q CA 0.134 55.891 55.803 -0.078 0.000 0.912 400 Q CB 0.233 28.940 28.738 -0.052 0.000 1.258 400 Q HN -0.019 8.252 8.270 0.003 0.000 0.443 401 R N -0.235 120.220 120.500 -0.076 0.000 2.747 401 R HA 0.341 4.595 4.340 -0.144 0.000 0.272 401 R C -1.990 174.364 176.300 0.090 0.000 1.032 401 R CA -1.709 54.347 56.100 -0.073 0.000 0.896 401 R CB 2.138 32.381 30.300 -0.096 0.000 1.253 401 R HN -0.593 7.684 8.270 0.011 0.000 0.461 402 T N -0.541 114.029 114.554 0.026 0.000 2.946 402 T HA 0.097 4.537 4.350 0.150 0.000 0.311 402 T C 0.897 175.574 174.700 -0.038 0.000 1.063 402 T CA -1.360 60.763 62.100 0.039 0.000 1.139 402 T CB 0.569 69.409 68.868 -0.046 0.000 0.994 402 T HN 0.555 8.772 8.240 -0.039 0.000 0.547 403 P HA -0.060 4.274 4.420 -0.142 0.000 0.225 403 P C 1.755 178.983 177.300 -0.120 0.000 1.148 403 P CA 1.693 64.695 63.100 -0.164 0.000 0.779 403 P CB 0.122 31.669 31.700 -0.255 0.000 0.780 404 R N -1.484 118.946 120.500 -0.116 0.000 2.200 404 R HA -0.233 4.048 4.340 -0.099 0.000 0.234 404 R C 1.503 177.760 176.300 -0.071 0.000 1.127 404 R CA 2.879 58.921 56.100 -0.096 0.000 0.989 404 R CB -0.415 29.828 30.300 -0.095 0.000 0.869 404 R HN -0.585 7.571 8.270 -0.121 0.041 0.459 405 D N -2.842 117.518 120.400 -0.067 0.000 2.355 405 D HA 0.009 4.619 4.640 -0.049 0.000 0.218 405 D C 0.450 176.723 176.300 -0.044 0.000 1.004 405 D CA 1.730 55.699 54.000 -0.053 0.000 0.880 405 D CB 0.878 41.645 40.800 -0.055 0.000 0.911 405 D HN -0.657 7.639 8.370 -0.071 0.032 0.528 406 M N -6.724 112.847 119.600 -0.049 0.000 4.568 406 M HA 0.474 4.934 4.480 -0.032 0.000 0.533 406 M C -1.234 175.043 176.300 -0.037 0.000 2.143 406 M CA -0.222 55.054 55.300 -0.040 0.000 0.483 406 M CB 0.195 32.770 32.600 -0.042 0.000 1.438 406 M HN -0.363 7.737 8.290 -0.059 0.155 0.591 407 M N 1.546 121.126 119.600 -0.032 0.000 2.229 407 M HA -0.158 4.302 4.480 -0.032 0.000 0.264 407 M C 1.949 178.255 176.300 0.011 0.000 1.063 407 M CA 2.950 58.238 55.300 -0.020 0.000 1.114 407 M CB -0.697 31.889 32.600 -0.022 0.000 1.387 407 M HN 0.293 8.564 8.290 -0.032 0.000 0.420 408 G N -1.983 106.822 108.800 0.009 0.000 2.446 408 G HA2 -0.386 3.597 3.960 0.038 0.000 0.217 408 G HA3 -0.386 3.583 3.960 0.015 0.000 0.217 408 G C 1.245 176.158 174.900 0.021 0.000 1.168 408 G CA 2.005 47.118 45.100 0.022 0.000 0.771 408 G HN 0.295 8.571 8.290 -0.000 0.015 0.551 409 Q N 0.363 120.164 119.800 0.001 0.000 2.163 409 Q HA -0.046 4.293 4.340 -0.001 0.000 0.198 409 Q C 1.543 177.539 176.000 -0.006 0.000 0.954 409 Q CA 1.725 57.523 55.803 -0.008 0.000 0.851 409 Q CB -0.050 28.671 28.738 -0.029 0.000 0.928 409 Q HN -0.652 7.613 8.270 -0.009 0.000 0.459 410 A N -2.794 120.015 122.820 -0.017 0.000 1.968 410 A HA -0.059 4.418 4.320 -0.045 -0.184 0.217 410 A C 0.631 178.225 177.584 0.016 0.000 1.169 410 A CA 2.109 54.125 52.037 -0.035 0.000 0.638 410 A CB 0.514 19.459 19.000 -0.091 0.000 0.812 410 A HN -0.113 8.023 8.150 -0.023 0.000 0.446 411 C N -5.150 114.193 119.300 0.072 0.000 2.904 411 C HA 0.140 4.746 4.460 0.244 0.000 0.524 411 C C 1.037 176.182 174.990 0.257 0.000 1.313 411 C CA 1.256 60.392 59.018 0.197 0.000 2.614 411 C CB 1.935 29.791 27.740 0.193 0.000 3.335 411 C HN -0.436 7.829 8.230 0.059 0.000 0.519 412 L N 0.369 121.699 121.223 0.178 0.000 2.341 412 L HA -0.146 4.362 4.340 0.280 0.000 0.214 412 L C 1.340 178.286 176.870 0.127 0.000 1.115 412 L CA 2.524 57.479 54.840 0.192 0.000 0.820 412 L CB -0.394 41.752 42.059 0.145 0.000 0.944 412 L HN -0.118 8.187 8.230 0.125 0.000 0.452 413 N N -1.470 117.280 118.700 0.083 0.000 2.223 413 N HA -0.211 4.554 4.740 0.040 0.000 0.185 413 N C 1.238 176.763 175.510 0.024 0.000 1.016 413 N CA 2.626 55.703 53.050 0.045 0.000 0.863 413 N CB -0.320 38.183 38.487 0.027 0.000 0.983 413 N HN -0.363 8.064 8.380 0.078 0.000 0.429 414 C N -1.638 117.677 119.300 0.024 0.000 2.505 414 C HA -0.034 4.378 4.460 -0.081 0.000 0.279 414 C C 0.818 175.707 174.990 -0.167 0.000 1.316 414 C CA 0.549 59.519 59.018 -0.080 0.000 1.720 414 C CB 0.341 28.016 27.740 -0.109 0.000 2.050 414 C HN -0.540 7.728 8.230 0.063 0.000 0.493 415 H N 0.691 119.786 119.070 0.042 0.000 2.652 415 H HA 0.185 4.790 4.556 -0.124 -0.123 0.233 415 H C -0.320 175.015 175.328 0.011 0.000 1.762 415 H CA -0.732 55.300 56.048 -0.025 0.000 1.285 415 H CB -2.279 27.515 29.762 0.053 0.000 1.668 415 H HN -0.152 8.250 8.280 0.204 0.000 0.550 416 A N 2.746 125.592 122.820 0.043 0.000 2.125 416 A HA -0.181 4.183 4.320 0.074 0.000 0.219 416 A C 0.667 178.281 177.584 0.050 0.000 1.156 416 A CA 2.356 54.421 52.037 0.047 0.000 0.671 416 A CB 0.059 19.062 19.000 0.006 0.000 0.794 416 A HN -0.418 7.685 8.150 -0.017 0.037 0.459 417 E N -4.420 115.778 120.200 -0.002 0.000 2.427 417 E HA -0.167 4.189 4.350 0.009 0.000 0.196 417 E C -0.112 176.561 176.600 0.122 0.000 1.028 417 E CA 0.305 56.694 56.400 -0.018 0.000 0.864 417 E CB -0.048 29.558 29.700 -0.157 0.000 0.813 417 E HN 0.101 8.386 8.360 -0.052 0.044 0.514 418 W N -0.761 120.580 121.300 0.069 0.000 2.627 418 W HA 0.280 5.148 4.660 0.028 -0.191 0.339 418 W C 0.398 176.935 176.519 0.031 0.000 1.058 418 W CA -2.465 54.906 57.345 0.043 0.000 1.223 418 W CB 1.628 31.113 29.460 0.043 0.000 1.389 418 W HN -0.706 7.595 8.180 0.288 0.052 0.541 419 T N -0.718 113.970 114.554 0.224 0.000 2.816 419 T HA 0.271 4.682 4.350 0.103 0.000 0.282 419 T C 0.726 175.452 174.700 0.044 0.000 0.993 419 T CA -1.277 60.881 62.100 0.097 0.000 0.994 419 T CB 1.954 70.841 68.868 0.032 0.000 1.025 419 T HN 0.128 8.791 8.240 0.203 -0.301 0.529 420 E N 0.703 120.913 120.200 0.016 0.000 2.085 420 E HA -0.391 3.955 4.350 -0.008 0.000 0.194 420 E C 1.851 178.404 176.600 -0.079 0.000 0.994 420 E CA 4.093 60.481 56.400 -0.020 0.000 0.801 420 E CB -0.107 29.585 29.700 -0.014 0.000 0.743 420 E HN 0.571 8.944 8.360 0.022 0.000 0.453 421 D N -2.447 117.905 120.400 -0.080 0.000 2.144 421 D HA -0.230 4.361 4.640 -0.083 0.000 0.199 421 D C 2.687 178.881 176.300 -0.177 0.000 0.984 421 D CA 3.201 57.139 54.000 -0.103 0.000 0.834 421 D CB -0.659 40.085 40.800 -0.094 0.000 0.955 421 D HN 0.143 8.477 8.370 -0.060 0.000 0.465 422 Q N -0.336 119.311 119.800 -0.256 0.000 2.084 422 Q HA -0.309 3.787 4.340 -0.406 0.000 0.202 422 Q C 2.341 177.859 176.000 -0.804 0.000 0.978 422 Q CA 2.962 58.474 55.803 -0.486 0.000 0.844 422 Q CB -0.035 28.399 28.738 -0.508 0.000 0.898 422 Q HN -0.641 7.512 8.270 -0.195 0.000 0.426 423 A N -0.062 122.322 122.820 -0.727 0.000 1.902 423 A HA -0.239 3.242 4.320 -1.400 0.000 0.217 423 A C 2.129 179.470 177.584 -0.405 0.000 1.181 423 A CA 3.039 54.633 52.037 -0.738 0.000 0.623 423 A CB -0.740 18.136 19.000 -0.207 0.000 0.818 423 A HN -0.399 7.475 8.150 -0.460 0.000 0.443 424 L N -2.403 118.679 121.223 -0.235 0.000 2.046 424 L HA -0.436 3.813 4.340 -0.151 0.000 0.208 424 L C 2.067 178.896 176.870 -0.069 0.000 1.077 424 L CA 3.140 57.898 54.840 -0.136 0.000 0.747 424 L CB -0.377 41.631 42.059 -0.085 0.000 0.896 424 L HN -0.268 7.835 8.230 -0.211 0.000 0.432 425 Y N -0.222 119.946 120.300 -0.220 0.000 2.181 425 Y HA -0.482 4.021 4.550 -0.078 0.000 0.288 425 Y C 1.184 177.023 175.900 -0.101 0.000 1.146 425 Y CA 3.579 61.595 58.100 -0.141 0.000 1.164 425 Y CB -0.101 38.264 38.460 -0.158 0.000 0.982 425 Y HN -0.409 7.864 8.280 -0.011 0.000 0.515 426 A N -0.705 122.048 122.820 -0.111 0.000 1.902 426 A HA -0.350 3.946 4.320 -0.041 0.000 0.217 426 A C 2.005 179.638 177.584 0.082 0.000 1.181 426 A CA 3.029 55.017 52.037 -0.083 0.000 0.623 426 A CB -1.011 17.832 19.000 -0.262 0.000 0.818 426 A HN -0.373 7.624 8.150 -0.256 0.000 0.443 427 I N -1.804 118.788 120.570 0.036 0.000 2.163 427 I HA -0.632 3.726 4.170 0.314 0.000 0.243 427 I C 1.661 177.835 176.117 0.095 0.000 1.085 427 I CA 4.360 65.709 61.300 0.081 0.000 1.347 427 I CB -0.339 37.542 38.000 -0.198 0.000 1.044 427 I HN -0.454 7.712 8.210 -0.072 0.000 0.408 428 D N -1.048 119.355 120.400 0.005 0.000 2.178 428 D HA -0.255 4.384 4.640 -0.002 0.000 0.202 428 D C 2.515 178.817 176.300 0.003 0.000 0.974 428 D CA 3.230 57.220 54.000 -0.016 0.000 0.841 428 D CB -0.330 40.435 40.800 -0.059 0.000 0.953 428 D HN -0.355 7.997 8.370 -0.030 0.000 0.478 429 Y N 1.475 121.685 120.300 -0.150 0.000 2.128 429 Y HA -0.444 4.010 4.550 -0.160 0.000 0.284 429 Y C 1.729 177.637 175.900 0.014 0.000 1.154 429 Y CA 4.101 62.121 58.100 -0.132 0.000 1.149 429 Y CB -0.010 38.336 38.460 -0.189 0.000 0.976 429 Y HN -0.335 7.974 8.280 0.048 0.000 0.505 430 I N -1.698 119.067 120.570 0.325 0.000 2.179 430 I HA -0.659 3.708 4.170 0.327 0.000 0.242 430 I C 1.981 178.233 176.117 0.225 0.000 1.088 430 I CA 4.329 65.806 61.300 0.295 0.000 1.357 430 I CB -0.160 38.015 38.000 0.292 0.000 1.051 430 I HN -0.738 7.664 8.210 0.318 0.000 0.409 431 K N -0.036 120.471 120.400 0.179 0.000 2.057 431 K HA -0.225 4.421 4.320 0.146 -0.238 0.207 431 K C 2.870 179.531 176.600 0.103 0.000 1.049 431 K CA 3.233 59.596 56.287 0.126 0.000 0.931 431 K CB -0.298 32.245 32.500 0.072 0.000 0.714 431 K HN -0.263 8.094 8.250 0.179 0.000 0.440 432 N N -0.215 118.520 118.700 0.059 0.000 2.084 432 N HA -0.265 4.509 4.740 0.057 0.000 0.190 432 N C 1.965 177.510 175.510 0.058 0.000 1.030 432 N CA 2.862 55.933 53.050 0.036 0.000 0.849 432 N CB -0.367 38.089 38.487 -0.050 0.000 1.012 432 N HN -0.049 8.355 8.380 0.041 0.000 0.423 433 Y N 1.116 121.370 120.300 -0.077 0.000 2.145 433 Y HA -0.338 4.153 4.550 -0.099 0.000 0.286 433 Y C 1.786 177.678 175.900 -0.013 0.000 1.145 433 Y CA 4.120 62.174 58.100 -0.077 0.000 1.148 433 Y CB 0.116 38.521 38.460 -0.093 0.000 0.981 433 Y HN -0.318 8.040 8.280 0.130 0.000 0.507 434 T N 1.950 116.503 114.554 -0.001 0.000 2.708 434 T HA -0.399 3.825 4.350 -0.211 0.000 0.266 434 T C 1.486 176.161 174.700 -0.041 0.000 1.037 434 T CA 5.382 67.437 62.100 -0.075 0.000 1.146 434 T CB -0.497 68.394 68.868 0.039 0.000 0.865 434 T HN -0.126 8.199 8.240 0.141 0.000 0.435 435 H N 3.016 122.064 119.070 -0.037 0.000 2.353 435 H HA -0.369 4.209 4.556 0.037 0.000 0.300 435 H C 1.701 177.012 175.328 -0.029 0.000 1.090 435 H CA 3.896 59.943 56.048 -0.001 0.000 1.327 435 H CB -0.283 29.486 29.762 0.012 0.000 1.383 435 H HN 0.040 8.426 8.280 0.177 0.000 0.508 436 G N -1.920 106.800 108.800 -0.133 0.000 2.442 436 G HA2 -0.402 3.444 3.960 -0.190 0.000 0.219 436 G HA3 -0.402 3.457 3.960 -0.169 0.000 0.219 436 G C 1.317 176.093 174.900 -0.205 0.000 1.141 436 G CA 2.111 47.096 45.100 -0.191 0.000 0.763 436 G HN -0.127 8.126 8.290 -0.061 0.000 0.554 437 K N 1.630 121.876 120.400 -0.256 0.000 2.155 437 K HA -0.145 4.092 4.320 -0.138 0.000 0.203 437 K C 2.480 179.062 176.600 -0.029 0.000 1.052 437 K CA 1.437 57.617 56.287 -0.178 0.000 0.948 437 K CB -0.574 31.755 32.500 -0.285 0.000 0.728 437 K HN -0.731 7.324 8.250 -0.327 0.000 0.448 438 I N 0.698 121.262 120.570 -0.010 0.000 2.179 438 I HA -0.471 3.889 4.170 0.317 0.000 0.242 438 I C 1.671 177.847 176.117 0.098 0.000 1.088 438 I CA 4.424 65.820 61.300 0.160 0.000 1.357 438 I CB -0.098 38.011 38.000 0.180 0.000 1.051 438 I HN -0.162 8.010 8.210 -0.063 0.000 0.409 439 V N -0.185 119.666 119.914 -0.105 0.000 2.343 439 V HA -0.538 3.553 4.120 -0.048 0.000 0.247 439 V C 2.022 178.122 176.094 0.009 0.000 1.051 439 V CA 4.908 67.152 62.300 -0.092 0.000 1.036 439 V CB -1.056 30.642 31.823 -0.208 0.000 0.654 439 V HN -0.036 8.012 8.190 -0.236 0.000 0.451 440 K N -1.462 118.956 120.400 0.029 0.000 2.097 440 K HA -0.383 4.024 4.320 0.145 0.000 0.205 440 K C 2.397 179.167 176.600 0.283 0.000 1.050 440 K CA 3.621 59.999 56.287 0.153 0.000 0.938 440 K CB -0.393 32.189 32.500 0.137 0.000 0.718 440 K HN -0.172 8.069 8.250 -0.015 0.000 0.442 441 S N 0.783 116.600 115.700 0.195 0.000 2.370 441 S HA -0.270 4.349 4.470 0.249 0.000 0.226 441 S C 2.142 176.745 174.600 0.005 0.000 1.033 441 S CA 4.021 62.334 58.200 0.188 0.000 1.011 441 S CB -0.649 62.715 63.200 0.274 0.000 0.852 441 S HN -0.039 8.364 8.310 0.155 0.000 0.457 442 E N 1.627 121.756 120.200 -0.118 0.000 2.106 442 E HA -0.395 3.611 4.350 -0.573 0.000 0.192 442 E C 1.956 178.456 176.600 -0.167 0.000 0.984 442 E CA 2.855 59.072 56.400 -0.306 0.000 0.806 442 E CB -0.058 29.510 29.700 -0.220 0.000 0.750 442 E HN -0.362 7.978 8.360 -0.033 0.000 0.458 443 Y N 2.135 122.337 120.300 -0.163 0.000 2.114 443 Y HA -0.356 4.047 4.550 -0.244 0.000 0.282 443 Y C 1.694 177.399 175.900 -0.326 0.000 1.165 443 Y CA 3.440 61.385 58.100 -0.259 0.000 1.148 443 Y CB 0.023 38.293 38.460 -0.315 0.000 0.972 443 Y HN -0.351 7.993 8.280 0.106 0.000 0.504 444 W N -3.244 117.987 121.300 -0.114 0.000 2.418 444 W HA -0.303 4.193 4.660 -0.272 0.000 0.292 444 W C 2.193 178.582 176.519 -0.218 0.000 1.213 444 W CA 3.915 61.162 57.345 -0.163 0.000 1.283 444 W CB 0.205 29.670 29.460 0.008 0.000 1.119 444 W HN -0.514 7.797 8.180 0.217 0.000 0.542 445 L N -0.604 120.602 121.223 -0.028 0.000 2.012 445 L HA -0.469 3.804 4.340 -0.112 0.000 0.210 445 L C 2.253 178.981 176.870 -0.238 0.000 1.073 445 L CA 3.308 58.051 54.840 -0.160 0.000 0.748 445 L CB -0.240 41.650 42.059 -0.282 0.000 0.891 445 L HN -0.008 8.213 8.230 -0.014 0.000 0.431 446 A N -2.061 120.589 122.820 -0.283 0.000 1.933 446 A HA -0.398 3.792 4.320 -0.217 0.000 0.218 446 A C 1.462 178.875 177.584 -0.286 0.000 1.175 446 A CA 3.293 55.168 52.037 -0.270 0.000 0.628 446 A CB -0.954 17.887 19.000 -0.266 0.000 0.814 446 A HN 0.144 8.114 8.150 -0.300 0.000 0.444 447 K N -1.105 119.046 120.400 -0.415 0.000 2.026 447 K HA -0.336 3.764 4.320 -0.367 0.000 0.208 447 K C 2.018 178.516 176.600 -0.170 0.000 1.048 447 K CA 3.030 59.087 56.287 -0.383 0.000 0.929 447 K CB -0.092 32.042 32.500 -0.611 0.000 0.713 447 K HN -0.564 7.372 8.250 -0.524 0.000 0.439 448 M N -0.512 119.026 119.600 -0.103 0.000 2.086 448 M HA -0.361 4.116 4.480 -0.005 0.000 0.261 448 M C 2.449 178.769 176.300 0.033 0.000 1.067 448 M CA 3.713 58.999 55.300 -0.023 0.000 1.116 448 M CB 0.033 32.623 32.600 -0.016 0.000 1.348 448 M HN -0.592 7.634 8.290 -0.107 0.000 0.407 449 I N -0.084 120.436 120.570 -0.083 0.000 2.208 449 I HA -0.577 3.561 4.170 -0.054 0.000 0.245 449 I C 2.061 178.215 176.117 0.062 0.000 1.097 449 I CA 4.030 65.290 61.300 -0.066 0.000 1.363 449 I CB -0.293 37.590 38.000 -0.194 0.000 1.051 449 I HN 0.075 8.185 8.210 -0.167 0.000 0.413 450 D N -0.892 119.502 120.400 -0.009 0.000 2.310 450 D HA -0.152 4.497 4.640 0.016 0.000 0.212 450 D C 1.936 178.246 176.300 0.016 0.000 0.965 450 D CA 2.915 56.912 54.000 -0.005 0.000 0.879 450 D CB -0.509 40.255 40.800 -0.061 0.000 0.921 450 D HN -0.295 8.038 8.370 -0.062 0.000 0.510 451 L N -1.600 119.633 121.223 0.017 0.000 2.418 451 L HA -0.199 4.119 4.340 -0.037 0.000 0.218 451 L C 1.169 178.021 176.870 -0.031 0.000 1.125 451 L CA 1.286 56.106 54.840 -0.033 0.000 0.835 451 L CB -0.108 41.896 42.059 -0.092 0.000 0.953 451 L HN -0.684 7.417 8.230 0.021 0.142 0.454 452 F N 0.036 119.955 119.950 -0.051 0.000 2.102 452 F HA -0.257 4.251 4.527 -0.030 0.000 0.298 452 F C -1.145 174.646 175.800 -0.015 0.000 1.105 452 F CA 6.661 64.643 58.000 -0.031 0.000 1.239 452 F CB -3.206 35.779 39.000 -0.026 0.000 0.991 452 F HN -0.502 7.858 8.300 0.325 0.136 0.474 453 P HA -0.264 4.216 4.420 0.100 0.000 0.217 453 P C 0.870 178.195 177.300 0.041 0.000 1.150 453 P CA 3.171 66.326 63.100 0.091 0.000 0.832 453 P CB -0.517 31.224 31.700 0.069 0.000 0.787 454 V N -2.754 117.170 119.914 0.017 0.000 2.343 454 V HA -0.407 3.710 4.120 -0.004 0.000 0.247 454 V C 1.936 178.014 176.094 -0.027 0.000 1.051 454 V CA 4.166 66.460 62.300 -0.010 0.000 1.036 454 V CB -1.122 30.687 31.823 -0.022 0.000 0.654 454 V HN -0.440 7.763 8.190 0.021 0.000 0.451 455 A N -0.171 122.615 122.820 -0.057 0.000 1.877 455 A HA -0.417 3.855 4.320 -0.079 0.000 0.216 455 A C 1.840 179.396 177.584 -0.046 0.000 1.186 455 A CA 3.492 55.477 52.037 -0.087 0.000 0.620 455 A CB -0.596 18.289 19.000 -0.191 0.000 0.822 455 A HN 0.111 8.221 8.150 -0.067 0.000 0.443 456 K N -1.676 118.718 120.400 -0.010 0.000 2.032 456 K HA -0.341 3.987 4.320 0.013 0.000 0.209 456 K C 3.300 179.905 176.600 0.010 0.000 1.048 456 K CA 3.327 59.625 56.287 0.019 0.000 0.927 456 K CB -0.094 32.443 32.500 0.062 0.000 0.712 456 K HN -0.135 8.117 8.250 0.004 0.000 0.441 457 R N -1.567 118.939 120.500 0.009 0.000 2.148 457 R HA -0.195 4.150 4.340 0.009 0.000 0.227 457 R C 1.862 178.160 176.300 -0.003 0.000 1.103 457 R CA 2.340 58.444 56.100 0.006 0.000 0.983 457 R CB -0.189 30.116 30.300 0.008 0.000 0.874 457 R HN -0.348 7.929 8.270 0.012 0.000 0.451 458 A N -3.285 119.528 122.820 -0.011 0.000 2.235 458 A HA 0.081 4.394 4.320 -0.012 0.000 0.208 458 A C -0.062 177.513 177.584 -0.015 0.000 1.172 458 A CA 0.070 52.097 52.037 -0.015 0.000 0.786 458 A CB -0.022 18.964 19.000 -0.024 0.000 0.804 458 A HN -0.341 7.690 8.150 -0.014 0.110 0.479 459 G N -2.475 106.318 108.800 -0.013 0.000 2.137 459 G HA2 -0.370 3.586 3.960 -0.007 0.000 0.237 459 G HA3 -0.370 3.584 3.960 -0.010 0.000 0.237 459 G C -0.366 174.523 174.900 -0.018 0.000 1.002 459 G CA -0.056 45.037 45.100 -0.011 0.000 0.702 459 G HN -0.646 7.476 8.290 -0.010 0.162 0.515 460 V N 0.118 120.015 119.914 -0.029 0.000 2.788 460 V HA -0.118 3.980 4.120 -0.037 0.000 0.307 460 V C 0.180 176.256 176.094 -0.029 0.000 1.069 460 V CA 0.686 62.962 62.300 -0.040 0.000 1.173 460 V CB 0.348 32.128 31.823 -0.072 0.000 0.925 460 V HN -0.603 7.568 8.190 -0.032 0.000 0.492 461 S N 5.080 120.764 115.700 -0.027 0.000 2.579 461 S HA 0.005 4.469 4.470 -0.010 0.000 0.275 461 S C 1.283 175.877 174.600 -0.010 0.000 1.345 461 S CA -0.373 57.818 58.200 -0.015 0.000 1.031 461 S CB 1.165 64.357 63.200 -0.014 0.000 0.892 461 S HN -0.105 8.187 8.310 -0.030 0.000 0.529 462 E N 2.567 122.767 120.200 0.001 0.000 2.153 462 E HA -0.390 3.973 4.350 0.021 0.000 0.194 462 E C 1.569 178.176 176.600 0.011 0.000 0.988 462 E CA 3.766 60.174 56.400 0.013 0.000 0.811 462 E CB -0.447 29.262 29.700 0.014 0.000 0.746 462 E HN 0.715 9.076 8.360 0.002 0.000 0.466 463 D N -2.239 118.163 120.400 0.002 0.000 2.104 463 D HA -0.246 4.397 4.640 0.005 0.000 0.194 463 D C 2.554 178.853 176.300 -0.002 0.000 0.994 463 D CA 3.183 57.184 54.000 0.001 0.000 0.830 463 D CB -0.581 40.217 40.800 -0.003 0.000 0.959 463 D HN 0.170 8.540 8.370 -0.000 0.000 0.452 464 V N 0.139 120.044 119.914 -0.016 0.000 2.358 464 V HA -0.324 3.780 4.120 -0.027 0.000 0.246 464 V C 1.960 178.029 176.094 -0.042 0.000 1.047 464 V CA 4.018 66.298 62.300 -0.034 0.000 1.035 464 V CB -0.478 31.313 31.823 -0.054 0.000 0.658 464 V HN -0.610 7.569 8.190 -0.018 0.000 0.452 465 L N -1.157 120.048 121.223 -0.030 0.000 2.042 465 L HA -0.536 3.754 4.340 -0.084 0.000 0.210 465 L C 2.107 179.049 176.870 0.120 0.000 1.076 465 L CA 3.464 58.315 54.840 0.018 0.000 0.749 465 L CB -0.934 41.172 42.059 0.077 0.000 0.893 465 L HN -0.071 8.144 8.230 -0.025 0.000 0.432 466 N N -1.934 116.809 118.700 0.072 0.000 2.188 466 N HA -0.316 4.474 4.740 0.083 0.000 0.184 466 N C 2.509 178.055 175.510 0.061 0.000 1.018 466 N CA 2.785 55.873 53.050 0.064 0.000 0.858 466 N CB -0.462 38.041 38.487 0.027 0.000 0.989 466 N HN 0.034 8.442 8.380 0.046 0.000 0.426 467 Q N 0.464 120.288 119.800 0.041 0.000 2.061 467 Q HA -0.343 4.018 4.340 0.035 0.000 0.204 467 Q C 2.158 178.202 176.000 0.073 0.000 0.984 467 Q CA 3.241 59.067 55.803 0.038 0.000 0.846 467 Q CB -0.090 28.656 28.738 0.014 0.000 0.902 467 Q HN -0.346 7.940 8.270 0.027 0.000 0.421 468 A N -0.990 121.879 122.820 0.082 0.000 1.933 468 A HA -0.384 4.004 4.320 0.113 0.000 0.218 468 A C 1.861 179.643 177.584 0.330 0.000 1.175 468 A CA 3.030 55.160 52.037 0.154 0.000 0.628 468 A CB -0.627 18.368 19.000 -0.009 0.000 0.814 468 A HN -0.154 8.024 8.150 0.046 0.000 0.444 469 R N -2.299 118.398 120.500 0.329 0.000 2.096 469 R HA -0.341 4.147 4.340 0.246 0.000 0.235 469 R C 2.645 179.026 176.300 0.135 0.000 1.127 469 R CA 3.678 59.905 56.100 0.212 0.000 0.968 469 R CB -0.189 30.167 30.300 0.093 0.000 0.861 469 R HN -0.010 8.437 8.270 0.295 0.000 0.440 470 E N -0.817 119.445 120.200 0.103 0.000 2.072 470 E HA -0.264 4.115 4.350 0.048 0.000 0.191 470 E C 2.247 178.937 176.600 0.150 0.000 0.985 470 E CA 2.534 58.982 56.400 0.079 0.000 0.801 470 E CB -0.283 29.439 29.700 0.038 0.000 0.750 470 E HN -0.586 7.832 8.360 0.097 0.000 0.452 471 L N -1.104 120.216 121.223 0.162 0.000 2.046 471 L HA -0.383 4.065 4.340 0.180 0.000 0.208 471 L C 1.692 178.714 176.870 0.252 0.000 1.077 471 L CA 3.203 58.154 54.840 0.185 0.000 0.747 471 L CB -0.340 41.805 42.059 0.143 0.000 0.896 471 L HN -0.567 7.752 8.230 0.147 0.000 0.432 472 H N 0.274 119.415 119.070 0.119 0.000 2.352 472 H HA -0.453 4.148 4.556 0.075 0.000 0.299 472 H C 2.088 177.464 175.328 0.080 0.000 1.097 472 H CA 3.012 59.097 56.048 0.063 0.000 1.311 472 H CB 0.501 30.227 29.762 -0.059 0.000 1.377 472 H HN -0.112 8.280 8.280 0.315 0.077 0.504 473 Y N -0.308 120.002 120.300 0.017 0.000 2.081 473 Y HA -0.512 3.930 4.550 -0.180 0.000 0.280 473 Y C 1.583 177.510 175.900 0.046 0.000 1.163 473 Y CA 4.139 62.199 58.100 -0.068 0.000 1.135 473 Y CB -0.282 38.123 38.460 -0.093 0.000 0.970 473 Y HN -0.444 7.982 8.280 0.242 0.000 0.498 474 D N -2.139 118.469 120.400 0.346 0.000 2.103 474 D HA -0.344 4.383 4.640 0.145 0.000 0.199 474 D C 2.161 178.625 176.300 0.274 0.000 0.978 474 D CA 3.313 57.483 54.000 0.284 0.000 0.829 474 D CB -0.770 40.281 40.800 0.418 0.000 0.981 474 D HN -0.522 8.069 8.370 0.369 0.000 0.464 475 A N -0.232 122.777 122.820 0.316 0.000 1.908 475 A HA -0.388 4.141 4.320 0.348 0.000 0.218 475 A C 1.610 179.404 177.584 0.350 0.000 1.181 475 A CA 3.094 55.325 52.037 0.324 0.000 0.627 475 A CB -0.580 18.573 19.000 0.254 0.000 0.818 475 A HN -0.016 8.317 8.150 0.305 0.000 0.445 476 H N -0.224 118.989 119.070 0.239 0.000 2.276 476 H HA -0.319 4.547 4.556 0.516 0.000 0.301 476 H C 2.071 177.485 175.328 0.143 0.000 1.073 476 H CA 4.063 60.276 56.048 0.276 0.000 1.311 476 H CB 0.507 30.294 29.762 0.043 0.000 1.379 476 H HN -0.251 8.261 8.280 0.388 0.000 0.494 477 L N -0.339 120.874 121.223 -0.017 0.000 2.013 477 L HA -0.400 3.823 4.340 -0.195 0.000 0.212 477 L C 1.343 178.089 176.870 -0.207 0.000 1.073 477 L CA 3.215 57.898 54.840 -0.262 0.000 0.753 477 L CB -0.406 41.325 42.059 -0.546 0.000 0.890 477 L HN -0.246 7.946 8.230 -0.064 0.000 0.432 478 Y N -5.791 114.603 120.300 0.157 0.000 2.561 478 Y HA -0.053 4.579 4.550 0.138 0.000 0.291 478 Y C 1.821 177.943 175.900 0.370 0.000 1.141 478 Y CA 1.551 59.778 58.100 0.212 0.000 1.303 478 Y CB -0.686 37.911 38.460 0.229 0.000 1.015 478 Y HN -0.348 7.914 8.280 -0.030 0.000 0.547 479 W N 0.539 121.986 121.300 0.246 0.000 2.633 479 W HA -0.148 4.713 4.660 0.334 0.000 0.295 479 W C 1.013 177.622 176.519 0.150 0.000 1.133 479 W CA 2.164 59.642 57.345 0.222 0.000 1.490 479 W CB 0.904 30.423 29.460 0.099 0.000 1.127 479 W HN -0.636 7.777 8.180 0.440 0.031 0.538 480 E N 2.429 122.168 120.200 -0.767 0.000 2.204 480 E HA -0.342 2.713 4.350 -2.158 0.000 0.194 480 E C 1.932 178.079 176.600 -0.756 0.000 0.989 480 E CA 2.696 58.292 56.400 -1.340 0.000 0.824 480 E CB -0.021 28.982 29.700 -1.163 0.000 0.756 480 E HN 0.145 8.262 8.360 -0.405 0.000 0.477 481 W N -0.378 120.453 121.300 -0.783 0.000 2.308 481 W HA -0.389 3.766 4.660 -0.842 0.000 0.301 481 W C 1.778 177.664 176.519 -1.054 0.000 1.220 481 W CA 3.566 60.324 57.345 -0.979 0.000 1.240 481 W CB -0.034 28.710 29.460 -1.194 0.000 1.142 481 W HN -0.613 7.379 8.180 -0.287 0.016 0.521 482 W N -4.634 116.608 121.300 -0.097 0.000 2.704 482 W HA -0.196 4.474 4.660 0.016 0.000 0.266 482 W C 1.669 178.105 176.519 -0.140 0.000 1.266 482 W CA 2.228 59.541 57.345 -0.054 0.000 1.377 482 W CB 0.202 29.682 29.460 0.033 0.000 1.082 482 W HN -0.320 7.622 8.180 -0.352 0.026 0.608 483 T N -3.210 111.233 114.554 -0.185 0.000 2.904 483 T HA -0.134 4.199 4.350 -0.028 0.000 0.267 483 T C 1.161 175.746 174.700 -0.191 0.000 1.059 483 T CA 2.461 64.461 62.100 -0.167 0.000 1.137 483 T CB -0.615 68.108 68.868 -0.241 0.000 0.879 483 T HN -0.670 7.331 8.240 -0.398 0.000 0.467 484 A N 2.466 125.095 122.820 -0.319 0.000 1.898 484 A HA -0.163 4.075 4.320 -0.137 0.000 0.216 484 A C 0.850 178.305 177.584 -0.215 0.000 1.181 484 A CA 1.375 53.243 52.037 -0.281 0.000 0.620 484 A CB 0.178 18.875 19.000 -0.506 0.000 0.819 484 A HN -0.344 7.540 8.150 -0.443 0.000 0.442 485 E N -1.482 118.547 120.200 -0.286 0.000 2.360 485 E HA -0.071 4.342 4.350 -0.156 -0.156 0.269 485 E C 0.287 176.886 176.600 -0.003 0.000 1.022 485 E CA -0.264 56.035 56.400 -0.168 0.000 0.887 485 E CB 0.553 30.102 29.700 -0.253 0.000 0.990 485 E HN -0.632 7.509 8.360 -0.365 0.000 0.426 486 N N 6.001 124.723 118.700 0.037 0.000 2.412 486 N HA 0.031 4.778 4.740 0.012 0.000 0.184 486 N C 0.300 175.799 175.510 -0.018 0.000 1.101 486 N CA 1.726 54.789 53.050 0.022 0.000 0.881 486 N CB 0.613 39.125 38.487 0.041 0.000 0.969 486 N HN 0.216 8.894 8.380 0.068 -0.258 0.459 487 S N -2.052 113.610 115.700 -0.064 0.000 2.575 487 S HA 0.118 4.487 4.470 -0.168 0.000 0.215 487 S C 0.673 175.291 174.600 0.031 0.000 0.966 487 S CA 0.142 58.240 58.200 -0.170 0.000 0.911 487 S CB 0.841 63.624 63.200 -0.695 0.000 0.780 487 S HN -0.488 8.084 8.310 -0.018 -0.272 0.514 488 V N 0.506 120.486 119.914 0.110 0.000 5.479 488 V HA -0.432 3.814 4.120 0.209 0.000 0.289 488 V C 0.384 176.592 176.094 0.190 0.000 0.595 488 V CA 0.339 62.737 62.300 0.164 0.000 0.649 488 V CB -3.021 28.867 31.823 0.109 0.000 0.390 488 V HN -0.264 7.946 8.190 0.113 0.048 0.974 489 G N -1.649 107.299 108.800 0.248 0.000 2.284 489 G HA2 -0.502 3.574 3.960 0.192 0.000 0.247 489 G HA3 -0.502 3.527 3.960 0.114 0.000 0.247 489 G C 0.696 175.720 174.900 0.205 0.000 1.012 489 G CA 0.827 46.040 45.100 0.190 0.000 0.618 489 G HN -0.068 8.418 8.290 0.327 0.000 0.521 490 F N 2.446 122.448 119.950 0.086 0.000 2.161 490 F HA -0.424 4.191 4.527 0.147 0.000 0.300 490 F C 0.688 176.643 175.800 0.259 0.000 1.089 490 F CA 3.407 61.477 58.000 0.116 0.000 1.282 490 F CB 0.251 39.273 39.000 0.038 0.000 1.010 490 F HN -0.724 7.598 8.300 0.296 0.156 0.485 491 H N -5.323 113.953 119.070 0.344 0.000 2.491 491 H HA -0.268 4.535 4.556 0.411 0.000 0.290 491 H C -0.658 174.839 175.328 0.282 0.000 1.050 491 H CA 2.044 58.313 56.048 0.369 0.000 1.309 491 H CB 0.917 30.930 29.762 0.419 0.000 1.392 491 H HN -0.513 7.904 8.280 0.244 0.011 0.554 492 N N -4.246 114.646 118.700 0.319 0.000 2.946 492 N HA 0.278 5.103 4.740 0.143 0.000 0.213 492 N C -2.635 172.934 175.510 0.098 0.000 1.440 492 N CA -1.571 51.605 53.050 0.210 0.000 0.745 492 N CB -0.074 38.595 38.487 0.304 0.000 1.471 492 N HN -0.721 7.819 8.380 0.307 0.025 0.569 493 P HA 0.036 4.544 4.420 -0.001 -0.088 0.217 493 P C 0.835 178.125 177.300 -0.017 0.000 1.150 493 P CA 2.230 65.331 63.100 0.002 0.000 0.832 493 P CB 0.591 32.297 31.700 0.010 0.000 0.787 494 D N -1.798 118.603 120.400 0.001 0.000 2.178 494 D HA -0.228 4.417 4.640 0.008 0.000 0.202 494 D C 2.041 178.351 176.300 0.018 0.000 0.974 494 D CA 3.448 57.453 54.000 0.008 0.000 0.841 494 D CB -0.739 40.068 40.800 0.012 0.000 0.953 494 D HN 0.245 8.619 8.370 0.006 0.000 0.478 495 Q N 1.077 120.901 119.800 0.040 0.000 2.079 495 Q HA -0.324 4.145 4.340 0.215 0.000 0.200 495 Q C 1.978 177.885 176.000 -0.154 0.000 0.974 495 Q CA 2.993 58.859 55.803 0.105 0.000 0.840 495 Q CB 0.025 28.899 28.738 0.227 0.000 0.898 495 Q HN -0.714 7.779 8.270 0.054 -0.190 0.430 496 A N -0.239 122.229 122.820 -0.587 0.000 1.883 496 A HA -0.436 2.315 4.320 -2.615 0.000 0.217 496 A C 1.524 178.699 177.584 -0.682 0.000 1.186 496 A CA 3.472 54.658 52.037 -1.420 0.000 0.624 496 A CB -0.865 17.411 19.000 -1.207 0.000 0.822 496 A HN -0.267 7.632 8.150 -0.419 0.000 0.444 497 R N -1.552 118.783 120.500 -0.275 0.000 2.083 497 R HA -0.384 3.906 4.340 -0.083 0.000 0.237 497 R C 1.791 178.069 176.300 -0.036 0.000 1.137 497 R CA 3.561 59.620 56.100 -0.069 0.000 0.951 497 R CB -0.128 30.230 30.300 0.098 0.000 0.851 497 R HN -0.388 7.758 8.270 -0.207 0.000 0.434 498 E N -1.583 118.625 120.200 0.013 0.000 2.077 498 E HA -0.330 4.041 4.350 0.035 0.000 0.193 498 E C 2.244 178.939 176.600 0.159 0.000 0.989 498 E CA 3.217 59.668 56.400 0.085 0.000 0.800 498 E CB -0.093 29.684 29.700 0.129 0.000 0.746 498 E HN -0.530 7.838 8.360 0.014 0.000 0.452 499 S N 0.600 116.422 115.700 0.204 0.000 2.348 499 S HA -0.210 4.428 4.470 0.280 0.000 0.221 499 S C 2.220 176.922 174.600 0.170 0.000 1.033 499 S CA 3.629 61.961 58.200 0.219 0.000 1.010 499 S CB -0.339 63.038 63.200 0.294 0.000 0.891 499 S HN -0.364 8.020 8.310 0.124 0.000 0.442 500 L N 1.381 122.615 121.223 0.020 0.000 2.083 500 L HA -0.303 4.162 4.340 0.207 0.000 0.209 500 L C 2.588 179.502 176.870 0.074 0.000 1.083 500 L CA 3.042 57.926 54.840 0.075 0.000 0.752 500 L CB -0.104 41.919 42.059 -0.060 0.000 0.899 500 L HN -0.001 8.143 8.230 -0.144 0.000 0.433 501 M N -2.148 117.466 119.600 0.023 0.000 2.213 501 M HA -0.438 4.041 4.480 -0.002 0.000 0.263 501 M C 2.362 178.669 176.300 0.012 0.000 1.062 501 M CA 4.277 59.581 55.300 0.007 0.000 1.105 501 M CB -0.329 32.268 32.600 -0.004 0.000 1.385 501 M HN -0.254 8.038 8.290 0.003 0.000 0.417 502 T N 2.134 116.705 114.554 0.028 0.000 2.777 502 T HA -0.326 4.014 4.350 -0.018 0.000 0.266 502 T C 1.718 176.491 174.700 0.121 0.000 1.040 502 T CA 5.078 67.184 62.100 0.010 0.000 1.141 502 T CB -0.717 68.068 68.868 -0.138 0.000 0.868 502 T HN -0.347 7.821 8.240 0.039 0.095 0.444 503 S N 3.225 119.063 115.700 0.230 0.000 2.359 503 S HA -0.347 4.342 4.470 0.365 0.000 0.223 503 S C 1.851 176.553 174.600 0.169 0.000 1.039 503 S CA 3.991 62.368 58.200 0.295 0.000 1.042 503 S CB -0.658 62.767 63.200 0.375 0.000 0.915 503 S HN -0.327 8.130 8.310 0.244 0.000 0.439 504 I N 0.222 120.850 120.570 0.097 0.000 2.208 504 I HA -0.588 3.591 4.170 0.016 0.000 0.245 504 I C 1.453 177.479 176.117 -0.153 0.000 1.097 504 I CA 4.477 65.756 61.300 -0.034 0.000 1.363 504 I CB -0.212 37.738 38.000 -0.084 0.000 1.051 504 I HN -0.325 7.949 8.210 0.106 0.000 0.413 505 S N 0.489 116.134 115.700 -0.091 0.000 2.368 505 S HA -0.306 4.061 4.470 -0.172 0.000 0.225 505 S C 2.255 176.824 174.600 -0.052 0.000 1.030 505 S CA 3.816 61.954 58.200 -0.103 0.000 0.999 505 S CB -0.748 62.416 63.200 -0.060 0.000 0.844 505 S HN -0.354 7.929 8.310 -0.045 0.000 0.459 506 K N 1.456 121.877 120.400 0.034 0.000 2.025 506 K HA -0.168 4.194 4.320 0.070 0.000 0.207 506 K C 2.521 179.161 176.600 0.066 0.000 1.049 506 K CA 2.615 58.953 56.287 0.084 0.000 0.933 506 K CB -0.505 32.105 32.500 0.183 0.000 0.714 506 K HN -0.154 8.136 8.250 0.067 0.000 0.438 507 S N 0.708 116.449 115.700 0.069 0.000 2.368 507 S HA -0.204 4.321 4.470 0.091 0.000 0.225 507 S C 2.229 176.862 174.600 0.056 0.000 1.030 507 S CA 3.641 61.894 58.200 0.089 0.000 0.999 507 S CB -0.608 62.691 63.200 0.166 0.000 0.844 507 S HN -0.147 8.209 8.310 0.078 0.000 0.459 508 K N 1.175 121.507 120.400 -0.114 0.000 2.063 508 K HA -0.392 3.820 4.320 -0.179 0.000 0.208 508 K C 1.761 178.314 176.600 -0.079 0.000 1.048 508 K CA 3.656 59.804 56.287 -0.232 0.000 0.928 508 K CB -0.219 31.967 32.500 -0.524 0.000 0.713 508 K HN -0.134 8.002 8.250 -0.190 0.000 0.442 509 E N -0.720 119.447 120.200 -0.056 0.000 2.077 509 E HA -0.336 3.995 4.350 -0.032 0.000 0.193 509 E C 2.085 178.686 176.600 0.001 0.000 0.989 509 E CA 2.973 59.360 56.400 -0.022 0.000 0.800 509 E CB -0.061 29.636 29.700 -0.005 0.000 0.746 509 E HN -0.575 7.748 8.360 -0.061 0.000 0.452 510 A N -0.796 122.038 122.820 0.023 0.000 1.930 510 A HA -0.350 3.975 4.320 0.008 0.000 0.217 510 A C 1.653 179.235 177.584 -0.003 0.000 1.175 510 A CA 3.287 55.337 52.037 0.021 0.000 0.627 510 A CB -0.382 18.655 19.000 0.062 0.000 0.815 510 A HN -0.355 7.815 8.150 0.033 0.000 0.443 511 V N -1.154 118.784 119.914 0.039 0.000 2.343 511 V HA -0.515 3.615 4.120 0.017 0.000 0.247 511 V C 1.766 177.874 176.094 0.024 0.000 1.051 511 V CA 4.894 67.227 62.300 0.054 0.000 1.036 511 V CB -0.901 31.035 31.823 0.188 0.000 0.654 511 V HN -0.085 8.143 8.190 0.063 0.000 0.451 512 S N 0.553 116.267 115.700 0.023 0.000 2.356 512 S HA -0.284 4.195 4.470 0.016 0.000 0.223 512 S C 1.779 176.368 174.600 -0.018 0.000 1.032 512 S CA 3.504 61.708 58.200 0.006 0.000 1.005 512 S CB -0.425 62.774 63.200 -0.001 0.000 0.867 512 S HN -0.492 7.833 8.310 0.024 0.000 0.449 513 L N 2.128 123.334 121.223 -0.029 0.000 1.989 513 L HA -0.343 3.975 4.340 -0.037 0.000 0.211 513 L C 1.380 178.205 176.870 -0.075 0.000 1.071 513 L CA 3.272 58.084 54.840 -0.046 0.000 0.749 513 L CB -0.087 41.944 42.059 -0.045 0.000 0.890 513 L HN -0.402 7.814 8.230 -0.023 0.000 0.431 514 L N -2.349 118.810 121.223 -0.107 0.000 2.056 514 L HA -0.492 3.744 4.340 -0.173 0.000 0.207 514 L C 2.209 179.018 176.870 -0.102 0.000 1.078 514 L CA 3.320 58.067 54.840 -0.155 0.000 0.749 514 L CB -0.755 41.154 42.059 -0.250 0.000 0.901 514 L HN -0.132 8.038 8.230 -0.101 0.000 0.433 515 N N -0.590 118.072 118.700 -0.064 0.000 2.104 515 N HA -0.321 4.391 4.740 -0.047 0.000 0.190 515 N C 2.244 177.733 175.510 -0.036 0.000 1.024 515 N CA 3.220 56.246 53.050 -0.041 0.000 0.853 515 N CB -0.590 37.889 38.487 -0.014 0.000 1.008 515 N HN -0.089 8.259 8.380 -0.054 0.000 0.424 516 D N -0.184 120.197 120.400 -0.033 0.000 2.117 516 D HA -0.204 4.423 4.640 -0.021 0.000 0.198 516 D C 1.843 178.122 176.300 -0.034 0.000 0.982 516 D CA 3.297 57.281 54.000 -0.027 0.000 0.828 516 D CB -0.512 40.274 40.800 -0.023 0.000 0.967 516 D HN -0.233 8.117 8.370 -0.033 0.000 0.464 517 A N -0.571 122.220 122.820 -0.048 0.000 1.930 517 A HA -0.188 4.107 4.320 -0.041 0.000 0.217 517 A C 2.248 179.802 177.584 -0.049 0.000 1.175 517 A CA 2.893 54.899 52.037 -0.051 0.000 0.627 517 A CB -0.481 18.478 19.000 -0.069 0.000 0.815 517 A HN -0.544 7.572 8.150 -0.057 0.000 0.443 518 I N -1.291 119.245 120.570 -0.056 0.000 2.202 518 I HA -0.604 3.538 4.170 -0.047 0.000 0.242 518 I C 1.461 177.559 176.117 -0.032 0.000 1.091 518 I CA 4.545 65.817 61.300 -0.047 0.000 1.368 518 I CB -0.182 37.787 38.000 -0.051 0.000 1.058 518 I HN -0.164 8.007 8.210 -0.064 0.000 0.410 519 D N 0.115 120.498 120.400 -0.028 0.000 2.149 519 D HA -0.302 4.327 4.640 -0.018 0.000 0.198 519 D C 1.883 178.172 176.300 -0.018 0.000 0.990 519 D CA 3.064 57.051 54.000 -0.020 0.000 0.839 519 D CB -0.573 40.217 40.800 -0.017 0.000 0.948 519 D HN -0.354 7.997 8.370 -0.031 0.000 0.460 520 A N -0.983 121.825 122.820 -0.020 0.000 1.969 520 A HA -0.167 4.144 4.320 -0.015 0.000 0.218 520 A C 1.544 179.118 177.584 -0.017 0.000 1.169 520 A CA 2.125 54.151 52.037 -0.018 0.000 0.635 520 A CB -0.207 18.782 19.000 -0.019 0.000 0.810 520 A HN -0.366 7.759 8.150 -0.024 0.011 0.445 521 Q N -2.674 117.114 119.800 -0.020 0.000 2.123 521 Q HA -0.180 4.151 4.340 -0.016 0.000 0.199 521 Q C 1.296 177.288 176.000 -0.014 0.000 0.966 521 Q CA 0.803 56.596 55.803 -0.017 0.000 0.845 521 Q CB 0.334 29.060 28.738 -0.021 0.000 0.907 521 Q HN -0.358 7.806 8.270 -0.023 0.092 0.439 522 V N 0.000 119.905 119.914 -0.015 0.000 2.409 522 V HA 0.000 4.114 4.120 -0.011 0.000 0.244 522 V CA 0.000 62.293 62.300 -0.012 0.000 1.235 522 V CB 0.000 31.816 31.823 -0.013 0.000 1.184 522 V HN 0.000 8.180 8.190 -0.017 0.000 0.556