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 3d1i_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 NDAIDAQVA 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 4.711 4.740 -0.049 0.000 0.220 5 N C 0.000 175.471 175.510 -0.064 0.000 1.280 5 N CA 0.000 53.022 53.050 -0.047 0.000 0.885 5 N CB 0.000 38.465 38.487 -0.038 0.000 1.341 6 L N 0.829 121.996 121.223 -0.094 0.000 2.490 6 L HA -0.061 4.205 4.340 -0.122 0.000 0.274 6 L C -0.594 176.212 176.870 -0.108 0.000 1.201 6 L CA 0.402 55.161 54.840 -0.135 0.000 0.869 6 L CB 0.378 42.284 42.059 -0.255 0.000 1.123 6 L HN 0.030 8.202 8.230 -0.097 0.000 0.484 7 K N 3.349 123.692 120.400 -0.095 0.000 2.323 7 K HA 0.406 4.690 4.320 -0.060 0.000 0.259 7 K C -1.903 174.653 176.600 -0.073 0.000 0.947 7 K CA -3.326 52.920 56.287 -0.068 0.000 0.819 7 K CB -0.245 32.226 32.500 -0.049 0.000 1.109 7 K HN 0.043 8.236 8.250 -0.096 0.000 0.429 8 P HA -0.008 4.522 4.420 -0.060 -0.145 0.271 8 P C -1.020 176.253 177.300 -0.044 0.000 1.218 8 P CA -0.737 62.334 63.100 -0.048 0.000 0.780 8 P CB 0.370 32.058 31.700 -0.020 0.000 0.901 9 V N -2.522 117.363 119.914 -0.048 0.000 3.096 9 V HA 0.259 4.349 4.120 -0.050 0.000 0.319 9 V C -1.111 174.939 176.094 -0.074 0.000 1.082 9 V CA -2.980 59.286 62.300 -0.057 0.000 1.022 9 V CB 1.874 33.661 31.823 -0.059 0.000 1.103 9 V HN -0.001 8.479 8.190 -0.048 -0.318 0.455 10 D N 0.829 121.180 120.400 -0.082 0.000 2.435 10 D HA 0.005 4.595 4.640 -0.083 0.000 0.230 10 D C 0.159 176.350 176.300 -0.182 0.000 1.215 10 D CA -0.563 53.378 54.000 -0.099 0.000 0.947 10 D CB -0.229 40.527 40.800 -0.075 0.000 1.048 10 D HN 0.239 8.565 8.370 -0.074 0.000 0.512 11 A N 7.359 130.026 122.820 -0.255 0.000 1.972 11 A HA -0.220 3.769 4.320 -0.552 0.000 0.219 11 A C 1.256 178.378 177.584 -0.769 0.000 1.169 11 A CA 2.491 54.190 52.037 -0.562 0.000 0.635 11 A CB 0.019 18.661 19.000 -0.597 0.000 0.810 11 A HN 0.148 8.184 8.150 -0.191 0.000 0.446 12 M N -3.189 116.204 119.600 -0.345 0.000 2.213 12 M HA -0.368 4.102 4.480 -0.018 0.000 0.263 12 M C 1.837 178.086 176.300 -0.086 0.000 1.062 12 M CA 2.098 57.327 55.300 -0.119 0.000 1.105 12 M CB -1.341 31.270 32.600 0.020 0.000 1.385 12 M HN -0.478 7.803 8.290 -0.217 -0.121 0.417 13 Q N 0.634 120.363 119.800 -0.119 0.000 2.084 13 Q HA -0.254 4.061 4.340 -0.043 0.000 0.202 13 Q C 2.911 178.862 176.000 -0.081 0.000 0.978 13 Q CA 3.016 58.772 55.803 -0.079 0.000 0.844 13 Q CB -0.208 28.483 28.738 -0.078 0.000 0.898 13 Q HN -0.422 7.930 8.270 -0.135 -0.164 0.426 14 C N 0.142 119.347 119.300 -0.159 0.000 2.401 14 C HA -0.295 4.186 4.460 0.034 0.000 0.276 14 C C 2.664 177.716 174.990 0.103 0.000 1.233 14 C CA 4.127 63.111 59.018 -0.057 0.000 1.753 14 C CB -1.874 25.744 27.740 -0.203 0.000 2.029 14 C HN -0.574 7.513 8.230 -0.238 0.000 0.478 15 F N -3.212 116.761 119.950 0.040 0.000 2.451 15 F HA -0.183 4.388 4.527 0.073 0.000 0.299 15 F C 0.750 176.555 175.800 0.007 0.000 1.101 15 F CA -0.264 57.759 58.000 0.039 0.000 1.436 15 F CB -1.371 37.645 39.000 0.026 0.000 1.074 15 F HN -0.289 7.799 8.300 -0.193 0.096 0.553 16 D N -2.088 118.400 120.400 0.146 0.000 2.265 16 D HA -0.153 4.525 4.640 0.063 0.000 0.208 16 D C 0.414 176.710 176.300 -0.007 0.000 0.977 16 D CA 2.413 56.443 54.000 0.051 0.000 0.871 16 D CB 0.145 40.950 40.800 0.009 0.000 0.925 16 D HN -0.497 7.913 8.370 0.110 0.026 0.485 17 C N -4.935 114.331 119.300 -0.056 0.000 3.336 17 C HA 0.112 4.480 4.460 -0.154 0.000 0.291 17 C C -0.886 173.926 174.990 -0.298 0.000 1.363 17 C CA -1.047 57.843 59.018 -0.213 0.000 1.737 17 C CB 0.446 27.967 27.740 -0.365 0.000 2.274 17 C HN -0.639 7.548 8.230 -0.026 0.027 0.663 18 H N 0.918 120.049 119.070 0.101 0.000 2.439 18 H HA 0.287 4.889 4.556 0.076 0.000 0.230 18 H C 0.283 175.666 175.328 0.091 0.000 1.420 18 H CA -1.050 55.063 56.048 0.108 0.000 1.305 18 H CB 0.533 30.370 29.762 0.125 0.000 1.667 18 H HN -0.673 7.573 8.280 0.160 0.130 0.515 19 T N 2.083 116.700 114.554 0.106 0.000 2.867 19 T HA -0.200 4.140 4.350 -0.016 0.000 0.268 19 T C 1.724 176.419 174.700 -0.007 0.000 1.057 19 T CA 3.829 65.940 62.100 0.018 0.000 1.136 19 T CB 0.258 69.125 68.868 -0.002 0.000 0.874 19 T HN 0.142 8.427 8.240 0.074 0.000 0.466 20 Q N 1.543 121.370 119.800 0.046 0.000 2.050 20 Q HA -0.279 4.058 4.340 -0.005 0.000 0.202 20 Q C 1.544 177.569 176.000 0.042 0.000 0.980 20 Q CA 3.594 59.418 55.803 0.035 0.000 0.840 20 Q CB -0.429 28.351 28.738 0.070 0.000 0.898 20 Q HN 0.176 8.480 8.270 0.082 0.015 0.424 21 I N -2.333 118.270 120.570 0.055 0.000 2.252 21 I HA -0.390 3.764 4.170 -0.027 0.000 0.245 21 I C 1.935 178.001 176.117 -0.084 0.000 1.102 21 I CA 1.875 63.159 61.300 -0.028 0.000 1.385 21 I CB -1.334 36.581 38.000 -0.142 0.000 1.064 21 I HN -0.234 8.038 8.210 0.104 0.000 0.414 22 E N 1.882 121.903 120.200 -0.299 0.000 2.086 22 E HA -0.536 2.807 4.350 -1.678 0.000 0.200 22 E C 2.102 178.450 176.600 -0.420 0.000 1.012 22 E CA 3.805 59.657 56.400 -0.914 0.000 0.812 22 E CB -0.218 28.902 29.700 -0.967 0.000 0.743 22 E HN 0.016 8.282 8.360 -0.157 0.000 0.453 23 D N -3.243 117.036 120.400 -0.202 0.000 2.219 23 D HA -0.153 4.416 4.640 -0.119 0.000 0.205 23 D C 1.510 177.790 176.300 -0.033 0.000 0.970 23 D CA 2.381 56.319 54.000 -0.104 0.000 0.851 23 D CB -0.223 40.538 40.800 -0.064 0.000 0.943 23 D HN -0.304 7.968 8.370 -0.164 0.000 0.488 24 M N -1.671 117.940 119.600 0.018 0.000 2.216 24 M HA -0.132 4.393 4.480 0.074 0.000 0.264 24 M C 1.394 177.777 176.300 0.140 0.000 1.080 24 M CA 3.269 58.627 55.300 0.097 0.000 1.153 24 M CB 0.711 33.414 32.600 0.173 0.000 1.356 24 M HN -0.768 7.420 8.290 0.011 0.109 0.432 25 H N 0.603 119.714 119.070 0.070 0.000 2.357 25 H HA -0.130 4.788 4.556 0.219 -0.231 0.301 25 H C 2.648 178.039 175.328 0.104 0.000 1.082 25 H CA 4.029 60.171 56.048 0.157 0.000 1.342 25 H CB 1.374 31.298 29.762 0.270 0.000 1.389 25 H HN 0.233 8.644 8.280 0.218 0.000 0.511 26 T N -3.701 110.919 114.554 0.110 0.000 3.035 26 T HA -0.136 4.305 4.350 0.151 0.000 0.268 26 T C 1.385 176.098 174.700 0.023 0.000 1.109 26 T CA 3.175 65.319 62.100 0.073 0.000 1.119 26 T CB -0.286 68.576 68.868 -0.010 0.000 0.900 26 T HN -0.192 8.066 8.240 0.029 0.000 0.503 27 V N 0.298 120.217 119.914 0.008 0.000 2.949 27 V HA 0.033 4.156 4.120 0.005 0.000 0.245 27 V C 0.704 176.798 176.094 -0.001 0.000 1.086 27 V CA 0.918 63.221 62.300 0.004 0.000 1.097 27 V CB 0.747 32.572 31.823 0.004 0.000 0.762 27 V HN -0.729 7.425 8.190 0.014 0.045 0.470 28 G N -1.265 107.530 108.800 -0.008 0.000 2.510 28 G HA2 0.177 4.127 3.960 -0.017 0.000 0.280 28 G HA3 0.177 4.305 3.960 -0.026 -0.183 0.280 28 G C -0.468 174.411 174.900 -0.036 0.000 1.386 28 G CA -0.795 44.291 45.100 -0.023 0.000 1.047 28 G HN -0.871 7.416 8.290 -0.004 0.000 0.527 29 K N -1.175 119.190 120.400 -0.058 0.000 2.458 29 K HA 0.006 4.324 4.320 -0.004 0.000 0.194 29 K C 0.177 176.812 176.600 0.058 0.000 1.024 29 K CA 1.050 57.322 56.287 -0.026 0.000 1.108 29 K CB 0.028 32.501 32.500 -0.046 0.000 0.846 29 K HN -0.104 8.092 8.250 -0.090 0.000 0.518 30 H N -2.426 116.582 119.070 -0.104 0.000 2.505 30 H HA 0.263 4.758 4.556 -0.100 0.000 0.286 30 H C 0.333 175.428 175.328 -0.389 0.000 1.072 30 H CA -1.126 54.827 56.048 -0.159 0.000 1.141 30 H CB 0.105 29.808 29.762 -0.098 0.000 1.550 30 H HN -0.129 8.094 8.280 -0.001 0.056 0.547 31 A N 0.252 122.954 122.820 -0.196 0.000 2.024 31 A HA -0.210 3.938 4.320 -0.520 -0.140 0.220 31 A C 0.337 177.909 177.584 -0.020 0.000 1.164 31 A CA 2.800 54.700 52.037 -0.229 0.000 0.643 31 A CB -0.086 18.894 19.000 -0.033 0.000 0.806 31 A HN -0.752 7.288 8.150 -0.092 0.054 0.451 32 T N -7.289 107.272 114.554 0.013 0.000 3.107 32 T HA -0.098 4.317 4.350 0.107 0.000 0.249 32 T C 0.027 174.773 174.700 0.077 0.000 1.096 32 T CA 0.251 62.392 62.100 0.068 0.000 1.012 32 T CB 0.039 68.929 68.868 0.037 0.000 0.977 32 T HN -0.302 7.913 8.240 -0.005 0.022 0.527 33 V N 5.237 125.185 119.914 0.056 0.000 2.368 33 V HA -0.056 4.045 4.120 -0.033 0.000 0.266 33 V C -1.206 175.038 176.094 0.249 0.000 1.045 33 V CA -0.147 62.167 62.300 0.023 0.000 0.899 33 V CB -0.037 31.633 31.823 -0.255 0.000 1.006 33 V HN -0.240 7.789 8.190 0.012 0.169 0.470 34 N N 6.713 125.561 118.700 0.246 0.000 2.479 34 N HA -0.096 4.744 4.740 0.167 0.000 0.257 34 N C 1.153 176.776 175.510 0.188 0.000 1.232 34 N CA 0.703 53.874 53.050 0.201 0.000 0.920 34 N CB 2.159 40.724 38.487 0.130 0.000 1.105 34 N HN 0.214 8.744 8.380 0.250 0.000 0.444 35 C N 2.626 121.975 119.300 0.082 0.000 2.410 35 C HA -0.205 4.368 4.460 0.187 0.000 0.281 35 C C 2.271 177.322 174.990 0.102 0.000 1.318 35 C CA 1.571 60.658 59.018 0.115 0.000 1.776 35 C CB -1.544 26.218 27.740 0.037 0.000 1.942 35 C HN 0.806 9.042 8.230 0.010 0.000 0.508 36 V N 1.518 121.441 119.914 0.014 0.000 2.828 36 V HA -0.382 3.911 4.120 -0.024 -0.187 0.260 36 V C 0.631 176.637 176.094 -0.146 0.000 1.101 36 V CA 2.789 65.048 62.300 -0.069 0.000 1.123 36 V CB -0.025 31.721 31.823 -0.129 0.000 0.704 36 V HN -0.573 7.875 8.190 0.001 -0.258 0.493 37 H N -2.574 116.468 119.070 -0.047 0.000 2.456 37 H HA -0.194 4.313 4.556 -0.081 0.000 0.296 37 H C 0.446 175.702 175.328 -0.120 0.000 1.079 37 H CA 3.377 59.374 56.048 -0.084 0.000 1.322 37 H CB 0.406 30.107 29.762 -0.102 0.000 1.388 37 H HN -0.572 7.706 8.280 0.049 0.031 0.538 38 C N -6.611 112.645 119.300 -0.073 0.000 3.882 38 C HA 0.227 4.571 4.460 -0.194 0.000 0.340 38 C C -1.810 172.929 174.990 -0.418 0.000 1.563 38 C CA -0.187 58.668 59.018 -0.271 0.000 1.870 38 C CB 1.917 29.412 27.740 -0.409 0.000 2.795 38 C HN -0.354 7.821 8.230 -0.045 0.028 0.692 39 H N -0.856 118.202 119.070 -0.019 0.000 2.717 39 H HA 0.851 5.609 4.556 -0.033 -0.221 0.366 39 H C -2.231 173.078 175.328 -0.032 0.000 1.132 39 H CA -1.351 54.678 56.048 -0.031 0.000 1.180 39 H CB 3.626 33.366 29.762 -0.037 0.000 1.678 39 H HN -0.189 8.088 8.280 -0.005 0.000 0.537 40 D N 2.035 122.496 120.400 0.101 0.000 2.460 40 D HA 0.309 4.973 4.640 0.039 0.000 0.232 40 D C -1.321 175.015 176.300 0.058 0.000 1.079 40 D CA -0.851 53.181 54.000 0.053 0.000 0.864 40 D CB 0.791 41.609 40.800 0.029 0.000 1.048 40 D HN -0.100 8.333 8.370 0.105 0.000 0.523 41 A N 6.341 129.199 122.820 0.063 0.000 2.564 41 A HA 0.319 4.704 4.320 0.109 0.000 0.279 41 A C 0.459 178.103 177.584 0.099 0.000 1.232 41 A CA -0.409 51.689 52.037 0.102 0.000 0.950 41 A CB 1.054 20.125 19.000 0.118 0.000 1.138 41 A HN 0.538 8.720 8.150 0.053 0.000 0.526 42 T N 1.933 116.518 114.554 0.052 0.000 2.674 42 T HA -0.438 3.920 4.350 0.014 0.000 0.265 42 T C 1.576 176.294 174.700 0.031 0.000 1.039 42 T CA 5.662 67.777 62.100 0.026 0.000 1.150 42 T CB -0.056 68.818 68.868 0.010 0.000 0.864 42 T HN -0.604 7.854 8.240 0.042 -0.192 0.427 43 E N -1.603 118.625 120.200 0.046 0.000 2.107 43 E HA -0.276 4.087 4.350 0.022 0.000 0.191 43 E C 1.372 178.014 176.600 0.070 0.000 0.982 43 E CA 2.832 59.258 56.400 0.043 0.000 0.809 43 E CB -0.339 29.385 29.700 0.040 0.000 0.756 43 E HN 0.239 8.628 8.360 0.050 0.000 0.459 44 H N 0.852 119.918 119.070 -0.007 0.000 2.265 44 H HA -0.308 4.374 4.556 -0.005 -0.129 0.295 44 H C 2.055 177.377 175.328 -0.009 0.000 1.084 44 H CA 2.893 58.938 56.048 -0.006 0.000 1.261 44 H CB -0.385 29.374 29.762 -0.004 0.000 1.360 44 H HN -0.343 8.053 8.280 0.194 0.000 0.487 45 V N -1.631 118.209 119.914 -0.124 0.000 2.392 45 V HA -0.436 3.481 4.120 -0.338 0.000 0.249 45 V C 1.251 177.265 176.094 -0.134 0.000 1.059 45 V CA 3.273 65.454 62.300 -0.198 0.000 1.051 45 V CB -0.198 31.565 31.823 -0.100 0.000 0.658 45 V HN -0.073 8.122 8.190 0.009 0.000 0.455 46 E N -3.354 116.803 120.200 -0.071 0.000 2.204 46 E HA -0.116 4.202 4.350 -0.054 0.000 0.194 46 E C 1.182 177.750 176.600 -0.054 0.000 0.989 46 E CA 2.098 58.467 56.400 -0.051 0.000 0.824 46 E CB 0.187 29.872 29.700 -0.025 0.000 0.756 46 E HN -0.547 7.692 8.360 -0.044 0.095 0.477 47 T N -5.978 108.540 114.554 -0.060 0.000 2.975 47 T HA 0.088 4.416 4.350 -0.036 0.000 0.257 47 T C -0.078 174.586 174.700 -0.060 0.000 1.003 47 T CA -0.084 61.992 62.100 -0.041 0.000 0.932 47 T CB 1.757 70.622 68.868 -0.004 0.000 1.087 47 T HN -0.454 7.593 8.240 -0.072 0.150 0.512 48 A N 2.687 125.428 122.820 -0.132 0.000 2.304 48 A HA 0.384 4.795 4.320 -0.070 -0.132 0.271 48 A C -0.938 176.575 177.584 -0.117 0.000 1.091 48 A CA -1.256 50.695 52.037 -0.144 0.000 0.812 48 A CB 1.149 19.940 19.000 -0.348 0.000 1.056 48 A HN -0.318 7.718 8.150 -0.190 0.000 0.489 49 S N 1.173 116.822 115.700 -0.086 0.000 2.715 49 S HA 0.328 4.743 4.470 -0.091 0.000 0.307 49 S C 1.634 176.181 174.600 -0.090 0.000 1.119 49 S CA -1.544 56.607 58.200 -0.081 0.000 0.937 49 S CB 2.378 65.546 63.200 -0.054 0.000 1.150 49 S HN -0.034 8.238 8.310 -0.063 0.000 0.521 50 S N 0.752 116.399 115.700 -0.088 0.000 2.500 50 S HA -0.123 4.266 4.470 -0.134 0.000 0.239 50 S C 0.919 175.479 174.600 -0.066 0.000 0.989 50 S CA 2.114 60.256 58.200 -0.096 0.000 0.951 50 S CB -0.415 62.737 63.200 -0.080 0.000 0.759 50 S HN 0.465 8.727 8.310 -0.079 0.000 0.523 51 R N -0.554 119.918 120.500 -0.046 0.000 2.508 51 R HA 0.263 4.587 4.340 -0.026 0.000 0.300 51 R C -1.516 174.773 176.300 -0.019 0.000 0.970 51 R CA -0.552 55.531 56.100 -0.029 0.000 1.102 51 R CB 1.418 31.703 30.300 -0.025 0.000 1.246 51 R HN -0.643 7.548 8.270 -0.047 0.052 0.539 52 R N -0.003 120.487 120.500 -0.017 0.000 2.508 52 R HA 0.271 4.610 4.340 -0.001 0.000 0.283 52 R C -0.918 175.395 176.300 0.022 0.000 1.120 52 R CA -0.291 55.807 56.100 -0.004 0.000 0.958 52 R CB 2.577 32.869 30.300 -0.012 0.000 1.215 52 R HN -0.587 7.569 8.270 -0.025 0.099 0.427 53 M N 6.028 125.659 119.600 0.052 0.000 2.149 53 M HA -0.319 4.290 4.480 0.215 0.000 0.261 53 M C 0.159 176.560 176.300 0.169 0.000 1.064 53 M CA 3.077 58.459 55.300 0.137 0.000 1.102 53 M CB 0.186 32.832 32.600 0.077 0.000 1.369 53 M HN 0.472 8.782 8.290 0.033 0.000 0.408 54 G N -4.035 104.812 108.800 0.079 0.000 2.552 54 G HA2 -0.498 3.484 3.960 0.036 0.000 0.265 54 G HA3 -0.498 3.500 3.960 0.063 0.000 0.265 54 G C -0.588 174.368 174.900 0.094 0.000 1.234 54 G CA -0.394 44.747 45.100 0.068 0.000 0.944 54 G HN -0.261 8.038 8.290 0.047 0.019 0.568 55 E N 2.422 122.683 120.200 0.101 0.000 2.414 55 E HA -0.198 4.181 4.350 0.048 0.000 0.263 55 E C -0.491 176.161 176.600 0.087 0.000 1.000 55 E CA -0.044 56.404 56.400 0.080 0.000 0.914 55 E CB 0.739 30.481 29.700 0.070 0.000 0.948 55 E HN -0.198 8.216 8.360 0.090 0.000 0.444 56 R N 3.826 124.334 120.500 0.013 0.000 2.316 56 R HA -0.012 4.259 4.340 -0.114 0.000 0.314 56 R C -1.636 174.615 176.300 -0.082 0.000 1.069 56 R CA -1.927 54.136 56.100 -0.062 0.000 0.959 56 R CB 0.342 30.617 30.300 -0.043 0.000 0.987 56 R HN 0.275 8.551 8.270 0.011 0.000 0.446 57 P HA 0.032 4.516 4.420 -0.038 -0.087 0.274 57 P C -1.731 175.542 177.300 -0.044 0.000 1.237 57 P CA -0.487 62.535 63.100 -0.130 0.000 0.793 57 P CB 1.487 33.014 31.700 -0.288 0.000 0.977 58 V N 1.392 121.318 119.914 0.022 0.000 2.509 58 V HA 0.039 4.186 4.120 0.043 0.000 0.284 58 V C -0.419 175.735 176.094 0.101 0.000 1.047 58 V CA -0.070 62.260 62.300 0.050 0.000 0.952 58 V CB 1.033 32.881 31.823 0.043 0.000 0.988 58 V HN 0.116 8.324 8.190 0.030 0.000 0.469 59 T N 7.843 122.449 114.554 0.087 0.000 2.812 59 T HA 0.430 4.970 4.350 0.024 -0.176 0.282 59 T C -0.901 173.784 174.700 -0.025 0.000 0.990 59 T CA -1.078 61.049 62.100 0.045 0.000 0.960 59 T CB 1.534 70.452 68.868 0.083 0.000 0.948 59 T HN 0.157 8.440 8.240 0.071 0.000 0.438 60 R N 7.301 127.743 120.500 -0.097 0.000 2.347 60 R HA -0.034 4.314 4.340 0.014 0.000 0.304 60 R C -0.451 175.841 176.300 -0.013 0.000 1.072 60 R CA 0.848 56.924 56.100 -0.041 0.000 0.980 60 R CB 0.507 30.767 30.300 -0.067 0.000 0.986 60 R HN 0.673 8.729 8.270 -0.175 0.110 0.448 61 M N 1.673 121.330 119.600 0.095 0.000 2.337 61 M HA 0.071 4.785 4.480 0.390 0.000 0.256 61 M C -1.190 175.140 176.300 0.050 0.000 1.075 61 M CA -2.333 53.120 55.300 0.254 0.000 1.024 61 M CB -0.336 32.480 32.600 0.360 0.000 1.429 61 M HN 0.329 8.689 8.290 0.117 0.000 0.497 62 D N -2.113 118.142 120.400 -0.242 0.000 2.399 62 D HA -0.162 3.565 4.640 -1.522 0.000 0.241 62 D C 1.099 177.214 176.300 -0.309 0.000 1.133 62 D CA -0.149 53.422 54.000 -0.714 0.000 0.890 62 D CB 0.790 41.292 40.800 -0.497 0.000 1.201 62 D HN -0.578 7.717 8.370 -0.126 0.000 0.432 63 L N 0.845 121.911 121.223 -0.261 0.000 2.275 63 L HA -0.225 4.070 4.340 -0.073 0.000 0.215 63 L C 2.006 178.812 176.870 -0.106 0.000 1.119 63 L CA 2.902 57.709 54.840 -0.056 0.000 0.790 63 L CB -0.137 42.011 42.059 0.149 0.000 0.919 63 L HN 0.496 8.530 8.230 -0.327 0.000 0.443 64 E N -0.879 119.186 120.200 -0.224 0.000 2.338 64 E HA -0.353 3.630 4.350 -0.611 0.000 0.197 64 E C 1.292 177.754 176.600 -0.229 0.000 1.007 64 E CA 2.503 58.684 56.400 -0.365 0.000 0.849 64 E CB -0.724 28.789 29.700 -0.311 0.000 0.774 64 E HN 0.038 8.310 8.360 -0.196 -0.030 0.506 65 A N -2.030 120.705 122.820 -0.143 0.000 2.019 65 A HA -0.181 4.095 4.320 -0.073 0.000 0.219 65 A C 0.207 177.744 177.584 -0.078 0.000 1.164 65 A CA 2.548 54.535 52.037 -0.085 0.000 0.644 65 A CB -0.288 18.677 19.000 -0.058 0.000 0.805 65 A HN -0.559 7.592 8.150 -0.138 -0.084 0.449 66 C N -3.867 115.390 119.300 -0.071 0.000 2.674 66 C HA -0.019 4.438 4.460 -0.005 0.000 0.276 66 C C 1.173 176.130 174.990 -0.056 0.000 1.300 66 C CA 0.647 59.660 59.018 -0.009 0.000 1.732 66 C CB 0.162 27.947 27.740 0.075 0.000 2.076 66 C HN -0.557 7.494 8.230 -0.080 0.131 0.548 67 A N 0.210 122.916 122.820 -0.190 0.000 2.066 67 A HA -0.225 4.025 4.320 -0.117 0.000 0.218 67 A C 0.992 178.437 177.584 -0.231 0.000 1.157 67 A CA 2.579 54.447 52.037 -0.283 0.000 0.670 67 A CB -0.986 17.487 19.000 -0.879 0.000 0.804 67 A HN -0.389 7.494 8.150 -0.258 0.112 0.453 68 T N -2.609 111.815 114.554 -0.217 0.000 2.720 68 T HA -0.233 4.018 4.350 -0.165 0.000 0.268 68 T C 0.892 175.468 174.700 -0.206 0.000 1.037 68 T CA 3.371 65.365 62.100 -0.177 0.000 1.144 68 T CB -0.226 68.570 68.868 -0.120 0.000 0.864 68 T HN -0.401 7.682 8.240 -0.214 0.030 0.444 69 C N -3.137 115.979 119.300 -0.308 0.000 2.926 69 C HA 0.216 4.476 4.460 -0.333 0.000 0.272 69 C C 0.318 174.982 174.990 -0.543 0.000 1.249 69 C CA -0.427 58.316 59.018 -0.457 0.000 1.691 69 C CB 0.430 27.773 27.740 -0.661 0.000 1.983 69 C HN -0.330 7.708 8.230 -0.320 0.000 0.615 70 H N -0.213 118.791 119.070 -0.110 0.000 2.616 70 H HA 0.379 4.868 4.556 -0.112 0.000 0.229 70 H C -0.352 174.925 175.328 -0.085 0.000 1.418 70 H CA -1.054 54.931 56.048 -0.105 0.000 1.248 70 H CB -0.305 29.395 29.762 -0.104 0.000 1.822 70 H HN -0.387 7.691 8.280 -0.157 0.108 0.522 71 T N 3.537 118.084 114.554 -0.013 0.000 2.788 71 T HA -0.369 4.066 4.350 0.057 -0.051 0.268 71 T C 1.106 175.814 174.700 0.013 0.000 1.044 71 T CA 4.351 66.460 62.100 0.014 0.000 1.139 71 T CB 0.044 68.893 68.868 -0.032 0.000 0.867 71 T HN 0.189 8.395 8.240 -0.056 0.000 0.454 72 A N 0.708 123.442 122.820 -0.143 0.000 1.902 72 A HA -0.482 3.688 4.320 -0.249 0.000 0.217 72 A C 1.887 179.333 177.584 -0.230 0.000 1.181 72 A CA 3.335 55.164 52.037 -0.347 0.000 0.623 72 A CB -0.712 17.755 19.000 -0.888 0.000 0.818 72 A HN 0.469 8.522 8.150 -0.163 0.000 0.443 73 Q N -1.143 118.553 119.800 -0.174 0.000 2.079 73 Q HA -0.281 4.004 4.340 -0.092 0.000 0.200 73 Q C 2.227 178.191 176.000 -0.059 0.000 0.974 73 Q CA 3.244 58.930 55.803 -0.195 0.000 0.840 73 Q CB -0.332 28.101 28.738 -0.509 0.000 0.898 73 Q HN -0.342 7.824 8.270 -0.174 0.000 0.430 74 F N 2.128 122.023 119.950 -0.092 0.000 2.075 74 F HA -0.430 4.117 4.527 0.035 0.000 0.297 74 F C 1.288 177.136 175.800 0.081 0.000 1.113 74 F CA 3.579 61.585 58.000 0.009 0.000 1.218 74 F CB 0.222 39.212 39.000 -0.017 0.000 0.984 74 F HN -0.364 8.040 8.300 0.174 0.000 0.472 75 N N -1.601 117.165 118.700 0.109 0.000 2.166 75 N HA -0.411 4.286 4.740 -0.071 0.000 0.186 75 N C 2.229 177.710 175.510 -0.047 0.000 1.019 75 N CA 2.942 55.996 53.050 0.007 0.000 0.856 75 N CB -0.341 38.198 38.487 0.087 0.000 0.993 75 N HN 0.127 8.638 8.380 0.219 0.000 0.426 76 S N 0.241 115.966 115.700 0.042 0.000 2.368 76 S HA -0.266 4.444 4.470 0.054 -0.207 0.225 76 S C 1.851 176.476 174.600 0.041 0.000 1.030 76 S CA 2.579 60.833 58.200 0.090 0.000 0.999 76 S CB 0.243 63.594 63.200 0.252 0.000 0.844 76 S HN -0.420 7.931 8.310 0.068 0.000 0.459 77 F N 3.448 123.351 119.950 -0.079 0.000 2.126 77 F HA -0.226 4.520 4.527 -0.008 -0.224 0.299 77 F C 1.407 177.066 175.800 -0.234 0.000 1.096 77 F CA 2.785 60.716 58.000 -0.114 0.000 1.255 77 F CB 0.299 39.212 39.000 -0.144 0.000 0.997 77 F HN -0.319 8.090 8.300 0.183 0.000 0.479 78 V N -3.053 116.520 119.914 -0.569 0.000 3.461 78 V HA -0.216 3.362 4.120 -0.904 0.000 0.267 78 V C -0.825 174.978 176.094 -0.484 0.000 1.186 78 V CA -0.156 61.741 62.300 -0.671 0.000 1.154 78 V CB 0.527 31.985 31.823 -0.609 0.000 0.802 78 V HN -0.695 7.235 8.190 -0.434 0.000 0.474 79 E N -0.376 119.612 120.200 -0.353 0.000 2.452 79 E HA -0.213 4.007 4.350 -0.216 0.000 0.261 79 E C -0.789 175.620 176.600 -0.319 0.000 0.987 79 E CA 0.825 57.070 56.400 -0.259 0.000 0.926 79 E CB 0.837 30.433 29.700 -0.173 0.000 0.934 79 E HN -0.801 7.328 8.360 -0.313 0.044 0.452 80 V N 5.260 124.987 119.914 -0.312 0.000 2.407 80 V HA 0.031 3.983 4.120 -0.280 0.000 0.278 80 V C -0.850 174.977 176.094 -0.445 0.000 1.037 80 V CA -0.634 61.458 62.300 -0.347 0.000 0.900 80 V CB 0.828 32.471 31.823 -0.299 0.000 0.983 80 V HN -0.048 7.973 8.190 -0.282 0.000 0.459 81 R N 7.706 128.025 120.500 -0.303 0.000 2.308 81 R HA 0.163 4.356 4.340 -0.245 0.000 0.325 81 R C 0.438 176.598 176.300 -0.233 0.000 1.161 81 R CA -0.718 55.231 56.100 -0.251 0.000 1.022 81 R CB -0.294 29.899 30.300 -0.177 0.000 1.091 81 R HN -0.008 8.124 8.270 -0.231 0.000 0.497 82 H N 5.516 124.558 119.070 -0.047 0.000 2.491 82 H HA -0.264 4.271 4.556 -0.036 0.000 0.290 82 H C 0.738 176.011 175.328 -0.091 0.000 1.050 82 H CA 2.995 59.015 56.048 -0.047 0.000 1.309 82 H CB 0.117 29.862 29.762 -0.028 0.000 1.392 82 H HN 0.223 8.323 8.280 -0.300 0.000 0.554 83 E N -2.211 117.965 120.200 -0.041 0.000 2.418 83 E HA -0.157 4.106 4.350 -0.144 0.000 0.197 83 E C -0.350 176.025 176.600 -0.375 0.000 1.026 83 E CA 1.010 57.310 56.400 -0.166 0.000 0.862 83 E CB -0.760 28.861 29.700 -0.132 0.000 0.799 83 E HN 0.273 8.578 8.360 -0.046 0.028 0.518 84 S N 1.282 116.828 115.700 -0.255 0.000 2.485 84 S HA -0.024 4.240 4.470 -0.345 0.000 0.312 84 S C -0.662 173.813 174.600 -0.209 0.000 1.102 84 S CA -0.480 57.560 58.200 -0.267 0.000 1.066 84 S CB -0.028 63.074 63.200 -0.163 0.000 1.102 84 S HN -0.764 7.296 8.310 -0.178 0.143 0.519 85 H N 6.490 125.534 119.070 -0.043 0.000 3.094 85 H HA -0.054 4.481 4.556 -0.034 0.000 0.320 85 H C -1.068 174.226 175.328 -0.058 0.000 1.000 85 H CA -1.208 54.814 56.048 -0.043 0.000 1.413 85 H CB -0.754 28.982 29.762 -0.044 0.000 1.405 85 H HN -0.265 7.612 8.280 -0.672 0.000 0.586 86 P HA 0.182 4.569 4.420 -0.055 0.000 0.290 86 P C -0.621 176.678 177.300 -0.003 0.000 1.275 86 P CA -0.500 62.583 63.100 -0.029 0.000 0.841 86 P CB 1.238 32.879 31.700 -0.099 0.000 1.042 87 R N -1.514 118.979 120.500 -0.011 0.000 3.405 87 R HA -0.383 3.969 4.340 0.019 0.000 0.258 87 R C -1.475 174.838 176.300 0.022 0.000 1.030 87 R CA 0.511 56.623 56.100 0.021 0.000 0.691 87 R CB -1.236 29.101 30.300 0.062 0.000 1.093 87 R HN 0.332 8.583 8.270 -0.032 0.000 0.448 88 L N 0.407 121.633 121.223 0.004 0.000 2.255 88 L HA 0.203 4.539 4.340 -0.007 0.000 0.289 88 L C -1.386 175.466 176.870 -0.030 0.000 1.046 88 L CA -1.385 53.450 54.840 -0.008 0.000 0.816 88 L CB 0.264 42.326 42.059 0.005 0.000 1.197 88 L HN -0.089 8.140 8.230 -0.001 0.000 0.427 89 E N 7.396 127.589 120.200 -0.013 0.000 2.376 89 E HA -0.166 4.304 4.350 -0.017 -0.130 0.266 89 E C -0.538 176.037 176.600 -0.042 0.000 1.009 89 E CA 0.215 56.610 56.400 -0.009 0.000 0.902 89 E CB 0.087 29.811 29.700 0.039 0.000 0.972 89 E HN 0.579 8.939 8.360 -0.000 0.000 0.439 90 K N 5.368 125.701 120.400 -0.112 0.000 2.217 90 K HA -0.131 4.109 4.320 -0.133 0.000 0.202 90 K C 0.555 177.130 176.600 -0.042 0.000 1.051 90 K CA 2.349 58.539 56.287 -0.162 0.000 0.952 90 K CB 0.439 32.689 32.500 -0.417 0.000 0.736 90 K HN 0.335 8.498 8.250 -0.145 0.000 0.453 91 A N -2.120 120.739 122.820 0.065 0.000 3.033 91 A HA 0.249 4.957 4.320 0.239 -0.244 0.250 91 A C -0.622 177.041 177.584 0.132 0.000 1.633 91 A CA -0.854 51.302 52.037 0.199 0.000 1.290 91 A CB -0.847 18.365 19.000 0.353 0.000 1.048 91 A HN -0.615 7.888 8.150 0.081 -0.305 0.648 92 T N -2.565 112.040 114.554 0.085 0.000 2.906 92 T HA 0.370 4.761 4.350 0.068 0.000 0.295 92 T C -1.451 173.287 174.700 0.064 0.000 1.075 92 T CA -2.558 59.579 62.100 0.062 0.000 1.005 92 T CB 1.168 70.054 68.868 0.031 0.000 1.136 92 T HN -0.628 7.574 8.240 0.070 0.079 0.498 93 P HA -0.026 4.440 4.420 0.076 0.000 0.222 93 P C -0.267 177.067 177.300 0.057 0.000 1.147 93 P CA 1.881 65.016 63.100 0.059 0.000 0.790 93 P CB 0.017 31.740 31.700 0.039 0.000 0.780 94 T N -9.777 104.793 114.554 0.026 0.000 3.086 94 T HA 0.020 4.374 4.350 0.007 0.000 0.250 94 T C -0.241 174.450 174.700 -0.015 0.000 1.074 94 T CA -0.274 61.826 62.100 0.000 0.000 0.988 94 T CB 0.196 69.047 68.868 -0.028 0.000 0.988 94 T HN -0.120 8.104 8.240 0.017 0.026 0.530 95 S N 0.789 116.495 115.700 0.010 0.000 2.702 95 S HA 0.048 4.498 4.470 -0.035 0.000 0.272 95 S C -0.953 173.673 174.600 0.044 0.000 1.068 95 S CA -1.326 56.870 58.200 -0.007 0.000 0.964 95 S CB 1.550 64.733 63.200 -0.029 0.000 1.307 95 S HN -0.393 7.785 8.310 0.031 0.150 0.567 96 R N -1.410 119.101 120.500 0.019 0.000 2.115 96 R HA -0.008 4.408 4.340 0.126 0.000 0.226 96 R C 0.109 176.515 176.300 0.177 0.000 1.100 96 R CA 1.355 57.503 56.100 0.081 0.000 0.980 96 R CB 0.358 30.645 30.300 -0.022 0.000 0.875 96 R HN 0.324 8.574 8.270 -0.033 0.000 0.445 97 S N -2.406 113.375 115.700 0.135 0.000 2.312 97 S HA 0.614 5.404 4.470 0.320 -0.128 0.173 97 S C -2.171 172.579 174.600 0.250 0.000 1.488 97 S CA -3.305 55.045 58.200 0.249 0.000 1.239 97 S CB 0.667 64.015 63.200 0.246 0.000 1.215 97 S HN -0.476 7.881 8.310 0.078 0.000 0.438 98 P HA -0.160 4.500 4.420 0.138 -0.157 0.218 98 P C -0.256 177.137 177.300 0.154 0.000 1.148 98 P CA 1.917 65.108 63.100 0.152 0.000 0.822 98 P CB 0.294 32.063 31.700 0.114 0.000 0.784 99 M N -4.852 114.846 119.600 0.163 0.000 2.655 99 M HA 0.147 4.685 4.480 0.098 0.000 0.311 99 M C -0.235 176.184 176.300 0.198 0.000 1.229 99 M CA -0.690 54.678 55.300 0.113 0.000 0.972 99 M CB -0.303 32.294 32.600 -0.005 0.000 1.366 99 M HN -0.176 8.558 8.290 0.174 -0.339 0.500 100 F N 2.512 122.558 119.950 0.160 0.000 2.171 100 F HA -0.409 4.328 4.527 0.350 0.000 0.300 100 F C 0.787 176.705 175.800 0.196 0.000 1.090 100 F CA 3.969 62.124 58.000 0.259 0.000 1.293 100 F CB 0.268 39.447 39.000 0.300 0.000 1.013 100 F HN -0.480 8.043 8.300 0.476 0.062 0.486 101 D N -1.792 118.709 120.400 0.169 0.000 2.097 101 D HA -0.397 4.211 4.640 -0.053 0.000 0.195 101 D C 2.136 178.422 176.300 -0.023 0.000 0.989 101 D CA 4.337 58.347 54.000 0.017 0.000 0.827 101 D CB -0.252 40.572 40.800 0.041 0.000 0.966 101 D HN 0.372 8.883 8.370 0.235 0.000 0.456 102 K N -0.571 119.843 120.400 0.022 0.000 2.057 102 K HA -0.297 4.046 4.320 0.039 0.000 0.207 102 K C 2.292 178.979 176.600 0.144 0.000 1.049 102 K CA 2.953 59.266 56.287 0.044 0.000 0.931 102 K CB -0.240 32.266 32.500 0.011 0.000 0.714 102 K HN -0.464 7.809 8.250 0.039 0.000 0.440 103 L N -2.669 118.604 121.223 0.082 0.000 2.179 103 L HA -0.158 4.305 4.340 0.205 0.000 0.208 103 L C 2.081 179.176 176.870 0.375 0.000 1.096 103 L CA 2.838 57.773 54.840 0.160 0.000 0.779 103 L CB 0.117 42.056 42.059 -0.200 0.000 0.922 103 L HN -0.512 7.734 8.230 0.026 0.000 0.443 104 I N -3.793 116.806 120.570 0.049 0.000 3.883 104 I HA -0.085 4.227 4.170 0.237 0.000 0.326 104 I C -1.618 174.437 176.117 -0.103 0.000 1.283 104 I CA -2.059 59.193 61.300 -0.080 0.000 1.161 104 I CB 0.507 38.035 38.000 -0.786 0.000 1.012 104 I HN -0.010 8.129 8.210 -0.119 0.000 0.421 105 A N 0.519 123.256 122.820 -0.137 0.000 2.566 105 A HA -0.234 3.964 4.320 -0.203 0.000 0.245 105 A C 0.656 178.105 177.584 -0.225 0.000 1.056 105 A CA 1.998 53.883 52.037 -0.253 0.000 0.757 105 A CB -0.355 18.464 19.000 -0.302 0.000 0.979 105 A HN -0.507 7.551 8.150 -0.061 0.056 0.508 106 G N 2.063 110.796 108.800 -0.112 0.000 2.218 106 G HA2 -0.256 3.715 3.960 0.019 0.000 0.216 106 G HA3 -0.256 3.803 3.960 0.166 0.000 0.216 106 G C -0.862 174.023 174.900 -0.025 0.000 0.994 106 G CA -0.022 45.101 45.100 0.038 0.000 0.637 106 G HN 0.423 8.634 8.290 -0.131 0.000 0.505 107 H N 1.600 120.403 119.070 -0.446 0.000 2.502 107 H HA 0.327 4.584 4.556 -0.499 0.000 0.338 107 H C 0.665 175.912 175.328 -0.135 0.000 1.155 107 H CA -0.884 54.805 56.048 -0.598 0.000 1.237 107 H CB 3.194 32.194 29.762 -1.270 0.000 1.534 107 H HN -0.179 7.872 8.280 -0.281 0.059 0.523 108 G N 4.034 112.617 108.800 -0.361 0.000 2.470 108 G HA2 -0.259 3.918 3.960 0.361 0.000 0.220 108 G HA3 -0.259 3.722 3.960 0.034 0.000 0.220 108 G C 1.520 176.697 174.900 0.462 0.000 1.121 108 G CA 1.723 46.914 45.100 0.152 0.000 0.766 108 G HN 0.687 8.379 8.290 -0.996 0.000 0.553 109 F N 2.003 122.139 119.950 0.310 0.000 2.333 109 F HA -0.149 4.533 4.527 0.258 0.000 0.300 109 F C 1.831 177.784 175.800 0.255 0.000 1.083 109 F CA 0.701 58.870 58.000 0.282 0.000 1.395 109 F CB -0.765 38.382 39.000 0.245 0.000 1.056 109 F HN -0.512 8.443 8.300 1.140 0.029 0.529 110 A N -0.830 122.128 122.820 0.230 0.000 2.076 110 A HA -0.250 4.114 4.320 0.073 0.000 0.220 110 A C 1.308 178.834 177.584 -0.097 0.000 1.160 110 A CA 2.204 54.234 52.037 -0.012 0.000 0.653 110 A CB -0.703 18.151 19.000 -0.243 0.000 0.801 110 A HN -0.570 7.663 8.150 0.181 0.025 0.455 111 F N -3.189 116.829 119.950 0.114 0.000 2.259 111 F HA -0.159 4.413 4.527 0.074 0.000 0.298 111 F C 0.572 176.427 175.800 0.091 0.000 1.088 111 F CA 2.850 60.897 58.000 0.080 0.000 1.358 111 F CB 0.996 40.023 39.000 0.044 0.000 1.040 111 F HN -0.627 7.728 8.300 0.317 0.136 0.505 112 E N -3.004 117.349 120.200 0.256 0.000 2.552 112 E HA 0.066 4.704 4.350 0.190 -0.174 0.297 112 E C -2.352 174.342 176.600 0.158 0.000 1.038 112 E CA 0.178 56.689 56.400 0.185 0.000 0.856 112 E CB 2.147 31.930 29.700 0.138 0.000 1.222 112 E HN -0.807 7.714 8.360 0.268 0.000 0.422 113 H N 6.116 125.206 119.070 0.033 0.000 3.198 113 H HA 0.245 4.686 4.556 -0.192 0.000 0.317 113 H C -2.753 172.552 175.328 -0.038 0.000 1.178 113 H CA -0.767 55.243 56.048 -0.063 0.000 1.609 113 H CB 1.595 31.398 29.762 0.068 0.000 1.819 113 H HN 0.131 8.979 8.280 0.212 -0.440 0.533 114 A N 6.283 129.073 122.820 -0.051 0.000 2.279 114 A HA 0.428 4.856 4.320 -0.116 -0.177 0.303 114 A C -0.009 177.452 177.584 -0.205 0.000 1.108 114 A CA -1.103 50.867 52.037 -0.110 0.000 0.830 114 A CB 1.819 20.805 19.000 -0.024 0.000 1.106 114 A HN 0.167 8.331 8.150 0.024 0.000 0.493 115 E N 1.197 121.300 120.200 -0.162 0.000 2.418 115 E HA -0.034 4.212 4.350 -0.174 0.000 0.261 115 E C -1.510 175.050 176.600 -0.066 0.000 1.070 115 E CA -1.346 54.978 56.400 -0.127 0.000 0.931 115 E CB -0.148 29.505 29.700 -0.079 0.000 0.954 115 E HN -0.280 8.004 8.360 -0.128 0.000 0.439 116 P HA -0.003 4.413 4.420 -0.007 0.000 0.272 116 P C -1.443 175.834 177.300 -0.037 0.000 1.223 116 P CA 0.183 63.270 63.100 -0.022 0.000 0.784 116 P CB 0.594 32.288 31.700 -0.011 0.000 0.923 117 R N 1.843 122.332 120.500 -0.018 0.000 3.150 117 R HA 0.360 4.665 4.340 -0.058 0.000 0.236 117 R C -0.806 175.494 176.300 -0.001 0.000 1.469 117 R CA -2.121 53.966 56.100 -0.022 0.000 1.045 117 R CB 1.397 31.683 30.300 -0.024 0.000 1.481 117 R HN 0.096 8.370 8.270 0.006 0.000 0.506 118 S N -1.052 114.672 115.700 0.041 0.000 2.563 118 S HA 0.038 4.390 4.470 -0.196 0.000 0.284 118 S C 1.430 176.013 174.600 -0.029 0.000 1.331 118 S CA 0.254 58.412 58.200 -0.071 0.000 1.047 118 S CB 0.754 63.890 63.200 -0.107 0.000 0.859 118 S HN 0.148 8.511 8.310 0.088 0.000 0.514 119 H N 4.485 123.442 119.070 -0.187 0.000 2.426 119 H HA -0.353 4.157 4.556 -0.076 0.000 0.298 119 H C 2.002 177.175 175.328 -0.259 0.000 1.107 119 H CA 3.080 59.023 56.048 -0.175 0.000 1.298 119 H CB 0.049 29.734 29.762 -0.127 0.000 1.377 119 H HN 0.781 8.908 8.280 -0.255 0.000 0.519 120 A N -0.856 121.710 122.820 -0.425 0.000 1.986 120 A HA -0.261 3.812 4.320 -0.413 0.000 0.220 120 A C 0.865 178.209 177.584 -0.400 0.000 1.171 120 A CA 2.295 54.002 52.037 -0.551 0.000 0.640 120 A CB -0.548 17.931 19.000 -0.868 0.000 0.811 120 A HN 0.407 8.213 8.150 -0.536 0.023 0.451 121 F N -5.155 114.755 119.950 -0.067 0.000 2.765 121 F HA 0.119 4.637 4.527 -0.014 0.000 0.302 121 F C 0.883 176.652 175.800 -0.052 0.000 1.111 121 F CA 0.142 58.125 58.000 -0.028 0.000 1.359 121 F CB -0.432 38.570 39.000 0.004 0.000 1.097 121 F HN -0.750 7.466 8.300 -0.086 0.033 0.577 122 M N 0.157 119.795 119.600 0.062 0.000 2.117 122 M HA -0.337 4.161 4.480 0.030 0.000 0.262 122 M C 0.904 177.131 176.300 -0.121 0.000 1.065 122 M CA 4.647 59.941 55.300 -0.011 0.000 1.114 122 M CB -0.497 32.073 32.600 -0.051 0.000 1.361 122 M HN -0.426 7.828 8.290 0.030 0.054 0.408 123 L N -1.222 119.874 121.223 -0.211 0.000 2.072 123 L HA -0.196 3.816 4.340 -0.547 0.000 0.205 123 L C 1.376 177.915 176.870 -0.552 0.000 1.079 123 L CA 2.874 57.430 54.840 -0.473 0.000 0.752 123 L CB -0.201 41.567 42.059 -0.485 0.000 0.906 123 L HN -0.180 7.949 8.230 -0.168 0.000 0.436 124 V N -5.322 114.423 119.914 -0.282 0.000 2.407 124 V HA -0.517 3.422 4.120 -0.301 0.000 0.248 124 V C 1.625 177.604 176.094 -0.193 0.000 1.055 124 V CA 3.756 65.905 62.300 -0.252 0.000 1.049 124 V CB -0.440 31.288 31.823 -0.158 0.000 0.662 124 V HN -0.631 7.454 8.190 -0.176 0.000 0.455 125 D N 0.250 120.624 120.400 -0.043 0.000 2.144 125 D HA -0.294 4.351 4.640 0.007 0.000 0.200 125 D C 2.170 178.462 176.300 -0.014 0.000 0.978 125 D CA 3.331 57.334 54.000 0.004 0.000 0.833 125 D CB -0.632 40.205 40.800 0.060 0.000 0.961 125 D HN 0.092 8.468 8.370 0.010 0.000 0.470 126 H N 1.503 120.490 119.070 -0.138 0.000 2.352 126 H HA -0.288 4.248 4.556 -0.033 0.000 0.299 126 H C 2.059 177.451 175.328 0.106 0.000 1.097 126 H CA 3.297 59.285 56.048 -0.100 0.000 1.311 126 H CB 0.061 29.658 29.762 -0.276 0.000 1.377 126 H HN -0.631 7.642 8.280 -0.011 0.000 0.504 127 F N -4.068 115.796 119.950 -0.144 0.000 2.206 127 F HA -0.145 4.302 4.527 -0.133 0.000 0.298 127 F C 1.108 176.888 175.800 -0.034 0.000 1.090 127 F CA 1.861 59.750 58.000 -0.186 0.000 1.323 127 F CB 0.487 39.184 39.000 -0.504 0.000 1.028 127 F HN -0.509 7.581 8.300 -0.187 0.098 0.492 128 V N -8.537 111.400 119.914 0.037 0.000 3.650 128 V HA 0.243 4.540 4.120 0.016 -0.167 0.271 128 V C 0.201 176.306 176.094 0.018 0.000 1.281 128 V CA -0.199 62.084 62.300 -0.029 0.000 1.120 128 V CB 1.038 32.715 31.823 -0.243 0.000 0.856 128 V HN -0.709 7.457 8.190 -0.040 0.000 0.443 129 V N 1.199 121.130 119.914 0.028 0.000 2.763 129 V HA -0.426 3.718 4.120 0.040 0.000 0.306 129 V C 0.297 176.415 176.094 0.040 0.000 1.059 129 V CA 1.177 63.494 62.300 0.029 0.000 1.138 129 V CB 1.065 32.888 31.823 -0.000 0.000 0.940 129 V HN -0.749 7.453 8.190 0.020 0.000 0.489 130 D N 7.189 127.625 120.400 0.061 0.000 2.263 130 D HA -0.233 4.444 4.640 0.061 0.000 0.208 130 D C 1.536 177.856 176.300 0.034 0.000 0.971 130 D CA 3.445 57.489 54.000 0.074 0.000 0.867 130 D CB -0.129 40.752 40.800 0.135 0.000 0.929 130 D HN 0.343 9.127 8.370 0.073 -0.370 0.492 131 R N -3.459 117.057 120.500 0.026 0.000 2.299 131 R HA -0.103 4.213 4.340 -0.040 0.000 0.197 131 R C 0.229 176.466 176.300 -0.105 0.000 0.971 131 R CA 2.087 58.176 56.100 -0.017 0.000 1.030 131 R CB -0.665 29.654 30.300 0.031 0.000 0.932 131 R HN 0.074 8.326 8.270 0.025 0.033 0.477 132 A N -0.574 122.178 122.820 -0.112 0.000 1.909 132 A HA 0.078 4.223 4.320 -0.291 0.000 0.209 132 A C -0.403 176.921 177.584 -0.434 0.000 1.247 132 A CA 1.860 53.736 52.037 -0.269 0.000 0.660 132 A CB 1.509 20.360 19.000 -0.249 0.000 0.910 132 A HN -0.561 7.501 8.150 -0.056 0.054 0.465 133 Y N -4.061 116.199 120.300 -0.067 0.000 2.721 133 Y HA 0.357 5.036 4.550 -0.065 -0.169 0.251 133 Y C 0.398 176.237 175.900 -0.101 0.000 1.136 133 Y CA -1.685 56.357 58.100 -0.098 0.000 1.142 133 Y CB 0.736 39.090 38.460 -0.177 0.000 1.212 133 Y HN -0.337 8.004 8.280 0.101 0.000 0.565 134 G N 0.267 109.081 108.800 0.023 0.000 2.225 134 G HA2 -0.472 3.514 3.960 -0.042 0.000 0.267 134 G HA3 -0.472 3.752 3.960 0.078 -0.217 0.267 134 G C -0.049 174.925 174.900 0.124 0.000 1.024 134 G CA 0.877 46.002 45.100 0.042 0.000 0.784 134 G HN 0.278 8.544 8.290 -0.040 0.000 0.507 135 G N -3.288 105.543 108.800 0.052 0.000 2.155 135 G HA2 -0.481 3.564 3.960 0.001 0.000 0.257 135 G HA3 -0.481 3.513 3.960 0.057 0.000 0.257 135 G C 0.169 174.974 174.900 -0.157 0.000 0.983 135 G CA 0.515 45.622 45.100 0.012 0.000 0.676 135 G HN 0.179 8.472 8.290 0.040 0.020 0.528 136 R N -0.685 119.605 120.500 -0.351 0.000 2.083 136 R HA -0.268 3.194 4.340 -1.463 0.000 0.237 136 R C -0.671 175.195 176.300 -0.725 0.000 1.137 136 R CA 2.947 58.470 56.100 -0.961 0.000 0.951 136 R CB 0.769 30.411 30.300 -1.098 0.000 0.851 136 R HN -0.492 7.501 8.270 -0.212 0.150 0.434 137 F N -5.057 114.729 119.950 -0.274 0.000 2.421 137 F HA 0.984 5.616 4.527 -0.241 -0.249 0.337 137 F C -0.331 175.319 175.800 -0.249 0.000 1.105 137 F CA -2.363 55.481 58.000 -0.259 0.000 1.049 137 F CB 0.789 39.603 39.000 -0.309 0.000 1.139 137 F HN -0.274 7.759 8.300 -0.446 0.000 0.479 138 Q N -0.771 118.989 119.800 -0.066 0.000 2.456 138 Q HA 0.260 4.468 4.340 -0.220 0.000 0.284 138 Q C -1.083 174.766 176.000 -0.252 0.000 1.061 138 Q CA -2.101 53.592 55.803 -0.183 0.000 0.799 138 Q CB 4.511 33.163 28.738 -0.142 0.000 1.445 138 Q HN 0.184 8.440 8.270 -0.024 0.000 0.411 139 F N 0.576 120.391 119.950 -0.225 0.000 2.553 139 F HA -0.162 4.411 4.527 -0.155 -0.139 0.356 139 F C 1.840 177.531 175.800 -0.182 0.000 1.142 139 F CA 1.993 59.867 58.000 -0.209 0.000 1.322 139 F CB 0.247 39.084 39.000 -0.271 0.000 1.126 139 F HN 0.367 8.538 8.300 -0.215 0.000 0.599 140 K N 0.407 120.868 120.400 0.101 0.000 2.103 140 K HA -0.385 3.950 4.320 0.026 0.000 0.207 140 K C -0.106 176.510 176.600 0.028 0.000 1.048 140 K CA 2.729 59.045 56.287 0.048 0.000 0.930 140 K CB 0.356 32.894 32.500 0.063 0.000 0.716 140 K HN 0.420 8.764 8.250 0.157 0.000 0.444 141 N N -5.755 112.960 118.700 0.025 0.000 3.116 141 N HA 0.053 4.789 4.740 -0.007 0.000 0.244 141 N C -0.818 174.676 175.510 -0.026 0.000 1.485 141 N CA -0.769 52.291 53.050 0.017 0.000 0.884 141 N CB 0.363 38.902 38.487 0.086 0.000 1.415 141 N HN -0.710 7.698 8.380 0.052 0.003 0.524 142 W N -1.871 119.434 121.300 0.010 0.000 2.825 142 W HA -0.063 4.562 4.660 -0.057 0.000 0.243 142 W C 1.309 177.763 176.519 -0.108 0.000 1.293 142 W CA 1.938 59.255 57.345 -0.047 0.000 1.403 142 W CB -0.056 29.384 29.460 -0.032 0.000 1.134 142 W HN 0.480 8.894 8.180 0.390 0.000 0.666 143 Q N -0.770 119.085 119.800 0.092 0.000 2.230 143 Q HA -0.238 4.114 4.340 0.019 0.000 0.202 143 Q C 1.974 177.933 176.000 -0.069 0.000 0.963 143 Q CA 2.754 58.566 55.803 0.016 0.000 0.866 143 Q CB -0.366 28.391 28.738 0.031 0.000 0.931 143 Q HN -0.269 8.248 8.270 0.108 -0.183 0.452 144 K N -1.694 118.636 120.400 -0.115 0.000 2.362 144 K HA -0.162 4.130 4.320 -0.047 0.000 0.200 144 K C 2.115 178.456 176.600 -0.431 0.000 1.046 144 K CA 1.052 57.254 56.287 -0.142 0.000 0.952 144 K CB -0.685 31.831 32.500 0.027 0.000 0.753 144 K HN -0.622 7.652 8.250 -0.090 -0.077 0.466 145 V N -4.642 114.835 119.914 -0.729 0.000 2.688 145 V HA -0.310 2.879 4.120 -1.551 0.000 0.256 145 V C 0.852 176.683 176.094 -0.439 0.000 1.084 145 V CA 3.141 64.888 62.300 -0.923 0.000 1.103 145 V CB -0.757 30.659 31.823 -0.679 0.000 0.688 145 V HN -0.631 7.165 8.190 -0.589 0.041 0.480 146 T N -4.041 110.423 114.554 -0.151 0.000 3.088 146 T HA -0.137 4.263 4.350 0.083 0.000 0.259 146 T C -0.235 174.623 174.700 0.263 0.000 1.122 146 T CA 1.233 63.373 62.100 0.067 0.000 1.095 146 T CB 0.057 68.955 68.868 0.050 0.000 0.930 146 T HN -0.615 7.499 8.240 -0.148 0.037 0.508 147 D N 3.365 123.900 120.400 0.225 0.000 2.522 147 D HA 0.158 4.873 4.640 0.126 0.000 0.218 147 D C 0.501 176.883 176.300 0.137 0.000 1.149 147 D CA -1.241 52.861 54.000 0.170 0.000 0.981 147 D CB -0.401 40.462 40.800 0.105 0.000 1.041 147 D HN -0.665 7.638 8.370 0.146 0.155 0.518 148 G N 2.598 111.359 108.800 -0.065 0.000 2.402 148 G HA2 -0.341 2.959 3.960 -1.101 0.000 0.216 148 G HA3 -0.341 3.187 3.960 -0.720 0.000 0.216 148 G C 0.747 175.460 174.900 -0.312 0.000 1.162 148 G CA 2.362 47.100 45.100 -0.603 0.000 0.777 148 G HN -0.207 8.099 8.290 0.027 0.000 0.539 149 M N 2.069 121.583 119.600 -0.142 0.000 2.117 149 M HA -0.207 4.237 4.480 -0.060 0.000 0.262 149 M C 1.926 178.233 176.300 0.012 0.000 1.065 149 M CA 1.646 56.920 55.300 -0.043 0.000 1.114 149 M CB -0.442 32.169 32.600 0.018 0.000 1.361 149 M HN -0.161 8.066 8.290 -0.104 0.000 0.408 150 G N -2.102 106.711 108.800 0.021 0.000 2.421 150 G HA2 -0.417 3.577 3.960 0.057 0.000 0.216 150 G HA3 -0.417 3.770 3.960 0.060 -0.191 0.216 150 G C 0.525 175.448 174.900 0.038 0.000 1.171 150 G CA 1.978 47.107 45.100 0.048 0.000 0.775 150 G HN -0.060 8.573 8.290 0.020 -0.331 0.543 151 A N 2.407 125.237 122.820 0.017 0.000 1.908 151 A HA -0.306 4.016 4.320 0.004 0.000 0.218 151 A C 1.990 179.565 177.584 -0.015 0.000 1.181 151 A CA 2.704 54.738 52.037 -0.006 0.000 0.627 151 A CB -0.558 18.438 19.000 -0.008 0.000 0.818 151 A HN -0.474 7.681 8.150 0.008 0.000 0.445 152 V N -1.727 118.183 119.914 -0.008 0.000 2.343 152 V HA -0.577 3.604 4.120 0.102 0.000 0.247 152 V C 2.089 178.310 176.094 0.211 0.000 1.051 152 V CA 3.932 66.290 62.300 0.096 0.000 1.036 152 V CB -0.191 31.685 31.823 0.089 0.000 0.654 152 V HN -0.462 7.695 8.190 -0.055 0.000 0.451 153 R N -2.020 118.579 120.500 0.165 0.000 2.105 153 R HA -0.288 4.175 4.340 0.204 0.000 0.239 153 R C 0.485 176.911 176.300 0.210 0.000 1.135 153 R CA 2.381 58.592 56.100 0.184 0.000 0.967 153 R CB 0.691 31.062 30.300 0.119 0.000 0.861 153 R HN -0.293 8.050 8.270 0.122 0.000 0.442 154 G N -6.910 101.943 108.800 0.088 0.000 2.380 154 G HA2 -0.003 4.050 3.960 -0.128 0.000 0.305 154 G HA3 -0.003 3.931 3.960 -0.043 0.000 0.305 154 G C -1.491 173.316 174.900 -0.155 0.000 1.672 154 G CA -0.102 44.965 45.100 -0.054 0.000 0.904 154 G HN -0.616 7.710 8.290 0.060 0.000 0.686 155 A N 3.484 126.100 122.820 -0.341 0.000 1.917 155 A HA -0.220 3.854 4.320 -0.409 0.000 0.219 155 A C 1.151 178.304 177.584 -0.718 0.000 1.182 155 A CA 3.245 54.925 52.037 -0.597 0.000 0.633 155 A CB 0.139 18.631 19.000 -0.847 0.000 0.819 155 A HN 0.389 8.219 8.150 -0.354 0.107 0.448 156 W N -6.289 114.931 121.300 -0.134 0.000 3.180 156 W HA -0.021 4.514 4.660 -0.208 0.000 0.254 156 W C 0.855 177.322 176.519 -0.086 0.000 1.318 156 W CA -0.043 57.204 57.345 -0.163 0.000 1.608 156 W CB -0.466 28.876 29.460 -0.196 0.000 1.124 156 W HN -0.189 7.713 8.180 -0.440 0.014 0.694 157 T N -2.345 112.228 114.554 0.031 0.000 3.055 157 T HA -0.158 4.237 4.350 0.074 0.000 0.265 157 T C 1.007 175.734 174.700 0.044 0.000 1.111 157 T CA 2.944 65.075 62.100 0.051 0.000 1.118 157 T CB 0.337 69.234 68.868 0.049 0.000 0.909 157 T HN -0.079 7.984 8.240 -0.028 0.160 0.501 158 V N -4.718 115.201 119.914 0.009 0.000 3.604 158 V HA 0.377 4.558 4.120 0.102 0.000 0.277 158 V C -1.708 174.414 176.094 0.046 0.000 1.399 158 V CA -0.229 62.119 62.300 0.079 0.000 1.034 158 V CB 1.032 32.966 31.823 0.186 0.000 0.824 158 V HN -0.574 7.444 8.190 -0.061 0.135 0.439 159 L N -0.807 120.358 121.223 -0.097 0.000 2.313 159 L HA 0.822 5.222 4.340 -0.152 -0.151 0.268 159 L C 0.078 176.982 176.870 0.056 0.000 1.010 159 L CA -1.719 53.032 54.840 -0.147 0.000 0.814 159 L CB 2.955 44.733 42.059 -0.469 0.000 1.304 159 L HN -0.712 7.443 8.230 -0.126 0.000 0.441 160 T N -3.399 111.190 114.554 0.058 0.000 2.924 160 T HA 0.300 4.719 4.350 0.116 0.000 0.291 160 T C -2.147 172.649 174.700 0.160 0.000 1.045 160 T CA -2.051 60.106 62.100 0.095 0.000 1.015 160 T CB 2.777 71.658 68.868 0.022 0.000 1.103 160 T HN 0.622 8.860 8.240 -0.003 0.000 0.496 161 D N 0.994 121.446 120.400 0.086 0.000 2.344 161 D HA 0.279 5.118 4.640 0.116 -0.130 0.239 161 D C 0.082 176.281 176.300 -0.169 0.000 1.064 161 D CA -1.699 52.315 54.000 0.024 0.000 0.829 161 D CB 2.515 43.309 40.800 -0.010 0.000 1.129 161 D HN -0.002 8.385 8.370 0.029 0.000 0.506 162 A N 4.903 127.490 122.820 -0.389 0.000 2.070 162 A HA -0.201 3.979 4.320 -0.234 0.000 0.220 162 A C 0.068 177.506 177.584 -0.244 0.000 1.159 162 A CA 1.572 53.365 52.037 -0.406 0.000 0.656 162 A CB 0.541 19.062 19.000 -0.798 0.000 0.800 162 A HN 0.488 8.309 8.150 -0.549 0.000 0.453 163 D N -4.548 115.711 120.400 -0.235 0.000 2.527 163 D HA 0.414 5.049 4.640 -0.009 0.000 0.242 163 D C -2.203 174.069 176.300 -0.047 0.000 1.285 163 D CA -1.872 52.108 54.000 -0.034 0.000 0.886 163 D CB 0.801 41.702 40.800 0.169 0.000 1.402 163 D HN -0.526 7.927 8.370 -0.327 -0.280 0.528 164 P HA -0.049 4.458 4.420 -0.096 -0.144 0.223 164 P C -0.455 176.824 177.300 -0.035 0.000 1.144 164 P CA 1.007 64.065 63.100 -0.070 0.000 0.783 164 P CB 0.409 32.063 31.700 -0.076 0.000 0.771 165 E N -4.667 115.528 120.200 -0.007 0.000 2.489 165 E HA 0.057 4.406 4.350 -0.001 0.000 0.193 165 E C -0.237 176.375 176.600 0.020 0.000 1.057 165 E CA -0.223 56.181 56.400 0.006 0.000 0.866 165 E CB 0.071 29.778 29.700 0.011 0.000 0.916 165 E HN -0.392 8.161 8.360 0.000 -0.194 0.500 166 S N -1.940 113.780 115.700 0.034 0.000 2.570 166 S HA 0.346 4.839 4.470 0.039 0.000 0.286 166 S C -0.886 173.745 174.600 0.051 0.000 1.099 166 S CA -1.360 56.868 58.200 0.047 0.000 0.913 166 S CB 2.350 65.590 63.200 0.065 0.000 1.085 166 S HN -0.579 7.712 8.310 0.033 0.039 0.480 167 S N 0.194 115.929 115.700 0.059 0.000 2.730 167 S HA 0.161 4.671 4.470 0.067 0.000 0.244 167 S C -1.176 173.478 174.600 0.091 0.000 1.022 167 S CA -0.803 57.442 58.200 0.074 0.000 1.014 167 S CB 1.174 64.426 63.200 0.086 0.000 0.963 167 S HN 0.508 8.852 8.310 0.056 0.000 0.540 168 D N 0.345 120.791 120.400 0.076 0.000 2.313 168 D HA -0.003 4.680 4.640 0.072 0.000 0.247 168 D C -0.570 175.778 176.300 0.079 0.000 1.094 168 D CA -0.830 53.209 54.000 0.066 0.000 0.925 168 D CB 1.159 41.977 40.800 0.030 0.000 1.188 168 D HN -0.712 7.699 8.370 0.068 0.000 0.430 169 Q N 0.340 120.182 119.800 0.070 0.000 2.296 169 Q HA -0.077 4.323 4.340 0.100 0.000 0.263 169 Q C -0.187 175.817 176.000 0.008 0.000 1.026 169 Q CA 0.589 56.429 55.803 0.062 0.000 0.912 169 Q CB -0.295 28.465 28.738 0.036 0.000 1.198 169 Q HN 0.423 8.732 8.270 0.065 0.000 0.407 170 R N 2.131 122.635 120.500 0.006 0.000 2.795 170 R HA 0.359 4.635 4.340 -0.107 0.000 0.268 170 R C -0.650 175.568 176.300 -0.136 0.000 1.041 170 R CA -0.841 55.187 56.100 -0.120 0.000 0.927 170 R CB 0.714 30.868 30.300 -0.244 0.000 1.235 170 R HN 0.222 8.548 8.270 0.094 0.000 0.463 171 R N 1.423 121.799 120.500 -0.208 0.000 2.234 171 R HA 0.343 4.683 4.340 -0.000 0.000 0.324 171 R C -0.548 175.589 176.300 -0.272 0.000 1.054 171 R CA 0.056 56.072 56.100 -0.139 0.000 0.912 171 R CB 0.686 30.912 30.300 -0.124 0.000 1.030 171 R HN 0.392 nan 8.270 nan 0.000 0.455 172 F N 3.237 123.144 119.950 -0.071 0.000 2.582 172 F HA 0.014 4.513 4.527 -0.047 0.000 0.290 172 F C -0.124 175.659 175.800 -0.028 0.000 1.115 172 F CA 1.437 59.405 58.000 -0.053 0.000 1.445 172 F CB 1.094 40.052 39.000 -0.069 0.000 1.126 172 F HN 0.820 9.216 8.300 0.346 0.112 0.574 173 L N -2.363 118.947 121.223 0.146 0.000 2.333 173 L HA 0.461 4.857 4.340 0.093 0.000 0.269 173 L C 0.164 177.069 176.870 0.057 0.000 1.010 173 L CA -1.601 53.296 54.840 0.096 0.000 0.818 173 L CB 2.501 44.623 42.059 0.105 0.000 1.306 173 L HN -0.701 7.617 8.230 0.148 0.000 0.430 174 S N 0.281 116.019 115.700 0.062 0.000 2.368 174 S HA -0.231 4.258 4.470 0.031 0.000 0.225 174 S C 0.697 175.352 174.600 0.091 0.000 1.030 174 S CA 2.336 60.570 58.200 0.057 0.000 0.999 174 S CB 0.146 63.384 63.200 0.064 0.000 0.844 174 S HN 0.267 8.619 8.310 0.070 0.000 0.459 175 Q N 2.165 122.049 119.800 0.141 0.000 2.916 175 Q HA 0.271 4.839 4.340 0.381 0.000 0.314 175 Q C -1.465 174.696 176.000 0.267 0.000 1.194 175 Q CA -0.969 55.003 55.803 0.282 0.000 1.079 175 Q CB -0.730 28.164 28.738 0.259 0.000 1.322 175 Q HN 0.265 8.613 8.270 0.129 0.000 0.500 176 T N -4.633 109.900 114.554 -0.035 0.000 2.887 176 T HA 0.464 4.848 4.350 -0.104 -0.096 0.292 176 T C -2.011 172.203 174.700 -0.811 0.000 1.087 176 T CA -1.756 60.204 62.100 -0.235 0.000 1.009 176 T CB 3.320 72.139 68.868 -0.082 0.000 1.203 176 T HN -0.704 7.422 8.240 -0.095 0.057 0.518 177 A N -0.941 121.470 122.820 -0.682 0.000 2.486 177 A HA 0.410 4.341 4.320 -0.648 0.000 0.289 177 A C -1.785 175.620 177.584 -0.297 0.000 1.176 177 A CA -1.084 50.576 52.037 -0.629 0.000 0.757 177 A CB 2.859 21.458 19.000 -0.669 0.000 1.337 177 A HN 0.145 8.039 8.150 -0.427 0.000 0.423 178 T N -3.133 111.283 114.554 -0.230 0.000 3.516 178 T HA 0.262 4.561 4.350 -0.192 -0.064 0.245 178 T C -0.178 174.422 174.700 -0.167 0.000 1.077 178 T CA -0.930 61.064 62.100 -0.176 0.000 1.222 178 T CB -1.046 67.753 68.868 -0.116 0.000 1.045 178 T HN -0.046 8.055 8.240 -0.231 0.000 0.585 179 A N 1.904 124.625 122.820 -0.164 0.000 2.119 179 A HA -0.109 4.169 4.320 -0.070 0.000 0.216 179 A C -0.499 177.032 177.584 -0.087 0.000 1.152 179 A CA 1.172 53.155 52.037 -0.090 0.000 0.708 179 A CB -0.202 18.784 19.000 -0.023 0.000 0.805 179 A HN -0.154 7.892 8.150 -0.173 0.000 0.460 180 A N -2.296 120.371 122.820 -0.255 0.000 2.483 180 A HA -0.132 4.163 4.320 -0.043 0.000 0.238 180 A C -0.868 176.680 177.584 -0.060 0.000 1.070 180 A CA 0.393 52.283 52.037 -0.245 0.000 0.770 180 A CB 0.674 19.110 19.000 -0.941 0.000 1.008 180 A HN -0.445 7.330 8.150 -0.394 0.139 0.497 181 N N 1.292 120.055 118.700 0.104 0.000 2.732 181 N HA 0.283 5.123 4.740 0.166 0.000 0.259 181 N C -1.740 173.920 175.510 0.249 0.000 1.402 181 N CA -1.735 51.416 53.050 0.168 0.000 0.829 181 N CB -0.083 38.492 38.487 0.147 0.000 1.495 181 N HN -0.612 7.860 8.380 0.154 0.000 0.511 182 P HA -0.093 4.667 4.420 0.567 0.000 0.222 182 P C 0.648 178.088 177.300 0.234 0.000 1.147 182 P CA 1.867 65.196 63.100 0.381 0.000 0.790 182 P CB 0.272 32.148 31.700 0.293 0.000 0.780 183 V N -1.213 118.845 119.914 0.241 0.000 2.427 183 V HA -0.566 3.652 4.120 0.163 0.000 0.248 183 V C 1.514 177.616 176.094 0.013 0.000 1.051 183 V CA 3.987 66.391 62.300 0.174 0.000 1.048 183 V CB -0.271 31.702 31.823 0.250 0.000 0.666 183 V HN -0.243 8.303 8.190 0.261 -0.199 0.456 184 C N -0.724 118.601 119.300 0.043 0.000 2.391 184 C HA -0.311 4.113 4.460 -0.060 0.000 0.276 184 C C 2.443 177.246 174.990 -0.311 0.000 1.217 184 C CA 3.968 62.938 59.018 -0.080 0.000 1.766 184 C CB -1.954 25.794 27.740 0.013 0.000 2.046 184 C HN -0.469 7.994 8.230 0.119 -0.161 0.475 185 L N -1.966 119.051 121.223 -0.343 0.000 2.265 185 L HA -0.273 3.667 4.340 -0.667 0.000 0.215 185 L C 2.294 178.924 176.870 -0.400 0.000 1.117 185 L CA 2.135 56.665 54.840 -0.516 0.000 0.782 185 L CB -1.557 40.123 42.059 -0.633 0.000 0.914 185 L HN -0.453 7.634 8.230 -0.208 0.018 0.441 186 N N -1.225 117.280 118.700 -0.325 0.000 2.453 186 N HA -0.206 4.490 4.740 -0.073 0.000 0.183 186 N C 0.102 175.505 175.510 -0.178 0.000 1.041 186 N CA 3.014 55.946 53.050 -0.197 0.000 0.900 186 N CB 0.202 38.561 38.487 -0.213 0.000 0.961 186 N HN -0.451 7.700 8.380 -0.328 0.032 0.443 187 C N -3.991 115.165 119.300 -0.240 0.000 2.780 187 C HA 0.203 4.538 4.460 -0.208 0.000 0.287 187 C C 0.322 175.139 174.990 -0.289 0.000 1.288 187 C CA -0.904 57.963 59.018 -0.251 0.000 1.713 187 C CB -1.436 26.126 27.740 -0.297 0.000 1.955 187 C HN -0.406 7.630 8.230 -0.277 0.028 0.613 188 K N -2.022 118.188 120.400 -0.318 0.000 2.474 188 K HA 0.306 4.447 4.320 -0.299 0.000 0.202 188 K C -0.683 175.749 176.600 -0.281 0.000 1.248 188 K CA -0.336 55.748 56.287 -0.339 0.000 0.946 188 K CB 2.852 35.050 32.500 -0.505 0.000 1.102 188 K HN 0.043 7.928 8.250 -0.319 0.173 0.541 189 T N -1.613 112.804 114.554 -0.230 0.000 2.830 189 T HA 0.321 4.568 4.350 -0.172 0.000 0.322 189 T C -2.449 172.217 174.700 -0.057 0.000 1.501 189 T CA -0.489 61.520 62.100 -0.152 0.000 1.036 189 T CB 1.754 70.537 68.868 -0.141 0.000 1.379 189 T HN -0.322 7.789 8.240 -0.214 0.000 0.493 190 Q N 2.368 122.114 119.800 -0.091 0.000 2.129 190 Q HA 0.420 4.532 4.340 -0.379 0.000 0.274 190 Q C 0.234 176.267 176.000 0.055 0.000 0.854 190 Q CA -1.296 54.424 55.803 -0.138 0.000 1.123 190 Q CB 1.257 29.951 28.738 -0.075 0.000 1.226 190 Q HN 0.515 9.097 8.270 -0.133 -0.392 0.454 191 D N 1.269 121.768 120.400 0.165 0.000 2.221 191 D HA -0.262 4.571 4.640 0.321 0.000 0.204 191 D C -0.255 176.202 176.300 0.263 0.000 0.982 191 D CA 3.150 57.303 54.000 0.256 0.000 0.857 191 D CB -0.241 40.686 40.800 0.210 0.000 0.934 191 D HN -0.320 8.138 8.370 0.146 0.000 0.475 192 H N -7.293 111.895 119.070 0.197 0.000 2.524 192 H HA 0.085 4.884 4.556 0.404 0.000 0.280 192 H C 0.486 175.999 175.328 0.309 0.000 1.018 192 H CA -1.223 55.029 56.048 0.339 0.000 1.165 192 H CB -1.689 28.358 29.762 0.475 0.000 1.411 192 H HN -0.225 8.192 8.280 0.287 0.035 0.569 193 I N 1.734 122.235 120.570 -0.116 0.000 2.335 193 I HA -0.416 3.635 4.170 -0.200 0.000 0.251 193 I C -0.623 175.535 176.117 0.068 0.000 1.129 193 I CA 3.206 64.448 61.300 -0.096 0.000 1.402 193 I CB 0.074 38.037 38.000 -0.061 0.000 1.069 193 I HN -0.675 7.415 8.210 -0.072 0.076 0.424 194 L N -5.799 115.516 121.223 0.153 0.000 2.628 194 L HA -0.044 4.473 4.340 0.296 0.000 0.229 194 L C -0.361 176.765 176.870 0.427 0.000 1.137 194 L CA 0.156 55.151 54.840 0.257 0.000 0.909 194 L CB -0.560 41.584 42.059 0.142 0.000 1.137 194 L HN -0.176 8.124 8.230 0.148 0.019 0.470 195 D N -2.567 118.118 120.400 0.474 0.000 2.540 195 D HA 0.288 5.200 4.640 0.452 0.000 0.229 195 D C -2.292 174.380 176.300 0.621 0.000 1.250 195 D CA 0.085 54.401 54.000 0.526 0.000 0.817 195 D CB 2.608 43.736 40.800 0.546 0.000 1.060 195 D HN -0.155 8.316 8.370 0.456 0.172 0.508 196 W N 0.028 121.495 121.300 0.278 0.000 2.830 196 W HA 0.511 5.455 4.660 0.175 -0.179 0.335 196 W C -2.856 173.475 176.519 -0.313 0.000 1.043 196 W CA -1.664 55.759 57.345 0.130 0.000 1.239 196 W CB 2.939 32.605 29.460 0.344 0.000 1.378 196 W HN -0.937 7.527 8.180 0.472 0.000 0.456 197 A N 5.970 128.425 122.820 -0.608 0.000 2.351 197 A HA 0.037 3.706 4.320 -1.301 -0.130 0.257 197 A C -0.822 176.454 177.584 -0.512 0.000 1.087 197 A CA -0.942 50.634 52.037 -0.769 0.000 0.798 197 A CB 1.869 20.655 19.000 -0.357 0.000 1.033 197 A HN 0.436 8.290 8.150 -0.492 0.000 0.488 198 Y N 2.798 122.862 120.300 -0.393 0.000 2.895 198 Y HA -0.456 4.054 4.550 -0.066 0.000 0.334 198 Y C 0.421 176.228 175.900 -0.154 0.000 1.261 198 Y CA 2.573 60.575 58.100 -0.164 0.000 1.560 198 Y CB 0.495 38.893 38.460 -0.103 0.000 1.253 198 Y HN -0.094 8.079 8.280 -0.178 0.000 0.582 199 M N 3.502 122.824 119.600 -0.464 0.000 2.901 199 M HA -0.507 3.906 4.480 -0.257 -0.087 0.182 199 M C 0.769 176.921 176.300 -0.246 0.000 0.641 199 M CA 0.697 55.794 55.300 -0.338 0.000 0.689 199 M CB -2.398 29.957 32.600 -0.408 0.000 2.484 199 M HN 0.345 8.534 8.290 -0.450 -0.169 0.302 200 G N -2.820 105.560 108.800 -0.701 0.000 2.147 200 G HA2 -0.523 2.097 3.960 -2.320 0.000 0.244 200 G HA3 -0.523 2.597 3.960 -1.400 0.000 0.244 200 G C -0.908 173.603 174.900 -0.648 0.000 1.005 200 G CA 0.244 44.510 45.100 -1.391 0.000 0.713 200 G HN 0.480 8.106 8.290 -0.799 0.184 0.515 201 D N 0.649 120.823 120.400 -0.376 0.000 2.419 201 D HA -0.095 4.453 4.640 -0.152 0.000 0.236 201 D C -0.204 176.007 176.300 -0.147 0.000 1.165 201 D CA 0.865 54.756 54.000 -0.181 0.000 0.882 201 D CB 0.446 41.205 40.800 -0.069 0.000 1.201 201 D HN -0.868 7.249 8.370 -0.348 0.044 0.443 202 E N 1.014 121.169 120.200 -0.075 0.000 2.442 202 E HA -0.134 4.194 4.350 -0.037 0.000 0.262 202 E C -0.868 175.772 176.600 0.068 0.000 1.004 202 E CA 1.514 57.900 56.400 -0.023 0.000 0.928 202 E CB 0.249 29.935 29.700 -0.024 0.000 0.937 202 E HN 0.203 8.522 8.360 -0.068 0.000 0.446 203 H N 4.309 123.370 119.070 -0.015 0.000 3.112 203 H HA 0.001 4.580 4.556 0.038 0.000 0.347 203 H C 0.255 175.602 175.328 0.032 0.000 1.188 203 H CA 0.238 56.314 56.048 0.046 0.000 1.240 203 H CB 2.010 31.864 29.762 0.153 0.000 1.920 203 H HN -0.176 8.174 8.280 0.117 0.000 0.535 204 E N 5.154 125.392 120.200 0.063 0.000 2.153 204 E HA -0.209 4.152 4.350 0.018 0.000 0.194 204 E C -0.766 175.909 176.600 0.126 0.000 0.988 204 E CA 2.073 58.506 56.400 0.055 0.000 0.811 204 E CB -0.355 29.318 29.700 -0.045 0.000 0.746 204 E HN 0.396 8.626 8.360 -0.216 0.000 0.466 205 A N -1.988 121.028 122.820 0.327 0.000 2.251 205 A HA 0.088 4.349 4.320 -0.099 0.000 0.209 205 A C -0.613 176.936 177.584 -0.059 0.000 1.187 205 A CA -0.073 51.925 52.037 -0.066 0.000 0.823 205 A CB 0.795 19.503 19.000 -0.487 0.000 0.846 205 A HN -0.455 8.218 8.150 0.898 0.016 0.486 206 A N -1.645 121.296 122.820 0.201 0.000 2.260 206 A HA 0.138 4.676 4.320 0.364 0.000 0.308 206 A C -0.561 177.037 177.584 0.024 0.000 1.254 206 A CA -0.849 51.335 52.037 0.246 0.000 0.874 206 A CB 0.466 19.610 19.000 0.240 0.000 1.153 206 A HN -0.688 7.458 8.150 0.262 0.162 0.527 207 K N 5.147 125.491 120.400 -0.093 0.000 2.148 207 K HA -0.114 3.966 4.320 -0.400 0.000 0.204 207 K C 0.198 176.436 176.600 -0.603 0.000 1.050 207 K CA 1.948 57.959 56.287 -0.461 0.000 0.942 207 K CB 0.445 32.533 32.500 -0.685 0.000 0.724 207 K HN 0.362 8.605 8.250 -0.012 0.000 0.446 208 W N -3.169 118.178 121.300 0.078 0.000 2.761 208 W HA 0.224 4.817 4.660 -0.112 0.000 0.340 208 W C -1.347 175.102 176.519 -0.116 0.000 1.072 208 W CA -1.775 55.534 57.345 -0.061 0.000 1.215 208 W CB 3.017 32.337 29.460 -0.233 0.000 1.420 208 W HN -0.466 7.757 8.180 0.111 0.023 0.519 209 S N -1.157 114.577 115.700 0.057 0.000 2.752 209 S HA 0.502 4.478 4.470 -0.823 0.000 0.284 209 S C 0.697 175.227 174.600 -0.115 0.000 1.189 209 S CA -1.372 56.642 58.200 -0.311 0.000 0.835 209 S CB 2.516 65.593 63.200 -0.205 0.000 1.192 209 S HN 0.602 8.998 8.310 0.145 0.000 0.506 210 R N -0.637 119.749 120.500 -0.190 0.000 2.159 210 R HA -0.217 4.263 4.340 0.234 0.000 0.237 210 R C 0.988 177.338 176.300 0.084 0.000 1.131 210 R CA 3.175 59.313 56.100 0.064 0.000 0.982 210 R CB 0.134 30.450 30.300 0.025 0.000 0.868 210 R HN 0.254 8.311 8.270 -0.355 0.000 0.453 211 T N -6.069 108.509 114.554 0.040 0.000 3.122 211 T HA 0.056 4.446 4.350 0.068 0.000 0.250 211 T C 0.399 175.156 174.700 0.095 0.000 1.067 211 T CA -0.430 61.706 62.100 0.060 0.000 0.966 211 T CB 0.299 69.184 68.868 0.029 0.000 1.002 211 T HN -0.646 7.565 8.240 0.000 0.028 0.542 212 S N 2.880 118.660 115.700 0.132 0.000 2.580 212 S HA -0.182 4.410 4.470 0.204 0.000 0.266 212 S C -0.396 174.330 174.600 0.210 0.000 1.354 212 S CA 1.367 59.693 58.200 0.210 0.000 1.008 212 S CB 0.728 64.134 63.200 0.342 0.000 0.898 212 S HN -0.575 7.761 8.310 0.122 0.047 0.555 213 E N 1.702 122.052 120.200 0.249 0.000 2.166 213 E HA 0.041 4.502 4.350 0.185 0.000 0.279 213 E C 0.011 176.768 176.600 0.262 0.000 1.095 213 E CA -0.715 55.820 56.400 0.224 0.000 0.888 213 E CB -0.439 29.386 29.700 0.208 0.000 1.041 213 E HN 0.529 9.060 8.360 0.286 0.000 0.414 214 V N 6.963 127.037 119.914 0.268 0.000 2.490 214 V HA -0.386 3.975 4.120 0.402 0.000 0.250 214 V C 0.633 176.969 176.094 0.403 0.000 1.061 214 V CA 3.051 65.572 62.300 0.369 0.000 1.064 214 V CB 0.303 32.344 31.823 0.364 0.000 0.670 214 V HN 0.655 8.984 8.190 0.233 0.000 0.461 215 V N -0.437 119.683 119.914 0.344 0.000 2.343 215 V HA -0.540 3.802 4.120 0.370 0.000 0.247 215 V C 1.832 178.017 176.094 0.152 0.000 1.051 215 V CA 4.267 66.736 62.300 0.282 0.000 1.036 215 V CB -0.496 31.436 31.823 0.182 0.000 0.654 215 V HN 0.142 8.511 8.190 0.298 0.000 0.451 216 E N -0.975 119.325 120.200 0.166 0.000 2.077 216 E HA -0.314 4.108 4.350 0.120 0.000 0.193 216 E C 2.119 178.725 176.600 0.009 0.000 0.989 216 E CA 2.496 58.998 56.400 0.171 0.000 0.800 216 E CB -0.523 29.390 29.700 0.356 0.000 0.746 216 E HN -0.749 7.734 8.360 0.204 0.000 0.452 217 F N -0.062 119.607 119.950 -0.469 0.000 2.069 217 F HA -0.353 2.782 4.527 -2.321 0.000 0.298 217 F C 1.768 177.264 175.800 -0.507 0.000 1.113 217 F CA 1.580 58.893 58.000 -1.145 0.000 1.214 217 F CB -0.289 38.224 39.000 -0.811 0.000 0.978 217 F HN -0.491 7.837 8.300 0.047 0.000 0.474 218 A N -0.216 122.491 122.820 -0.189 0.000 1.903 218 A HA -0.449 3.840 4.320 -0.052 0.000 0.219 218 A C 2.206 179.659 177.584 -0.218 0.000 1.191 218 A CA 3.217 55.156 52.037 -0.164 0.000 0.638 218 A CB -0.781 18.091 19.000 -0.213 0.000 0.823 218 A HN 0.359 8.517 8.150 0.013 0.000 0.451 219 R N -3.949 116.333 120.500 -0.364 0.000 2.241 219 R HA -0.223 3.420 4.340 -1.162 0.000 0.224 219 R C 1.083 177.201 176.300 -0.303 0.000 1.101 219 R CA 2.275 58.010 56.100 -0.608 0.000 0.995 219 R CB -0.143 29.854 30.300 -0.505 0.000 0.870 219 R HN -0.657 7.441 8.270 -0.286 0.000 0.463 220 D N -3.192 117.149 120.400 -0.098 0.000 2.349 220 D HA 0.067 4.750 4.640 0.072 0.000 0.214 220 D C -0.827 175.512 176.300 0.065 0.000 1.063 220 D CA 0.548 54.586 54.000 0.064 0.000 0.847 220 D CB 0.885 41.857 40.800 0.286 0.000 0.933 220 D HN -0.468 7.659 8.370 -0.145 0.156 0.513 221 L N -2.606 118.642 121.223 0.041 0.000 2.334 221 L HA 0.152 4.493 4.340 0.001 0.000 0.273 221 L C -1.657 175.260 176.870 0.080 0.000 1.013 221 L CA -0.915 53.934 54.840 0.015 0.000 0.816 221 L CB 2.021 43.992 42.059 -0.147 0.000 1.278 221 L HN -0.622 7.494 8.230 0.071 0.157 0.431 222 N N -1.885 116.722 118.700 -0.154 0.000 2.354 222 N HA 0.230 4.817 4.740 -0.254 0.000 0.253 222 N C -0.919 174.313 175.510 -0.463 0.000 1.096 222 N CA 0.726 53.548 53.050 -0.379 0.000 0.820 222 N CB 3.673 41.778 38.487 -0.637 0.000 1.610 222 N HN 0.618 9.246 8.380 -0.181 -0.356 0.501 223 H N 0.126 119.173 119.070 -0.038 0.000 2.472 223 H HA 0.577 5.102 4.556 -0.052 0.000 0.338 223 H C -2.578 172.682 175.328 -0.114 0.000 1.133 223 H CA -2.259 53.754 56.048 -0.058 0.000 1.216 223 H CB 0.793 30.538 29.762 -0.027 0.000 1.497 223 H HN -0.264 8.133 8.280 -0.292 -0.293 0.500 224 P HA 0.271 4.837 4.420 -0.127 -0.222 0.282 224 P C -0.470 176.776 177.300 -0.090 0.000 1.259 224 P CA -1.418 61.646 63.100 -0.059 0.000 0.826 224 P CB 1.722 33.414 31.700 -0.014 0.000 1.064 225 L N -0.922 120.195 121.223 -0.176 0.000 4.035 225 L HA -0.412 3.740 4.340 -0.313 0.000 0.490 225 L C -1.735 174.863 176.870 -0.454 0.000 1.163 225 L CA 0.589 55.255 54.840 -0.290 0.000 0.680 225 L CB -1.355 40.571 42.059 -0.222 0.000 1.409 225 L HN -0.256 7.862 8.230 -0.187 0.000 0.786 226 N N -2.018 116.375 118.700 -0.511 0.000 2.353 226 N HA -0.210 4.187 4.740 -0.572 0.000 0.248 226 N C 1.684 176.743 175.510 -0.752 0.000 1.240 226 N CA 0.959 53.557 53.050 -0.753 0.000 0.862 226 N CB 0.758 38.401 38.487 -1.407 0.000 1.086 226 N HN -0.414 7.688 8.380 -0.462 0.000 0.453 227 C N 0.063 119.029 119.300 -0.556 0.000 2.411 227 C HA -0.226 4.045 4.460 -0.314 0.000 0.279 227 C C 1.619 176.513 174.990 -0.161 0.000 1.288 227 C CA 2.899 61.742 59.018 -0.291 0.000 1.764 227 C CB -0.970 26.713 27.740 -0.095 0.000 1.974 227 C HN 0.869 8.812 8.230 -0.477 0.000 0.498 228 F N -3.207 116.710 119.950 -0.055 0.000 2.802 228 F HA 0.243 4.962 4.527 0.020 -0.181 0.300 228 F C 1.020 176.775 175.800 -0.074 0.000 1.168 228 F CA -1.130 56.848 58.000 -0.036 0.000 1.433 228 F CB -2.192 36.773 39.000 -0.057 0.000 1.115 228 F HN -0.447 7.458 8.300 -0.630 0.016 0.582 229 M N 0.748 120.190 119.600 -0.264 0.000 2.374 229 M HA -0.383 4.070 4.480 -0.045 0.000 0.264 229 M C 0.035 176.261 176.300 -0.122 0.000 1.067 229 M CA 4.090 59.294 55.300 -0.160 0.000 1.103 229 M CB -0.158 32.283 32.600 -0.264 0.000 1.402 229 M HN -0.126 7.713 8.290 -0.489 0.158 0.444 230 C N -6.553 112.618 119.300 -0.215 0.000 3.392 230 C HA 0.483 5.025 4.460 -0.195 -0.200 0.301 230 C C -1.042 173.754 174.990 -0.323 0.000 1.354 230 C CA -1.391 57.434 59.018 -0.322 0.000 1.732 230 C CB 0.953 28.379 27.740 -0.523 0.000 2.269 230 C HN -0.820 7.240 8.230 -0.250 0.021 0.673 231 H N -0.890 118.197 119.070 0.028 0.000 2.840 231 H HA 0.497 5.215 4.556 0.008 -0.157 0.340 231 H C -1.715 173.643 175.328 0.050 0.000 1.004 231 H CA -1.907 54.153 56.048 0.020 0.000 1.288 231 H CB 2.121 31.879 29.762 -0.006 0.000 1.607 231 H HN -0.589 7.607 8.280 0.036 0.105 0.522 232 D N 3.931 124.423 120.400 0.152 0.000 2.425 232 D HA 0.093 4.799 4.640 0.109 0.000 0.247 232 D C -0.073 176.262 176.300 0.058 0.000 1.147 232 D CA -1.340 52.725 54.000 0.109 0.000 0.879 232 D CB 2.190 43.066 40.800 0.127 0.000 1.179 232 D HN 0.026 8.479 8.370 0.139 0.000 0.456 233 P HA -0.130 4.359 4.420 0.114 0.000 0.223 233 P C 1.030 178.347 177.300 0.028 0.000 1.151 233 P CA 1.827 64.885 63.100 -0.071 0.000 0.787 233 P CB 0.480 31.969 31.700 -0.352 0.000 0.788 234 H N -1.266 117.959 119.070 0.258 0.000 2.370 234 H HA -0.023 4.811 4.556 0.463 0.000 0.304 234 H C 2.404 177.864 175.328 0.219 0.000 1.055 234 H CA 3.361 59.607 56.048 0.329 0.000 1.373 234 H CB 0.993 30.929 29.762 0.289 0.000 1.423 234 H HN 0.038 8.463 8.280 -0.113 -0.212 0.533 235 S N -1.733 114.092 115.700 0.208 0.000 2.503 235 S HA 0.102 4.734 4.470 0.070 -0.121 0.217 235 S C 0.178 174.726 174.600 -0.087 0.000 0.999 235 S CA 0.603 58.847 58.200 0.073 0.000 0.914 235 S CB 1.431 64.680 63.200 0.082 0.000 0.782 235 S HN -0.228 8.505 8.310 0.210 -0.298 0.520 236 A N 0.310 123.020 122.820 -0.183 0.000 3.413 236 A HA -0.363 3.853 4.320 -0.380 -0.124 0.268 236 A C -0.485 177.015 177.584 -0.140 0.000 1.128 236 A CA 0.962 52.771 52.037 -0.381 0.000 1.062 236 A CB -1.841 16.669 19.000 -0.816 0.000 1.121 236 A HN -0.115 7.982 8.150 -0.088 0.000 0.895 237 G N -2.239 106.547 108.800 -0.024 0.000 2.528 237 G HA2 0.322 4.294 3.960 0.020 0.000 0.289 237 G HA3 0.322 4.304 3.960 0.036 0.000 0.289 237 G C -2.939 172.019 174.900 0.098 0.000 1.192 237 G CA -2.340 42.780 45.100 0.033 0.000 0.921 237 G HN -0.518 7.714 8.290 -0.005 0.055 0.512 238 P HA 0.454 5.126 4.420 0.135 -0.171 0.275 238 P C -1.153 176.191 177.300 0.074 0.000 1.227 238 P CA -0.580 62.583 63.100 0.105 0.000 0.781 238 P CB 0.965 32.719 31.700 0.091 0.000 0.906 239 R N -1.907 118.621 120.500 0.047 0.000 2.747 239 R HA 0.799 5.302 4.340 0.057 -0.129 0.272 239 R C -2.105 174.207 176.300 0.020 0.000 1.032 239 R CA -1.320 54.810 56.100 0.050 0.000 0.896 239 R CB 3.814 34.161 30.300 0.079 0.000 1.253 239 R HN 0.204 8.387 8.270 0.015 0.097 0.461 240 V N -5.952 113.981 119.914 0.031 0.000 2.960 240 V HA 0.875 5.218 4.120 -0.002 -0.225 0.315 240 V C -0.764 175.350 176.094 0.034 0.000 1.087 240 V CA -3.147 59.161 62.300 0.015 0.000 0.982 240 V CB 4.068 35.893 31.823 0.005 0.000 1.039 240 V HN 0.419 8.634 8.190 0.042 0.000 0.437 241 V N -4.651 115.276 119.914 0.021 0.000 3.548 241 V HA 0.421 4.583 4.120 0.069 0.000 0.279 241 V C -0.568 175.533 176.094 0.012 0.000 1.446 241 V CA -1.743 60.583 62.300 0.042 0.000 1.023 241 V CB 1.798 33.660 31.823 0.064 0.000 0.820 241 V HN 0.451 8.994 8.190 -0.000 -0.353 0.438 242 R N 2.916 123.393 120.500 -0.038 0.000 2.351 242 R HA -0.068 4.223 4.340 -0.081 0.000 0.318 242 R C 0.540 176.741 176.300 -0.164 0.000 1.055 242 R CA -0.994 55.048 56.100 -0.097 0.000 0.968 242 R CB -0.200 30.040 30.300 -0.101 0.000 0.974 242 R HN -0.849 7.593 8.270 -0.038 -0.195 0.439 243 D N 8.015 128.339 120.400 -0.126 0.000 2.116 243 D HA -0.276 4.369 4.640 0.009 0.000 0.193 243 D C 1.753 177.778 176.300 -0.459 0.000 0.998 243 D CA 3.420 57.297 54.000 -0.206 0.000 0.836 243 D CB -0.919 39.709 40.800 -0.287 0.000 0.951 243 D HN 0.189 8.518 8.370 -0.067 0.000 0.449 244 G N -0.962 107.435 108.800 -0.672 0.000 2.442 244 G HA2 -0.269 3.274 3.960 -0.695 0.000 0.219 244 G HA3 -0.269 2.812 3.960 -1.465 0.000 0.219 244 G C 1.237 175.364 174.900 -1.288 0.000 1.141 244 G CA 1.704 46.165 45.100 -1.065 0.000 0.763 244 G HN 0.225 8.159 8.290 -0.593 0.000 0.554 245 L N 2.069 122.545 121.223 -1.246 0.000 2.044 245 L HA -0.167 3.762 4.340 -0.686 0.000 0.205 245 L C 1.462 178.059 176.870 -0.454 0.000 1.075 245 L CA 2.250 56.659 54.840 -0.718 0.000 0.747 245 L CB -0.030 41.823 42.059 -0.344 0.000 0.903 245 L HN -0.873 6.671 8.230 -1.117 0.015 0.435 246 I N -0.601 119.806 120.570 -0.271 0.000 2.264 246 I HA -0.549 3.560 4.170 -0.101 0.000 0.248 246 I C 2.222 178.305 176.117 -0.058 0.000 1.111 246 I CA 4.362 65.607 61.300 -0.091 0.000 1.382 246 I CB -0.603 37.444 38.000 0.079 0.000 1.060 246 I HN -0.549 7.504 8.210 -0.261 0.000 0.418 247 N N -0.058 118.586 118.700 -0.094 0.000 2.084 247 N HA -0.408 4.564 4.740 0.085 -0.181 0.190 247 N C 1.625 177.073 175.510 -0.103 0.000 1.030 247 N CA 3.780 56.798 53.050 -0.053 0.000 0.849 247 N CB 0.400 38.790 38.487 -0.161 0.000 1.012 247 N HN -0.127 8.133 8.380 -0.190 0.007 0.423 248 A N 0.271 122.952 122.820 -0.232 0.000 1.858 248 A HA -0.304 3.969 4.320 -0.079 0.000 0.216 248 A C 2.109 179.579 177.584 -0.190 0.000 1.190 248 A CA 3.154 55.062 52.037 -0.214 0.000 0.617 248 A CB -0.349 18.436 19.000 -0.360 0.000 0.827 248 A HN -0.628 7.322 8.150 -0.332 0.000 0.443 249 V N -2.393 117.337 119.914 -0.306 0.000 2.323 249 V HA -0.424 3.665 4.120 -0.051 0.000 0.244 249 V C 2.335 178.421 176.094 -0.013 0.000 1.041 249 V CA 4.308 66.524 62.300 -0.140 0.000 1.025 249 V CB 0.312 32.041 31.823 -0.156 0.000 0.656 249 V HN -0.336 7.623 8.190 -0.385 0.000 0.451 250 V N -0.978 118.920 119.914 -0.027 0.000 2.484 250 V HA -0.334 3.798 4.120 0.019 0.000 0.236 250 V C 2.244 178.351 176.094 0.021 0.000 1.062 250 V CA 3.684 65.988 62.300 0.007 0.000 1.081 250 V CB 0.386 32.207 31.823 -0.003 0.000 0.751 250 V HN 0.026 8.183 8.190 -0.056 0.000 0.484 251 D N 2.025 122.443 120.400 0.029 0.000 2.123 251 D HA -0.208 4.456 4.640 0.040 0.000 0.196 251 D C 1.806 178.137 176.300 0.051 0.000 0.992 251 D CA 3.089 57.118 54.000 0.049 0.000 0.833 251 D CB -0.328 40.524 40.800 0.087 0.000 0.954 251 D HN -0.654 7.733 8.370 0.028 0.000 0.455 252 R N -4.113 116.419 120.500 0.053 0.000 2.310 252 R HA 0.111 4.496 4.340 0.076 0.000 0.202 252 R C 0.338 176.690 176.300 0.086 0.000 0.933 252 R CA -0.265 55.881 56.100 0.076 0.000 1.054 252 R CB 0.255 30.613 30.300 0.095 0.000 0.985 252 R HN -0.427 7.867 8.270 0.040 0.000 0.489 253 G N -1.567 107.277 108.800 0.073 0.000 2.168 253 G HA2 -0.326 3.674 3.960 0.067 0.000 0.257 253 G HA3 -0.326 3.678 3.960 0.073 0.000 0.257 253 G C 0.379 175.345 174.900 0.109 0.000 0.997 253 G CA 1.014 46.161 45.100 0.078 0.000 0.708 253 G HN -0.415 7.733 8.290 0.059 0.178 0.520 254 L N -0.995 120.319 121.223 0.153 0.000 2.313 254 L HA -0.216 4.236 4.340 0.187 0.000 0.214 254 L C 0.013 177.022 176.870 0.231 0.000 1.119 254 L CA 0.682 55.659 54.840 0.228 0.000 0.809 254 L CB 0.073 42.376 42.059 0.407 0.000 0.933 254 L HN -0.747 7.543 8.230 0.142 0.026 0.449 255 G N -5.329 103.596 108.800 0.208 0.000 2.781 255 G HA2 -0.371 3.685 3.960 0.161 0.000 0.683 255 G HA3 -0.371 3.690 3.960 0.169 0.000 0.683 255 G C 0.108 175.211 174.900 0.339 0.000 1.390 255 G CA -0.521 44.702 45.100 0.205 0.000 0.850 255 G HN -0.502 7.860 8.290 0.166 0.027 0.557 256 T N -1.724 112.997 114.554 0.279 0.000 2.951 256 T HA -0.276 4.325 4.350 0.420 0.000 0.268 256 T C -0.762 173.932 174.700 -0.009 0.000 1.073 256 T CA 2.752 65.018 62.100 0.277 0.000 1.134 256 T CB 0.451 69.458 68.868 0.232 0.000 0.884 256 T HN 0.381 8.766 8.240 0.242 0.000 0.479 257 Y N 0.784 121.114 120.300 0.050 0.000 2.749 257 Y HA 0.385 4.664 4.550 -0.452 0.000 0.343 257 Y C -2.161 173.497 175.900 -0.403 0.000 1.015 257 Y CA -2.540 55.388 58.100 -0.286 0.000 1.270 257 Y CB 0.468 38.760 38.460 -0.280 0.000 1.097 257 Y HN -0.457 7.963 8.280 0.258 0.015 0.571 258 P HA -0.075 4.466 4.420 -0.094 -0.178 0.218 258 P C -0.285 176.917 177.300 -0.164 0.000 1.146 258 P CA 1.297 64.238 63.100 -0.265 0.000 0.813 258 P CB 0.509 31.968 31.700 -0.402 0.000 0.778 259 H N -7.293 111.582 119.070 -0.325 0.000 2.539 259 H HA 0.178 4.673 4.556 -0.102 0.000 0.269 259 H C -0.849 174.431 175.328 -0.080 0.000 0.980 259 H CA -0.976 54.982 56.048 -0.151 0.000 1.152 259 H CB -0.341 29.346 29.762 -0.125 0.000 1.407 259 H HN -0.266 7.898 8.280 -0.141 0.031 0.564 260 D N 0.874 120.994 120.400 -0.468 0.000 2.328 260 D HA 0.401 4.891 4.640 -0.250 0.000 0.243 260 D C -2.197 173.995 176.300 -0.179 0.000 1.324 260 D CA -2.475 51.310 54.000 -0.358 0.000 0.966 260 D CB 1.188 41.663 40.800 -0.542 0.000 1.324 260 D HN -0.343 7.624 8.370 -0.405 0.160 0.549 261 P HA -0.110 4.298 4.420 -0.020 0.000 0.218 261 P C 0.930 178.206 177.300 -0.040 0.000 1.149 261 P CA 1.706 64.781 63.100 -0.042 0.000 0.817 261 P CB 0.737 32.422 31.700 -0.024 0.000 0.785 262 V N -1.631 118.243 119.914 -0.068 0.000 2.323 262 V HA -0.496 3.601 4.120 -0.039 0.000 0.244 262 V C 1.481 177.528 176.094 -0.078 0.000 1.041 262 V CA 4.248 66.511 62.300 -0.061 0.000 1.025 262 V CB -0.228 31.555 31.823 -0.067 0.000 0.656 262 V HN -0.391 7.864 8.190 -0.084 -0.116 0.451 263 K N 0.078 120.390 120.400 -0.146 0.000 2.097 263 K HA -0.307 3.899 4.320 -0.191 0.000 0.206 263 K C 2.405 178.958 176.600 -0.079 0.000 1.049 263 K CA 2.988 59.141 56.287 -0.224 0.000 0.933 263 K CB -0.215 31.983 32.500 -0.502 0.000 0.717 263 K HN -0.483 7.954 8.250 -0.176 -0.292 0.442 264 S N -1.316 114.405 115.700 0.034 0.000 2.383 264 S HA -0.319 4.351 4.470 0.333 0.000 0.229 264 S C 0.667 175.334 174.600 0.112 0.000 1.030 264 S CA 3.091 61.394 58.200 0.172 0.000 1.002 264 S CB 0.056 63.332 63.200 0.127 0.000 0.829 264 S HN -0.261 8.040 8.310 -0.015 0.000 0.467 265 E N -0.268 119.962 120.200 0.050 0.000 2.122 265 E HA -0.173 4.208 4.350 0.051 0.000 0.190 265 E C 2.467 179.090 176.600 0.039 0.000 0.977 265 E CA 2.187 58.611 56.400 0.040 0.000 0.820 265 E CB -0.047 29.663 29.700 0.018 0.000 0.770 265 E HN -0.777 7.476 8.360 0.023 0.120 0.462 266 Q N -1.548 118.264 119.800 0.021 0.000 2.172 266 Q HA -0.170 4.182 4.340 0.020 0.000 0.200 266 Q C 1.636 177.666 176.000 0.050 0.000 0.964 266 Q CA 1.974 57.789 55.803 0.019 0.000 0.855 266 Q CB 0.834 29.564 28.738 -0.012 0.000 0.918 266 Q HN -0.523 7.749 8.270 0.003 0.000 0.444 267 Q N -1.753 118.100 119.800 0.088 0.000 2.773 267 Q HA 0.248 4.668 4.340 0.133 0.000 0.373 267 Q C -0.911 175.216 176.000 0.212 0.000 0.940 267 Q CA -1.318 54.581 55.803 0.161 0.000 1.015 267 Q CB 0.866 29.732 28.738 0.213 0.000 1.349 267 Q HN -0.138 8.185 8.270 0.087 0.000 0.413 268 G N -0.545 108.340 108.800 0.142 0.000 2.568 268 G HA2 0.323 4.414 3.960 0.159 0.000 0.293 268 G HA3 0.323 4.345 3.960 0.104 0.000 0.293 268 G C -2.823 172.140 174.900 0.106 0.000 1.347 268 G CA -1.953 43.225 45.100 0.130 0.000 1.039 268 G HN 0.131 8.800 8.290 0.111 -0.313 0.523 269 M N -0.700 118.948 119.600 0.082 0.000 2.393 269 M HA 0.830 5.540 4.480 0.063 -0.192 0.299 269 M C -1.460 174.863 176.300 0.038 0.000 1.103 269 M CA -0.620 54.716 55.300 0.060 0.000 0.910 269 M CB 4.217 36.847 32.600 0.050 0.000 1.659 269 M HN 0.159 8.496 8.290 0.078 0.000 0.445 270 T N 6.684 121.255 114.554 0.029 0.000 2.772 270 T HA 0.338 4.691 4.350 0.006 0.000 0.288 270 T C -1.732 172.966 174.700 -0.005 0.000 0.994 270 T CA -0.518 61.587 62.100 0.010 0.000 0.951 270 T CB 1.324 70.197 68.868 0.008 0.000 0.933 270 T HN 0.623 8.884 8.240 0.034 0.000 0.447 271 K N 8.848 129.232 120.400 -0.026 0.000 2.339 271 K HA 0.188 4.667 4.320 -0.035 -0.180 0.286 271 K C -0.622 175.927 176.600 -0.085 0.000 1.050 271 K CA -0.039 56.217 56.287 -0.053 0.000 0.956 271 K CB 0.621 33.073 32.500 -0.080 0.000 0.990 271 K HN 0.352 8.586 8.250 -0.026 0.000 0.475 272 V N 9.029 128.888 119.914 -0.091 0.000 2.448 272 V HA 0.276 4.270 4.120 -0.211 0.000 0.295 272 V C -1.290 174.636 176.094 -0.279 0.000 1.025 272 V CA -1.050 61.134 62.300 -0.194 0.000 0.859 272 V CB 2.328 34.046 31.823 -0.175 0.000 0.988 272 V HN 0.702 8.863 8.190 -0.048 0.000 0.431 273 T N 2.505 116.835 114.554 -0.372 0.000 2.895 273 T HA 0.578 5.003 4.350 -0.150 -0.165 0.283 273 T C -0.948 173.467 174.700 -0.475 0.000 1.014 273 T CA -2.711 59.220 62.100 -0.283 0.000 1.037 273 T CB 2.040 70.800 68.868 -0.180 0.000 1.006 273 T HN -0.001 8.027 8.240 -0.355 0.000 0.468 274 F N 2.254 122.223 119.950 0.031 0.000 2.520 274 F HA 0.249 4.816 4.527 0.066 0.000 0.322 274 F C -1.130 174.749 175.800 0.132 0.000 1.103 274 F CA -0.773 57.277 58.000 0.082 0.000 0.926 274 F CB 3.744 42.812 39.000 0.113 0.000 1.154 274 F HN 0.157 8.621 8.300 0.273 0.000 0.453 275 Q N 1.375 121.329 119.800 0.257 0.000 2.215 275 Q HA 0.570 5.193 4.340 0.234 -0.142 0.256 275 Q C -0.059 176.037 176.000 0.161 0.000 0.972 275 Q CA -0.774 55.150 55.803 0.201 0.000 0.889 275 Q CB 2.236 31.043 28.738 0.115 0.000 1.281 275 Q HN 0.417 8.821 8.270 0.224 0.000 0.456 276 R N 0.664 121.229 120.500 0.107 0.000 2.439 276 R HA 0.343 4.665 4.340 -0.030 0.000 0.310 276 R C 0.466 176.785 176.300 0.031 0.000 0.955 276 R CA -1.227 54.862 56.100 -0.019 0.000 0.853 276 R CB 0.974 31.125 30.300 -0.248 0.000 1.171 276 R HN 0.453 8.822 8.270 0.164 0.000 0.449 277 G N 6.868 115.676 108.800 0.012 0.000 2.622 277 G HA2 -0.426 3.538 3.960 0.007 0.000 0.307 277 G HA3 -0.426 3.539 3.960 0.009 0.000 0.307 277 G C -0.525 174.392 174.900 0.029 0.000 1.226 277 G CA 1.386 46.494 45.100 0.014 0.000 0.997 277 G HN 0.240 8.530 8.290 0.001 0.000 0.551 278 R N 4.368 124.883 120.500 0.026 0.000 2.334 278 R HA 0.165 4.521 4.340 0.026 0.000 0.216 278 R C -0.469 175.859 176.300 0.046 0.000 0.905 278 R CA -0.375 55.741 56.100 0.027 0.000 1.064 278 R CB 0.465 30.771 30.300 0.010 0.000 1.046 278 R HN 0.298 8.579 8.270 0.019 0.000 0.508 279 E N -0.137 120.111 120.200 0.080 0.000 2.179 279 E HA 0.245 4.645 4.350 0.084 0.000 0.275 279 E C -1.198 175.528 176.600 0.211 0.000 0.945 279 E CA -2.371 54.102 56.400 0.121 0.000 0.792 279 E CB 1.803 31.567 29.700 0.108 0.000 1.125 279 E HN -0.509 7.850 8.360 0.088 0.055 0.397 280 D N 2.982 123.491 120.400 0.182 0.000 2.472 280 D HA -0.184 4.557 4.640 0.169 0.000 0.237 280 D C -0.482 176.036 176.300 0.365 0.000 1.141 280 D CA 2.017 56.134 54.000 0.196 0.000 0.875 280 D CB 0.308 41.164 40.800 0.093 0.000 1.192 280 D HN 0.526 8.974 8.370 0.130 0.000 0.450 281 F N 4.498 124.494 119.950 0.077 0.000 2.347 281 F HA 0.385 4.751 4.527 -0.269 0.000 0.266 281 F C -2.262 173.527 175.800 -0.018 0.000 0.884 281 F CA -0.051 57.889 58.000 -0.100 0.000 1.123 281 F CB 4.194 43.099 39.000 -0.157 0.000 1.098 281 F HN 0.183 8.662 8.300 0.298 0.000 0.803 282 R N -3.647 116.820 120.500 -0.056 0.000 2.888 282 R HA 0.379 4.629 4.340 -0.152 0.000 0.264 282 R C -2.871 173.497 176.300 0.113 0.000 1.045 282 R CA -1.772 54.264 56.100 -0.107 0.000 0.962 282 R CB 3.262 33.443 30.300 -0.200 0.000 1.210 282 R HN -0.607 7.792 8.270 0.215 0.000 0.479 283 A N -1.164 121.731 122.820 0.125 0.000 2.587 283 A HA 1.093 5.707 4.320 0.190 -0.180 0.293 283 A C -2.079 175.616 177.584 0.185 0.000 1.087 283 A CA -1.280 50.815 52.037 0.097 0.000 0.692 283 A CB 3.388 22.215 19.000 -0.288 0.000 1.291 283 A HN 0.221 8.467 8.150 0.160 0.000 0.407 284 I N -6.001 114.687 120.570 0.196 0.000 3.145 284 I HA 0.604 4.856 4.170 0.137 0.000 0.313 284 I C -2.045 174.127 176.117 0.091 0.000 1.122 284 I CA -2.768 58.631 61.300 0.165 0.000 0.987 284 I CB 3.820 41.961 38.000 0.236 0.000 1.236 284 I HN 0.372 8.695 8.210 0.188 0.000 0.453 285 G N -0.051 108.793 108.800 0.074 0.000 2.814 285 G HA2 0.561 4.719 3.960 0.032 0.000 0.300 285 G HA3 0.561 4.541 3.960 0.032 0.000 0.300 285 G C -1.995 172.938 174.900 0.056 0.000 1.406 285 G CA -0.833 44.294 45.100 0.045 0.000 1.041 285 G HN 0.332 8.669 8.290 0.079 0.000 0.532 286 L N 6.653 127.910 121.223 0.057 0.000 2.367 286 L HA 0.085 4.468 4.340 0.072 0.000 0.275 286 L C -0.511 176.394 176.870 0.059 0.000 1.129 286 L CA 0.024 54.902 54.840 0.063 0.000 0.839 286 L CB 0.577 42.672 42.059 0.059 0.000 1.133 286 L HN 0.401 8.659 8.230 0.047 0.000 0.453 287 L N 3.107 124.370 121.223 0.067 0.000 2.334 287 L HA 0.097 4.648 4.340 0.080 -0.163 0.277 287 L C 0.045 176.959 176.870 0.073 0.000 1.075 287 L CA -0.102 54.784 54.840 0.076 0.000 0.804 287 L CB 0.690 42.800 42.059 0.086 0.000 1.174 287 L HN -0.067 8.204 8.230 0.068 0.000 0.438 288 D N 1.255 121.702 120.400 0.079 0.000 2.178 288 D HA -0.112 4.562 4.640 0.057 0.000 0.201 288 D C 0.047 176.389 176.300 0.069 0.000 0.980 288 D CA 2.640 56.681 54.000 0.068 0.000 0.842 288 D CB 0.525 41.368 40.800 0.071 0.000 0.948 288 D HN 0.260 8.683 8.370 0.089 0.000 0.472 289 T N -5.807 108.798 114.554 0.085 0.000 2.865 289 T HA 0.115 4.507 4.350 0.070 0.000 0.294 289 T C -1.290 173.466 174.700 0.092 0.000 1.119 289 T CA -2.139 60.011 62.100 0.083 0.000 1.007 289 T CB 2.874 71.795 68.868 0.088 0.000 1.225 289 T HN -0.902 7.375 8.240 0.098 0.022 0.515 290 A N 1.636 124.508 122.820 0.086 0.000 3.026 290 A HA -0.031 4.341 4.320 0.087 0.000 0.272 290 A C -0.953 176.689 177.584 0.096 0.000 1.782 290 A CA -0.319 51.771 52.037 0.089 0.000 1.451 290 A CB -0.982 18.071 19.000 0.089 0.000 1.081 290 A HN 0.316 8.513 8.150 0.079 0.000 0.611 291 D N 2.238 122.707 120.400 0.116 0.000 2.441 291 D HA 0.116 4.854 4.640 0.163 0.000 0.221 291 D C 0.548 176.932 176.300 0.140 0.000 1.156 291 D CA -1.367 52.729 54.000 0.160 0.000 0.896 291 D CB 0.360 41.297 40.800 0.229 0.000 1.028 291 D HN -0.589 7.825 8.370 0.114 0.025 0.509 292 S N 7.344 123.111 115.700 0.112 0.000 2.419 292 S HA -0.406 4.088 4.470 0.041 0.000 0.233 292 S C 1.560 176.219 174.600 0.099 0.000 1.016 292 S CA 2.753 60.995 58.200 0.070 0.000 0.974 292 S CB -0.066 63.153 63.200 0.031 0.000 0.786 292 S HN 0.133 8.510 8.310 0.111 0.000 0.492 293 N N 2.725 121.535 118.700 0.183 0.000 2.104 293 N HA -0.228 4.602 4.740 0.150 0.000 0.190 293 N C 2.259 177.894 175.510 0.209 0.000 1.024 293 N CA 2.950 56.133 53.050 0.221 0.000 0.853 293 N CB -0.303 38.430 38.487 0.409 0.000 1.008 293 N HN -0.444 8.266 8.380 0.228 -0.193 0.424 294 V N 0.010 120.047 119.914 0.205 0.000 2.649 294 V HA -0.394 3.896 4.120 0.283 0.000 0.248 294 V C 1.189 177.367 176.094 0.141 0.000 1.054 294 V CA 2.961 65.385 62.300 0.207 0.000 1.073 294 V CB 0.090 32.024 31.823 0.184 0.000 0.699 294 V HN -0.724 7.585 8.190 0.206 0.005 0.463 295 M N -0.108 119.546 119.600 0.089 0.000 2.080 295 M HA -0.453 4.038 4.480 0.018 0.000 0.260 295 M C 2.870 179.193 176.300 0.038 0.000 1.068 295 M CA 4.376 59.694 55.300 0.030 0.000 1.109 295 M CB -0.064 32.520 32.600 -0.026 0.000 1.342 295 M HN -0.564 7.781 8.290 0.092 0.000 0.405 296 C N -2.273 117.058 119.300 0.053 0.000 2.446 296 C HA -0.220 4.276 4.460 0.060 0.000 0.279 296 C C 1.760 176.832 174.990 0.136 0.000 1.366 296 C CA 2.980 62.035 59.018 0.062 0.000 1.763 296 C CB -2.201 25.525 27.740 -0.022 0.000 1.929 296 C HN -0.031 8.231 8.230 0.054 0.000 0.509 297 A N -1.664 121.260 122.820 0.173 0.000 2.248 297 A HA -0.217 4.247 4.320 0.239 0.000 0.210 297 A C 0.557 178.305 177.584 0.274 0.000 1.174 297 A CA 1.658 53.856 52.037 0.269 0.000 0.750 297 A CB -0.949 18.337 19.000 0.476 0.000 0.780 297 A HN -0.513 7.636 8.150 0.174 0.105 0.478 298 Q N -3.705 116.205 119.800 0.184 0.000 2.234 298 Q HA -0.294 4.204 4.340 0.264 0.000 0.206 298 Q C 0.119 176.225 176.000 0.176 0.000 0.980 298 Q CA 2.522 58.435 55.803 0.183 0.000 0.869 298 Q CB 0.422 29.188 28.738 0.047 0.000 0.912 298 Q HN -0.487 7.819 8.270 0.133 0.045 0.436 299 C N -7.502 111.816 119.300 0.029 0.000 3.484 299 C HA 0.304 4.664 4.460 -0.166 0.000 0.543 299 C C 0.552 175.351 174.990 -0.317 0.000 1.395 299 C CA -0.198 58.711 59.018 -0.182 0.000 2.412 299 C CB 2.911 30.468 27.740 -0.304 0.000 3.532 299 C HN -0.632 7.611 8.230 0.061 0.024 0.584 300 H N 4.258 123.243 119.070 -0.142 0.000 2.768 300 H HA 0.137 4.534 4.556 -0.265 0.000 0.219 300 H C -1.738 173.568 175.328 -0.037 0.000 1.898 300 H CA 0.533 56.494 56.048 -0.144 0.000 1.313 300 H CB -2.038 27.646 29.762 -0.131 0.000 1.701 300 H HN -0.143 8.199 8.280 0.103 0.000 0.534 301 V N -6.881 113.074 119.914 0.068 0.000 3.159 301 V HA 0.704 4.988 4.120 -0.057 -0.198 0.308 301 V C -1.404 174.685 176.094 -0.008 0.000 1.190 301 V CA -3.912 58.367 62.300 -0.035 0.000 1.037 301 V CB 3.960 35.664 31.823 -0.199 0.000 1.060 301 V HN -0.494 7.678 8.190 0.072 0.062 0.437 302 E N 2.005 122.110 120.200 -0.159 0.000 2.313 302 E HA 0.252 4.570 4.350 -0.276 -0.134 0.276 302 E C -1.304 175.382 176.600 0.143 0.000 1.031 302 E CA -0.977 55.314 56.400 -0.181 0.000 0.857 302 E CB 1.347 30.781 29.700 -0.444 0.000 1.040 302 E HN -0.165 8.499 8.360 -0.192 -0.419 0.408 303 Y N 2.271 122.614 120.300 0.072 0.000 2.638 303 Y HA 0.743 5.594 4.550 0.278 -0.134 0.335 303 Y C -2.045 174.069 175.900 0.358 0.000 1.155 303 Y CA -2.006 56.208 58.100 0.189 0.000 1.046 303 Y CB 2.555 40.980 38.460 -0.058 0.000 1.303 303 Y HN -0.422 7.684 8.280 -0.290 0.000 0.460 304 N N -0.149 118.727 118.700 0.293 0.000 2.421 304 N HA 0.341 5.230 4.740 0.058 -0.113 0.285 304 N C -1.013 174.745 175.510 0.412 0.000 1.027 304 N CA -0.687 52.455 53.050 0.153 0.000 0.918 304 N CB 3.253 41.662 38.487 -0.131 0.000 1.152 304 N HN 0.374 8.935 8.380 0.301 0.000 0.485 305 C N -0.553 118.998 119.300 0.419 0.000 3.181 305 C HA 0.728 5.585 4.460 0.363 -0.180 0.216 305 C C -1.936 173.250 174.990 0.327 0.000 1.834 305 C CA -2.717 56.579 59.018 0.464 0.000 1.208 305 C CB -0.021 28.125 27.740 0.677 0.000 2.103 305 C HN 0.644 9.046 8.230 0.287 0.000 0.579 306 N N -1.742 117.104 118.700 0.244 0.000 3.545 306 N HA 0.228 5.076 4.740 0.179 0.000 0.227 306 N C -3.658 171.972 175.510 0.201 0.000 1.380 306 N CA -0.622 52.554 53.050 0.209 0.000 0.892 306 N CB -0.478 38.145 38.487 0.226 0.000 1.441 306 N HN -0.650 7.860 8.380 0.217 0.000 0.497 307 P HA 0.286 4.845 4.420 0.103 -0.077 0.276 307 P C -1.086 176.218 177.300 0.006 0.000 1.261 307 P CA -0.657 62.476 63.100 0.055 0.000 0.800 307 P CB 1.074 32.736 31.700 -0.063 0.000 1.066 308 G N -3.543 105.099 108.800 -0.264 0.000 2.726 308 G HA2 0.557 4.083 3.960 -0.722 0.000 0.198 308 G HA3 0.557 4.069 3.960 -0.946 -0.120 0.198 308 G C -2.569 171.547 174.900 -1.306 0.000 1.195 308 G CA 0.717 45.341 45.100 -0.793 0.000 0.951 308 G HN 0.208 8.357 8.290 -0.234 0.000 0.532 309 Y N -3.466 116.201 120.300 -1.054 0.000 2.588 309 Y HA 0.664 5.101 4.550 -0.509 -0.193 0.343 309 Y C -1.249 174.194 175.900 -0.761 0.000 1.065 309 Y CA -1.412 56.163 58.100 -0.875 0.000 1.038 309 Y CB 4.724 42.455 38.460 -1.215 0.000 1.297 309 Y HN 0.128 7.548 8.280 -1.433 0.000 0.467 310 Q N -0.395 119.329 119.800 -0.127 0.000 2.261 310 Q HA 0.430 5.038 4.340 0.054 -0.236 0.252 310 Q C 1.162 177.326 176.000 0.273 0.000 0.915 310 Q CA -0.792 55.047 55.803 0.060 0.000 0.915 310 Q CB 1.192 29.978 28.738 0.080 0.000 1.204 310 Q HN 0.419 8.667 8.270 -0.036 0.000 0.421 311 L N 4.634 126.057 121.223 0.333 0.000 2.083 311 L HA -0.390 4.191 4.340 0.401 0.000 0.209 311 L C 1.013 177.975 176.870 0.153 0.000 1.083 311 L CA 2.695 57.715 54.840 0.301 0.000 0.752 311 L CB -0.149 42.013 42.059 0.172 0.000 0.899 311 L HN 0.500 8.870 8.230 0.278 0.027 0.433 312 S N -1.025 114.749 115.700 0.124 0.000 2.355 312 S HA -0.249 4.255 4.470 0.056 0.000 0.222 312 S C 0.676 175.321 174.600 0.074 0.000 1.031 312 S CA 2.571 60.817 58.200 0.077 0.000 0.993 312 S CB 0.453 63.693 63.200 0.068 0.000 0.859 312 S HN -0.153 8.505 8.310 0.132 -0.269 0.453 313 D N -3.473 116.984 120.400 0.095 0.000 2.538 313 D HA 0.023 4.703 4.640 0.066 0.000 0.241 313 D C 0.288 176.650 176.300 0.104 0.000 1.297 313 D CA -0.887 53.161 54.000 0.080 0.000 0.804 313 D CB 0.714 41.551 40.800 0.061 0.000 1.122 313 D HN -0.721 7.716 8.370 0.111 0.000 0.519 314 G N 0.774 109.674 108.800 0.166 0.000 2.184 314 G HA2 -0.393 3.825 3.960 0.306 0.000 0.264 314 G HA3 -0.393 3.659 3.960 0.152 0.000 0.264 314 G C 0.068 175.072 174.900 0.173 0.000 0.975 314 G CA 0.625 45.843 45.100 0.196 0.000 0.642 314 G HN 0.200 8.515 8.290 0.203 0.097 0.536 315 S N -0.706 115.069 115.700 0.125 0.000 2.593 315 S HA -0.106 4.438 4.470 0.123 0.000 0.269 315 S C -0.364 174.283 174.600 0.079 0.000 1.334 315 S CA -0.180 58.084 58.200 0.105 0.000 1.015 315 S CB 1.247 64.482 63.200 0.058 0.000 0.912 315 S HN -0.342 8.288 8.310 0.105 -0.257 0.541 316 R N 1.794 122.314 120.500 0.033 0.000 2.537 316 R HA -0.070 4.186 4.340 -0.375 -0.141 0.280 316 R C 0.033 176.239 176.300 -0.157 0.000 1.058 316 R CA 0.922 56.926 56.100 -0.160 0.000 1.057 316 R CB 0.653 30.890 30.300 -0.105 0.000 0.973 316 R HN 0.289 8.592 8.270 0.054 0.000 0.438 317 V N 5.035 124.801 119.914 -0.248 0.000 2.326 317 V HA 0.164 4.262 4.120 -0.037 0.000 0.281 317 V C -1.637 174.416 176.094 -0.069 0.000 1.015 317 V CA -0.938 61.313 62.300 -0.081 0.000 0.823 317 V CB 1.796 33.647 31.823 0.046 0.000 1.009 317 V HN 0.682 8.504 8.190 -0.431 0.109 0.436 318 G N 5.503 114.281 108.800 -0.036 0.000 2.535 318 G HA2 0.075 4.007 3.960 -0.046 0.000 0.303 318 G HA3 0.075 4.097 3.960 -0.022 -0.075 0.303 318 G C 0.762 175.673 174.900 0.018 0.000 1.237 318 G CA -1.261 43.825 45.100 -0.024 0.000 0.986 318 G HN 0.246 8.521 8.290 -0.025 0.000 0.494 319 M N -0.757 118.860 119.600 0.029 0.000 2.358 319 M HA -0.282 4.239 4.480 0.068 0.000 0.264 319 M C 0.738 177.059 176.300 0.034 0.000 1.064 319 M CA 1.685 57.017 55.300 0.052 0.000 1.093 319 M CB -1.041 31.600 32.600 0.069 0.000 1.401 319 M HN 0.408 8.711 8.290 0.022 0.000 0.440 320 D N -5.605 114.806 120.400 0.018 0.000 2.264 320 D HA -0.228 4.411 4.640 -0.001 0.000 0.208 320 D C 0.395 176.694 176.300 -0.002 0.000 0.966 320 D CA 1.701 55.703 54.000 0.004 0.000 0.864 320 D CB -0.856 39.945 40.800 0.002 0.000 0.933 320 D HN 0.159 8.513 8.370 0.016 0.026 0.499 321 D N 0.817 121.221 120.400 0.006 0.000 2.350 321 D HA -0.000 4.637 4.640 -0.004 0.000 0.249 321 D C 0.795 177.089 176.300 -0.011 0.000 1.119 321 D CA 0.293 54.294 54.000 0.001 0.000 0.886 321 D CB 1.973 42.782 40.800 0.015 0.000 1.195 321 D HN -0.528 7.715 8.370 0.013 0.135 0.437 322 R N 6.224 126.709 120.500 -0.026 0.000 2.139 322 R HA -0.339 3.978 4.340 -0.038 0.000 0.243 322 R C 2.180 178.445 176.300 -0.059 0.000 1.145 322 R CA 2.157 58.233 56.100 -0.039 0.000 0.976 322 R CB -0.189 30.088 30.300 -0.038 0.000 0.866 322 R HN 0.624 8.880 8.270 -0.024 0.000 0.449 323 R N -2.774 117.667 120.500 -0.099 0.000 2.241 323 R HA -0.263 3.884 4.340 -0.321 0.000 0.224 323 R C 0.684 176.850 176.300 -0.222 0.000 1.101 323 R CA 2.317 58.276 56.100 -0.236 0.000 0.995 323 R CB -0.281 29.875 30.300 -0.240 0.000 0.870 323 R HN -0.177 8.383 8.270 -0.074 -0.335 0.463 324 A N -4.162 118.624 122.820 -0.057 0.000 2.209 324 A HA -0.102 4.364 4.320 0.015 -0.137 0.212 324 A C -1.214 176.422 177.584 0.088 0.000 1.158 324 A CA 0.593 52.646 52.037 0.027 0.000 0.742 324 A CB 0.856 19.904 19.000 0.081 0.000 0.790 324 A HN -0.483 7.614 8.150 -0.024 0.038 0.472 325 N N -2.126 116.618 118.700 0.073 0.000 2.617 325 N HA 0.228 5.240 4.740 0.206 -0.147 0.263 325 N C -1.878 173.706 175.510 0.124 0.000 1.074 325 N CA -0.425 52.706 53.050 0.135 0.000 0.841 325 N CB 0.922 39.480 38.487 0.119 0.000 1.221 325 N HN -0.755 7.602 8.380 0.028 0.040 0.529 326 H N 6.353 125.452 119.070 0.049 0.000 2.947 326 H HA 0.257 4.769 4.556 -0.073 0.000 0.354 326 H C -2.442 173.018 175.328 0.220 0.000 1.085 326 H CA -0.304 55.711 56.048 -0.057 0.000 1.253 326 H CB 3.440 32.961 29.762 -0.401 0.000 1.757 326 H HN 0.170 8.627 8.280 0.294 0.000 0.523 327 F N 6.104 125.732 119.950 -0.537 0.000 2.405 327 F HA 0.211 4.749 4.527 0.018 0.000 0.355 327 F C 0.142 175.670 175.800 -0.454 0.000 1.121 327 F CA -2.749 55.099 58.000 -0.253 0.000 1.112 327 F CB -0.259 38.682 39.000 -0.098 0.000 1.126 327 F HN 0.594 8.768 8.300 -0.209 0.000 0.481 328 F N 3.395 123.420 119.950 0.126 0.000 2.186 328 F HA -0.157 4.476 4.527 0.176 0.000 0.299 328 F C 0.975 177.050 175.800 0.457 0.000 1.090 328 F CA 2.594 60.746 58.000 0.255 0.000 1.307 328 F CB 0.827 40.055 39.000 0.380 0.000 1.019 328 F HN -0.135 8.491 8.300 0.543 0.000 0.489 329 W N -2.912 118.651 121.300 0.439 0.000 5.563 329 W HA -0.409 4.581 4.660 0.550 0.000 0.396 329 W C -2.408 174.501 176.519 0.650 0.000 1.519 329 W CA -0.146 57.513 57.345 0.524 0.000 0.953 329 W CB -1.518 28.193 29.460 0.418 0.000 2.691 329 W HN -0.162 8.494 8.180 0.793 0.000 1.444 330 A N -0.908 122.279 122.820 0.611 0.000 2.422 330 A HA 0.223 4.855 4.320 0.519 0.000 0.302 330 A C -1.813 176.046 177.584 0.459 0.000 1.041 330 A CA -1.245 51.112 52.037 0.533 0.000 0.708 330 A CB 2.927 22.215 19.000 0.479 0.000 1.257 330 A HN -0.573 7.932 8.150 0.592 0.000 0.414 331 N N 2.658 121.580 118.700 0.370 0.000 2.317 331 N HA -0.100 4.722 4.740 0.136 0.000 0.245 331 N C 1.120 176.457 175.510 -0.288 0.000 1.294 331 N CA -0.777 52.341 53.050 0.113 0.000 0.924 331 N CB 0.409 38.999 38.487 0.172 0.000 1.186 331 N HN 0.062 8.692 8.380 0.416 0.000 0.495 332 V N -1.667 117.643 119.914 -1.006 0.000 2.392 332 V HA -0.335 2.475 4.120 -2.183 0.000 0.249 332 V C 0.213 175.960 176.094 -0.578 0.000 1.059 332 V CA 2.829 64.165 62.300 -1.607 0.000 1.051 332 V CB 0.210 30.786 31.823 -2.079 0.000 0.658 332 V HN 0.312 7.942 8.190 -0.935 0.000 0.455 333 F N -6.373 113.540 119.950 -0.061 0.000 2.748 333 F HA -0.074 4.600 4.527 0.245 0.000 0.299 333 F C 0.655 176.536 175.800 0.136 0.000 1.154 333 F CA 0.214 58.282 58.000 0.113 0.000 1.446 333 F CB -0.537 38.495 39.000 0.055 0.000 1.112 333 F HN -0.705 7.530 8.300 -0.305 -0.118 0.584 334 D N -2.691 117.857 120.400 0.246 0.000 2.407 334 D HA 0.152 4.933 4.640 0.235 0.000 0.208 334 D C 0.537 176.980 176.300 0.238 0.000 1.083 334 D CA 0.063 54.206 54.000 0.239 0.000 0.844 334 D CB 1.369 42.311 40.800 0.237 0.000 0.967 334 D HN -0.400 8.041 8.370 0.166 0.029 0.506 335 Y N 2.162 122.514 120.300 0.087 0.000 2.145 335 Y HA -0.511 4.132 4.550 0.155 0.000 0.286 335 Y C 0.621 176.601 175.900 0.133 0.000 1.145 335 Y CA 4.330 62.483 58.100 0.090 0.000 1.148 335 Y CB 0.165 38.621 38.460 -0.007 0.000 0.981 335 Y HN -0.523 7.900 8.280 0.240 0.000 0.507 336 K N -1.341 119.194 120.400 0.224 0.000 2.063 336 K HA -0.462 4.003 4.320 0.241 0.000 0.208 336 K C 1.799 178.442 176.600 0.071 0.000 1.048 336 K CA 3.718 60.120 56.287 0.191 0.000 0.928 336 K CB -0.472 32.184 32.500 0.260 0.000 0.713 336 K HN 0.312 8.742 8.250 0.301 0.000 0.442 337 E N -0.940 119.323 120.200 0.106 0.000 2.077 337 E HA -0.268 4.312 4.350 0.082 -0.181 0.193 337 E C 2.020 178.684 176.600 0.106 0.000 0.989 337 E CA 2.977 59.437 56.400 0.100 0.000 0.800 337 E CB -0.422 29.353 29.700 0.124 0.000 0.746 337 E HN -0.016 8.430 8.360 0.144 0.000 0.452 338 A N -0.965 121.924 122.820 0.115 0.000 1.902 338 A HA -0.283 4.175 4.320 0.231 0.000 0.217 338 A C 2.035 179.755 177.584 0.226 0.000 1.181 338 A CA 2.919 55.078 52.037 0.203 0.000 0.623 338 A CB -0.701 18.482 19.000 0.303 0.000 0.818 338 A HN -0.431 7.705 8.150 0.105 0.077 0.443 339 A N -2.312 120.536 122.820 0.048 0.000 1.929 339 A HA -0.384 4.201 4.320 0.440 0.000 0.216 339 A C 2.092 179.791 177.584 0.191 0.000 1.176 339 A CA 2.558 54.704 52.037 0.182 0.000 0.628 339 A CB -0.388 18.628 19.000 0.027 0.000 0.816 339 A HN -0.066 7.995 8.150 -0.149 0.000 0.444 340 Q N -1.611 118.252 119.800 0.106 0.000 2.124 340 Q HA -0.385 4.009 4.340 0.090 0.000 0.202 340 Q C 3.267 179.325 176.000 0.097 0.000 0.977 340 Q CA 3.108 58.962 55.803 0.085 0.000 0.850 340 Q CB -0.096 28.667 28.738 0.041 0.000 0.901 340 Q HN -0.050 8.264 8.270 0.073 0.000 0.429 341 E N 0.294 120.557 120.200 0.105 0.000 2.130 341 E HA -0.276 4.122 4.350 0.082 0.000 0.196 341 E C 1.409 178.051 176.600 0.069 0.000 0.998 341 E CA 2.727 59.183 56.400 0.093 0.000 0.806 341 E CB 0.003 29.773 29.700 0.118 0.000 0.738 341 E HN -0.123 8.305 8.360 0.114 0.000 0.459 342 I N -10.482 110.126 120.570 0.064 0.000 3.928 342 I HA 0.319 4.480 4.170 -0.015 0.000 0.335 342 I C -1.249 174.931 176.117 0.105 0.000 1.325 342 I CA -1.301 59.999 61.300 0.001 0.000 1.107 342 I CB 0.387 38.248 38.000 -0.231 0.000 1.014 342 I HN -0.918 7.345 8.210 0.101 0.007 0.400 343 D N 0.660 121.152 120.400 0.153 0.000 2.828 343 D HA -0.383 4.356 4.640 0.165 0.000 0.241 343 D C -2.428 174.037 176.300 0.275 0.000 1.142 343 D CA 1.473 55.580 54.000 0.178 0.000 0.755 343 D CB -1.323 39.548 40.800 0.119 0.000 1.014 343 D HN -0.317 7.950 8.370 0.141 0.187 0.420 344 F N 0.290 120.335 119.950 0.159 0.000 2.596 344 F HA 0.703 5.491 4.527 0.108 -0.195 0.311 344 F C -2.417 173.590 175.800 0.344 0.000 1.116 344 F CA -1.026 57.079 58.000 0.175 0.000 0.957 344 F CB 3.678 42.757 39.000 0.132 0.000 1.250 344 F HN -0.755 7.786 8.300 0.401 0.000 0.444 345 F N 1.251 120.999 119.950 -0.337 0.000 2.629 345 F HA 0.451 5.073 4.527 0.159 0.000 0.316 345 F C -2.166 173.415 175.800 -0.364 0.000 1.081 345 F CA -1.875 56.053 58.000 -0.121 0.000 0.954 345 F CB 2.331 41.359 39.000 0.046 0.000 1.337 345 F HN 0.696 8.540 8.300 -0.759 0.000 0.474 346 D N 0.460 120.989 120.400 0.214 0.000 2.197 346 D HA 0.057 4.729 4.640 0.054 0.000 0.212 346 D C -0.781 175.803 176.300 0.473 0.000 0.963 346 D CA 4.152 58.314 54.000 0.270 0.000 0.864 346 D CB 2.187 43.278 40.800 0.485 0.000 1.009 346 D HN -0.161 8.459 8.370 0.417 0.000 0.479 347 F N -4.863 115.295 119.950 0.346 0.000 2.686 347 F HA 0.351 5.054 4.527 0.293 0.000 0.311 347 F C -2.445 173.520 175.800 0.276 0.000 1.128 347 F CA -1.822 56.353 58.000 0.291 0.000 0.946 347 F CB 1.681 40.815 39.000 0.223 0.000 1.336 347 F HN -0.684 7.930 8.300 0.523 0.000 0.457 348 R N 0.445 120.995 120.500 0.083 0.000 2.294 348 R HA 0.472 4.841 4.340 -0.314 -0.217 0.319 348 R C -0.162 176.063 176.300 -0.126 0.000 0.984 348 R CA -1.468 54.538 56.100 -0.155 0.000 0.861 348 R CB 1.337 31.576 30.300 -0.101 0.000 1.104 348 R HN 0.384 8.768 8.270 0.190 0.000 0.451 349 H N 5.854 124.685 119.070 -0.397 0.000 2.964 349 H HA -0.131 4.594 4.556 0.023 -0.155 0.328 349 H C 0.879 176.174 175.328 -0.055 0.000 1.030 349 H CA 1.627 57.572 56.048 -0.173 0.000 1.445 349 H CB 2.132 31.743 29.762 -0.253 0.000 1.449 349 H HN -0.006 8.056 8.280 -0.364 0.000 0.581 350 A N 8.822 131.448 122.820 -0.324 0.000 2.019 350 A HA -0.210 4.066 4.320 -0.072 0.000 0.219 350 A C 0.436 177.991 177.584 -0.049 0.000 1.164 350 A CA 2.551 54.496 52.037 -0.154 0.000 0.644 350 A CB 0.129 19.024 19.000 -0.174 0.000 0.805 350 A HN 0.582 8.270 8.150 -0.592 0.107 0.449 351 T N -1.995 112.613 114.554 0.089 0.000 3.045 351 T HA 0.173 4.566 4.350 0.072 0.000 0.239 351 T C 1.599 176.323 174.700 0.040 0.000 1.008 351 T CA 2.422 64.604 62.100 0.137 0.000 1.143 351 T CB 1.278 70.269 68.868 0.205 0.000 0.894 351 T HN -0.489 7.852 8.240 0.215 0.028 0.451 352 T N -2.132 112.395 114.554 -0.046 0.000 3.054 352 T HA -0.026 3.704 4.350 -1.033 0.000 0.259 352 T C 1.203 175.648 174.700 -0.424 0.000 1.092 352 T CA 1.150 62.785 62.100 -0.774 0.000 1.121 352 T CB 1.244 69.300 68.868 -1.353 0.000 0.912 352 T HN -0.558 7.886 8.240 0.340 0.000 0.489 353 G N 1.778 110.481 108.800 -0.162 0.000 2.168 353 G HA2 -0.514 3.469 3.960 -0.098 0.000 0.263 353 G HA3 -0.514 3.394 3.960 -0.087 0.000 0.263 353 G C -1.391 173.393 174.900 -0.193 0.000 0.977 353 G CA 0.519 45.544 45.100 -0.126 0.000 0.659 353 G HN -0.207 8.041 8.290 -0.071 0.000 0.533 354 A N 0.736 123.392 122.820 -0.273 0.000 2.462 354 A HA 0.113 4.278 4.320 -0.260 0.000 0.243 354 A C -0.998 176.290 177.584 -0.492 0.000 1.076 354 A CA -0.316 51.520 52.037 -0.336 0.000 0.773 354 A CB 0.867 19.646 19.000 -0.368 0.000 1.010 354 A HN -0.518 7.404 8.150 -0.293 0.051 0.493 355 A N 3.541 126.002 122.820 -0.597 0.000 2.492 355 A HA 0.062 3.858 4.320 -1.070 -0.118 0.254 355 A C -0.831 176.344 177.584 -0.682 0.000 1.091 355 A CA 0.384 51.791 52.037 -1.050 0.000 0.768 355 A CB 0.082 18.055 19.000 -1.713 0.000 1.028 355 A HN 0.339 8.176 8.150 -0.521 0.000 0.498 356 L N 3.176 123.997 121.223 -0.671 0.000 2.354 356 L HA 0.563 4.473 4.340 -0.717 0.000 0.264 356 L C -2.647 174.010 176.870 -0.356 0.000 1.008 356 L CA -3.322 51.067 54.840 -0.751 0.000 0.819 356 L CB 3.272 44.521 42.059 -1.350 0.000 1.339 356 L HN 0.385 8.250 8.230 -0.609 0.000 0.420 357 P HA 0.274 4.933 4.420 0.189 -0.125 0.281 357 P C -2.080 175.215 177.300 -0.009 0.000 1.249 357 P CA -1.594 61.485 63.100 -0.035 0.000 0.810 357 P CB 1.112 32.783 31.700 -0.049 0.000 1.008 358 K N 1.171 121.595 120.400 0.041 0.000 2.307 358 K HA 0.313 4.690 4.320 -0.148 -0.146 0.263 358 K C -0.406 175.981 176.600 -0.356 0.000 0.973 358 K CA -1.740 54.429 56.287 -0.197 0.000 0.846 358 K CB 1.745 33.984 32.500 -0.434 0.000 1.100 358 K HN -0.089 8.539 8.250 0.120 -0.306 0.438 359 L N 5.492 126.434 121.223 -0.469 0.000 2.334 359 L HA 0.319 4.417 4.340 -0.681 -0.166 0.275 359 L C 0.306 176.759 176.870 -0.696 0.000 1.036 359 L CA -1.383 53.068 54.840 -0.649 0.000 0.807 359 L CB 0.640 42.272 42.059 -0.712 0.000 1.231 359 L HN -0.003 8.282 8.230 -0.407 -0.299 0.438 360 Q N -0.851 118.487 119.800 -0.770 0.000 2.305 360 Q HA 0.249 4.182 4.340 -0.677 0.000 0.271 360 Q C -1.184 174.249 176.000 -0.946 0.000 1.046 360 Q CA -1.613 53.688 55.803 -0.838 0.000 0.798 360 Q CB 4.009 32.252 28.738 -0.825 0.000 1.286 360 Q HN 0.181 8.194 8.270 -0.796 -0.221 0.435 361 H N -1.260 117.646 119.070 -0.273 0.000 1.694 361 H HA -0.295 4.265 4.556 -0.263 -0.163 0.323 361 H C -1.432 173.706 175.328 -0.318 0.000 0.802 361 H CA -0.835 55.070 56.048 -0.238 0.000 1.074 361 H CB -1.904 27.813 29.762 -0.075 0.000 1.518 361 H HN 0.454 8.450 8.280 -0.475 0.000 0.270 362 P HA 0.249 4.604 4.420 -0.390 -0.168 0.214 362 P C -0.625 176.502 177.300 -0.289 0.000 1.807 362 P CA -0.844 61.922 63.100 -0.557 0.000 0.921 362 P CB -0.742 30.138 31.700 -1.367 0.000 1.835 363 E N 2.348 122.496 120.200 -0.087 0.000 2.077 363 E HA -0.320 4.292 4.350 0.098 -0.203 0.193 363 E C 1.755 178.279 176.600 -0.127 0.000 0.989 363 E CA 3.732 60.127 56.400 -0.009 0.000 0.800 363 E CB -0.683 29.029 29.700 0.020 0.000 0.746 363 E HN -0.425 7.871 8.360 -0.009 0.059 0.452 364 A N -1.093 121.615 122.820 -0.188 0.000 1.877 364 A HA -0.351 3.852 4.320 -0.195 0.000 0.216 364 A C 1.864 178.908 177.584 -0.900 0.000 1.186 364 A CA 3.748 55.590 52.037 -0.324 0.000 0.620 364 A CB -0.469 18.442 19.000 -0.149 0.000 0.822 364 A HN -0.272 7.802 8.150 -0.127 0.000 0.443 365 E N -4.414 115.211 120.200 -0.958 0.000 2.285 365 E HA -0.224 2.367 4.350 -2.932 0.000 0.194 365 E C 1.727 178.044 176.600 -0.472 0.000 0.997 365 E CA 2.726 58.313 56.400 -1.354 0.000 0.845 365 E CB -0.588 28.729 29.700 -0.638 0.000 0.782 365 E HN 0.291 8.281 8.360 -0.617 0.000 0.491 366 T N 0.186 114.672 114.554 -0.113 0.000 2.851 366 T HA -0.113 4.545 4.350 0.265 -0.149 0.262 366 T C 0.438 175.268 174.700 0.217 0.000 1.043 366 T CA 3.264 65.482 62.100 0.197 0.000 1.140 366 T CB 0.522 69.588 68.868 0.330 0.000 0.872 366 T HN -0.590 7.539 8.240 -0.141 0.026 0.446 367 F N 0.629 120.544 119.950 -0.058 0.000 2.216 367 F HA -0.134 4.462 4.527 0.116 0.000 0.300 367 F C -0.149 175.739 175.800 0.146 0.000 1.085 367 F CA 1.122 59.139 58.000 0.028 0.000 1.326 367 F CB 0.704 39.656 39.000 -0.081 0.000 1.027 367 F HN -0.628 7.742 8.300 0.118 0.000 0.497 368 W N -1.512 119.776 121.300 -0.020 0.000 2.385 368 W HA -0.323 4.234 4.660 -0.171 0.000 0.336 368 W C 0.698 176.987 176.519 -0.383 0.000 1.351 368 W CA 1.938 59.122 57.345 -0.267 0.000 1.295 368 W CB -1.817 27.392 29.460 -0.419 0.000 1.239 368 W HN -0.780 7.324 8.180 -0.107 0.012 0.565 369 G N 2.548 111.257 108.800 -0.153 0.000 2.205 369 G HA2 -0.422 3.544 3.960 0.010 0.000 0.261 369 G HA3 -0.422 3.467 3.960 -0.118 0.000 0.261 369 G C -0.812 174.065 174.900 -0.038 0.000 0.980 369 G CA -0.104 44.945 45.100 -0.085 0.000 0.632 369 G HN 0.463 9.121 8.290 -0.014 -0.376 0.533 370 S N -0.957 114.688 115.700 -0.092 0.000 2.589 370 S HA 0.025 4.484 4.470 -0.019 0.000 0.265 370 S C 1.382 175.922 174.600 -0.100 0.000 1.342 370 S CA -1.129 57.028 58.200 -0.073 0.000 1.005 370 S CB 2.430 65.603 63.200 -0.045 0.000 0.909 370 S HN -0.735 7.413 8.310 -0.149 0.072 0.555 371 V N 2.526 122.385 119.914 -0.093 0.000 2.332 371 V HA -0.454 3.604 4.120 -0.103 0.000 0.248 371 V C 1.682 177.686 176.094 -0.150 0.000 1.055 371 V CA 4.277 66.492 62.300 -0.141 0.000 1.038 371 V CB -0.010 31.691 31.823 -0.202 0.000 0.651 371 V HN 0.551 8.693 8.190 -0.079 0.000 0.450 372 H N -2.811 116.275 119.070 0.027 0.000 2.357 372 H HA -0.344 4.289 4.556 0.129 0.000 0.301 372 H C 1.776 177.103 175.328 -0.001 0.000 1.082 372 H CA 4.106 60.225 56.048 0.118 0.000 1.342 372 H CB -0.278 29.706 29.762 0.369 0.000 1.389 372 H HN -0.283 7.983 8.280 -0.023 0.000 0.511 373 E N -0.059 119.967 120.200 -0.289 0.000 2.106 373 E HA -0.249 4.137 4.350 -0.204 -0.158 0.192 373 E C 2.868 179.429 176.600 -0.065 0.000 0.984 373 E CA 2.602 58.765 56.400 -0.395 0.000 0.806 373 E CB -0.281 28.921 29.700 -0.830 0.000 0.750 373 E HN -0.629 7.450 8.360 -0.467 0.000 0.458 374 R N -2.442 118.025 120.500 -0.055 0.000 2.148 374 R HA -0.139 4.201 4.340 0.000 0.000 0.227 374 R C 1.781 178.073 176.300 -0.014 0.000 1.103 374 R CA 1.709 57.801 56.100 -0.014 0.000 0.983 374 R CB -0.347 29.947 30.300 -0.011 0.000 0.874 374 R HN 0.020 8.237 8.270 -0.088 0.000 0.451 375 N N -3.053 115.650 118.700 0.006 0.000 2.314 375 N HA 0.033 4.774 4.740 0.001 0.000 0.200 375 N C 0.106 175.650 175.510 0.056 0.000 1.135 375 N CA 0.268 53.331 53.050 0.022 0.000 0.835 375 N CB 0.364 38.864 38.487 0.022 0.000 0.989 375 N HN -0.668 7.592 8.380 0.011 0.127 0.478 376 G N -0.585 108.254 108.800 0.065 0.000 2.143 376 G HA2 -0.461 3.535 3.960 0.061 0.000 0.248 376 G HA3 -0.461 3.530 3.960 0.051 0.000 0.248 376 G C -0.480 174.516 174.900 0.159 0.000 0.991 376 G CA 0.510 45.658 45.100 0.080 0.000 0.689 376 G HN -0.372 7.783 8.290 0.053 0.167 0.522 377 V N -0.131 119.928 119.914 0.242 0.000 2.732 377 V HA -0.105 4.284 4.120 0.229 -0.132 0.297 377 V C -1.320 175.040 176.094 0.442 0.000 1.060 377 V CA 0.182 62.670 62.300 0.314 0.000 1.038 377 V CB 0.616 32.672 31.823 0.388 0.000 1.003 377 V HN -0.696 7.597 8.190 0.244 0.043 0.481 378 A N 2.623 125.618 122.820 0.293 0.000 2.485 378 A HA 0.656 5.382 4.320 0.402 -0.165 0.292 378 A C 0.887 178.478 177.584 0.012 0.000 1.147 378 A CA -2.092 50.091 52.037 0.244 0.000 0.750 378 A CB 3.109 22.236 19.000 0.213 0.000 1.331 378 A HN 0.262 8.856 8.150 0.203 -0.322 0.419 379 C N -0.633 118.604 119.300 -0.106 0.000 2.401 379 C HA -0.392 3.919 4.460 -0.249 0.000 0.276 379 C C 2.069 177.046 174.990 -0.022 0.000 1.233 379 C CA 3.885 62.814 59.018 -0.148 0.000 1.753 379 C CB -1.826 25.827 27.740 -0.146 0.000 2.029 379 C HN 0.341 8.735 8.230 -0.064 -0.202 0.478 380 A N -1.096 121.720 122.820 -0.007 0.000 2.019 380 A HA -0.346 3.973 4.320 -0.001 0.000 0.219 380 A C 2.227 179.801 177.584 -0.017 0.000 1.164 380 A CA 3.032 55.065 52.037 -0.007 0.000 0.644 380 A CB -0.844 18.148 19.000 -0.013 0.000 0.805 380 A HN -0.009 8.134 8.150 0.002 0.009 0.449 381 D N -1.531 118.863 120.400 -0.010 0.000 2.178 381 D HA -0.175 4.462 4.640 -0.006 0.000 0.201 381 D C 1.184 177.445 176.300 -0.065 0.000 0.980 381 D CA 3.230 57.223 54.000 -0.012 0.000 0.842 381 D CB -0.161 40.657 40.800 0.030 0.000 0.948 381 D HN -0.146 8.102 8.370 0.006 0.125 0.472 382 C N -4.263 114.950 119.300 -0.146 0.000 2.674 382 C HA 0.133 4.462 4.460 -0.219 0.000 0.276 382 C C -0.116 174.635 174.990 -0.399 0.000 1.300 382 C CA 1.065 59.900 59.018 -0.304 0.000 1.732 382 C CB 0.527 27.994 27.740 -0.455 0.000 2.076 382 C HN -0.672 7.460 8.230 -0.142 0.013 0.548 383 H N -4.714 114.304 119.070 -0.088 0.000 3.046 383 H HA 0.463 5.110 4.556 -0.102 -0.152 0.262 383 H C -0.678 174.595 175.328 -0.091 0.000 1.044 383 H CA -0.053 55.934 56.048 -0.102 0.000 1.209 383 H CB 2.662 32.347 29.762 -0.129 0.000 1.507 383 H HN -0.381 7.770 8.280 -0.058 0.095 0.507 384 M N -3.656 115.954 119.600 0.016 0.000 3.432 384 M HA 0.557 5.027 4.480 -0.016 0.000 0.390 384 M C -3.267 173.007 176.300 -0.043 0.000 1.811 384 M CA -2.450 52.835 55.300 -0.024 0.000 0.536 384 M CB 0.555 33.120 32.600 -0.059 0.000 1.681 384 M HN -0.335 7.837 8.290 0.001 0.119 0.462 385 P HA 0.097 4.495 4.420 -0.038 0.000 0.276 385 P C -0.586 176.673 177.300 -0.068 0.000 1.261 385 P CA -1.405 61.666 63.100 -0.048 0.000 0.800 385 P CB 0.717 32.388 31.700 -0.048 0.000 1.066 386 K N -1.353 119.008 120.400 -0.065 0.000 2.414 386 K HA -0.181 4.186 4.320 -0.123 -0.122 0.272 386 K C 0.048 176.553 176.600 -0.157 0.000 0.993 386 K CA 0.950 57.174 56.287 -0.104 0.000 0.964 386 K CB 0.531 32.993 32.500 -0.062 0.000 0.925 386 K HN 0.013 8.235 8.250 -0.045 0.000 0.487 387 V N 1.954 121.693 119.914 -0.293 0.000 2.686 387 V HA -0.041 3.954 4.120 -0.209 0.000 0.295 387 V C -0.607 175.394 176.094 -0.156 0.000 1.055 387 V CA 0.325 62.451 62.300 -0.289 0.000 1.050 387 V CB 0.462 31.951 31.823 -0.556 0.000 0.984 387 V HN 0.009 7.961 8.190 -0.397 0.000 0.482 388 Q N 4.413 124.159 119.800 -0.091 0.000 2.325 388 Q HA 0.191 4.507 4.340 -0.042 0.000 0.262 388 Q C -1.254 174.732 176.000 -0.025 0.000 0.968 388 Q CA -0.442 55.334 55.803 -0.045 0.000 0.877 388 Q CB 1.266 29.988 28.738 -0.027 0.000 1.253 388 Q HN 0.092 8.312 8.270 -0.084 0.000 0.448 389 L N 5.376 126.595 121.223 -0.007 0.000 2.386 389 L HA 0.222 4.571 4.340 0.015 0.000 0.271 389 L C 0.393 177.273 176.870 0.016 0.000 0.993 389 L CA -0.813 54.035 54.840 0.014 0.000 0.819 389 L CB 1.976 44.056 42.059 0.035 0.000 1.294 389 L HN 0.319 8.545 8.230 -0.007 0.000 0.414 390 E N 1.041 121.252 120.200 0.018 0.000 2.110 390 E HA -0.192 4.166 4.350 0.014 0.000 0.193 390 E C -0.091 176.522 176.600 0.020 0.000 0.988 390 E CA 1.611 58.022 56.400 0.017 0.000 0.804 390 E CB 0.415 30.125 29.700 0.016 0.000 0.745 390 E HN 0.279 8.650 8.360 0.019 0.000 0.458 391 N N -1.538 117.177 118.700 0.026 0.000 2.500 391 N HA 0.123 4.879 4.740 0.026 0.000 0.291 391 N C -1.424 174.109 175.510 0.038 0.000 1.092 391 N CA 0.159 53.226 53.050 0.028 0.000 0.890 391 N CB 0.828 39.330 38.487 0.025 0.000 1.466 391 N HN -0.293 8.104 8.380 0.028 0.000 0.507 392 G N 0.651 109.477 108.800 0.043 0.000 2.321 392 G HA2 -0.142 3.852 3.960 0.055 0.000 0.298 392 G HA3 -0.142 3.862 3.960 0.072 0.000 0.298 392 G C -2.296 172.645 174.900 0.068 0.000 1.385 392 G CA -0.120 45.016 45.100 0.060 0.000 0.856 392 G HN -0.071 8.242 8.290 0.038 0.000 0.584 393 K N 0.557 121.011 120.400 0.090 0.000 2.276 393 K HA 0.175 4.542 4.320 0.077 0.000 0.285 393 K C -0.527 176.163 176.600 0.150 0.000 1.062 393 K CA -0.567 55.780 56.287 0.100 0.000 0.918 393 K CB 0.762 33.318 32.500 0.094 0.000 1.055 393 K HN 0.016 8.323 8.250 0.095 0.000 0.477 394 V N 4.689 124.666 119.914 0.105 0.000 2.763 394 V HA -0.106 4.043 4.120 0.048 0.000 0.306 394 V C -0.938 175.261 176.094 0.176 0.000 1.059 394 V CA 0.510 62.859 62.300 0.082 0.000 1.138 394 V CB 0.723 32.563 31.823 0.028 0.000 0.940 394 V HN 0.256 8.494 8.190 0.079 0.000 0.489 395 Y N 3.723 124.053 120.300 0.050 0.000 2.644 395 Y HA 0.337 4.923 4.550 0.060 0.000 0.338 395 Y C -2.042 173.908 175.900 0.084 0.000 1.119 395 Y CA -3.158 54.981 58.100 0.065 0.000 1.060 395 Y CB 1.886 40.386 38.460 0.067 0.000 1.294 395 Y HN -0.400 7.771 8.280 -0.182 0.000 0.472 396 T N 3.140 117.813 114.554 0.198 0.000 2.743 396 T HA 0.034 4.366 4.350 -0.030 0.000 0.293 396 T C -0.361 174.492 174.700 0.254 0.000 0.945 396 T CA 0.336 62.506 62.100 0.116 0.000 1.030 396 T CB 0.199 69.160 68.868 0.155 0.000 0.912 396 T HN 0.121 8.579 8.240 0.364 0.000 0.483 397 S N 6.285 122.003 115.700 0.030 0.000 2.552 397 S HA -0.332 4.318 4.470 0.300 0.000 0.289 397 S C 0.040 174.773 174.600 0.221 0.000 1.304 397 S CA 0.880 59.175 58.200 0.159 0.000 1.063 397 S CB 0.268 63.483 63.200 0.024 0.000 0.848 397 S HN -0.025 8.228 8.310 -0.094 0.000 0.499 398 H N 6.571 125.745 119.070 0.172 0.000 2.487 398 H HA 0.201 4.856 4.556 0.164 0.000 0.290 398 H C -0.305 175.120 175.328 0.162 0.000 1.081 398 H CA -0.296 55.862 56.048 0.183 0.000 1.116 398 H CB 0.626 30.522 29.762 0.224 0.000 1.560 398 H HN 0.299 8.877 8.280 0.497 0.000 0.548 399 S N 1.573 117.362 115.700 0.147 0.000 2.473 399 S HA 0.186 4.692 4.470 -0.009 -0.041 0.312 399 S C -1.010 173.580 174.600 -0.016 0.000 1.087 399 S CA -0.939 57.275 58.200 0.023 0.000 1.077 399 S CB -0.566 62.621 63.200 -0.022 0.000 1.065 399 S HN -0.753 7.583 8.310 0.136 0.056 0.510 400 Q N 7.648 127.426 119.800 -0.036 0.000 2.344 400 Q HA 0.215 4.791 4.340 -0.029 -0.253 0.253 400 Q C -0.563 175.316 176.000 -0.201 0.000 1.050 400 Q CA 0.183 55.932 55.803 -0.089 0.000 0.912 400 Q CB 0.028 28.732 28.738 -0.058 0.000 1.258 400 Q HN -0.045 8.217 8.270 -0.013 0.000 0.443 401 R N 0.467 120.915 120.500 -0.086 0.000 2.747 401 R HA 0.362 4.609 4.340 -0.156 0.000 0.272 401 R C -1.444 174.905 176.300 0.081 0.000 1.032 401 R CA -1.900 54.151 56.100 -0.083 0.000 0.896 401 R CB 2.102 32.341 30.300 -0.101 0.000 1.253 401 R HN -0.320 7.952 8.270 0.003 0.000 0.461 402 T N 0.343 114.908 114.554 0.018 0.000 2.934 402 T HA 0.057 4.497 4.350 0.150 0.000 0.306 402 T C 0.669 175.345 174.700 -0.039 0.000 1.042 402 T CA -1.111 61.011 62.100 0.035 0.000 1.145 402 T CB 0.844 69.682 68.868 -0.051 0.000 0.982 402 T HN 0.515 8.727 8.240 -0.047 0.000 0.544 403 P HA 0.009 4.343 4.420 -0.143 0.000 0.228 403 P C 1.525 178.750 177.300 -0.125 0.000 1.151 403 P CA 1.658 64.658 63.100 -0.167 0.000 0.770 403 P CB 0.080 31.624 31.700 -0.260 0.000 0.786 404 R N -1.570 118.857 120.500 -0.120 0.000 2.193 404 R HA -0.217 4.059 4.340 -0.106 0.000 0.229 404 R C 1.399 177.654 176.300 -0.075 0.000 1.110 404 R CA 2.768 58.807 56.100 -0.101 0.000 0.988 404 R CB -0.379 29.861 30.300 -0.099 0.000 0.871 404 R HN -0.547 7.600 8.270 -0.123 0.049 0.458 405 D N -2.721 117.637 120.400 -0.071 0.000 2.355 405 D HA 0.021 4.630 4.640 -0.052 0.000 0.218 405 D C 0.403 176.675 176.300 -0.047 0.000 1.004 405 D CA 1.744 55.710 54.000 -0.056 0.000 0.880 405 D CB 0.785 41.550 40.800 -0.057 0.000 0.911 405 D HN -0.623 7.668 8.370 -0.075 0.034 0.528 406 M N -4.830 114.739 119.600 -0.051 0.000 4.568 406 M HA 0.385 4.845 4.480 -0.033 0.000 0.533 406 M C -0.946 175.331 176.300 -0.039 0.000 2.143 406 M CA -0.426 54.849 55.300 -0.041 0.000 0.483 406 M CB 0.120 32.694 32.600 -0.043 0.000 1.438 406 M HN -0.408 7.689 8.290 -0.062 0.156 0.591 407 M N 2.894 122.474 119.600 -0.034 0.000 2.296 407 M HA -0.001 4.521 4.480 -0.037 -0.065 0.265 407 M C 1.892 178.197 176.300 0.009 0.000 1.064 407 M CA 3.064 58.350 55.300 -0.024 0.000 1.109 407 M CB -1.086 31.498 32.600 -0.027 0.000 1.396 407 M HN 0.386 8.655 8.290 -0.034 0.000 0.430 408 G N -1.374 107.431 108.800 0.008 0.000 2.446 408 G HA2 -0.315 3.668 3.960 0.039 0.000 0.217 408 G HA3 -0.315 3.654 3.960 0.015 0.000 0.217 408 G C 1.448 176.362 174.900 0.022 0.000 1.168 408 G CA 2.288 47.402 45.100 0.023 0.000 0.771 408 G HN 0.486 8.762 8.290 -0.001 0.014 0.551 409 Q N 0.498 120.299 119.800 0.001 0.000 2.163 409 Q HA -0.067 4.273 4.340 0.000 0.000 0.198 409 Q C 1.561 177.559 176.000 -0.003 0.000 0.954 409 Q CA 2.105 57.904 55.803 -0.006 0.000 0.851 409 Q CB -0.186 28.535 28.738 -0.028 0.000 0.928 409 Q HN -0.662 7.603 8.270 -0.009 0.000 0.459 410 A N -3.375 119.435 122.820 -0.016 0.000 2.016 410 A HA 0.040 4.525 4.320 -0.043 -0.191 0.217 410 A C 0.545 178.137 177.584 0.014 0.000 1.162 410 A CA 1.823 53.839 52.037 -0.036 0.000 0.662 410 A CB 0.742 19.686 19.000 -0.094 0.000 0.812 410 A HN -0.036 8.102 8.150 -0.021 0.000 0.450 411 C N -4.893 114.449 119.300 0.070 0.000 3.123 411 C HA 0.135 4.740 4.460 0.242 0.000 0.536 411 C C 0.941 176.087 174.990 0.261 0.000 1.281 411 C CA 1.278 60.411 59.018 0.192 0.000 2.595 411 C CB 1.864 29.705 27.740 0.169 0.000 3.423 411 C HN -0.357 7.908 8.230 0.058 0.000 0.496 412 L N 0.571 121.902 121.223 0.181 0.000 2.313 412 L HA -0.175 4.338 4.340 0.288 0.000 0.214 412 L C 1.329 178.282 176.870 0.137 0.000 1.119 412 L CA 2.732 57.691 54.840 0.198 0.000 0.809 412 L CB -0.344 41.802 42.059 0.145 0.000 0.933 412 L HN -0.028 8.278 8.230 0.126 0.000 0.449 413 N N -1.598 117.157 118.700 0.092 0.000 2.166 413 N HA -0.217 4.552 4.740 0.047 0.000 0.186 413 N C 1.290 176.822 175.510 0.037 0.000 1.019 413 N CA 2.664 55.746 53.050 0.053 0.000 0.856 413 N CB -0.344 38.163 38.487 0.034 0.000 0.993 413 N HN -0.384 8.048 8.380 0.086 0.000 0.426 414 C N -1.580 117.747 119.300 0.045 0.000 2.505 414 C HA -0.042 4.382 4.460 -0.061 0.000 0.279 414 C C 0.844 175.750 174.990 -0.140 0.000 1.316 414 C CA 0.523 59.511 59.018 -0.050 0.000 1.720 414 C CB 0.282 27.988 27.740 -0.057 0.000 2.050 414 C HN -0.578 7.699 8.230 0.086 0.004 0.493 415 H N 0.827 119.928 119.070 0.050 0.000 2.652 415 H HA 0.179 4.773 4.556 -0.118 -0.109 0.233 415 H C -0.280 175.059 175.328 0.018 0.000 1.762 415 H CA -0.628 55.410 56.048 -0.017 0.000 1.285 415 H CB -2.238 27.566 29.762 0.069 0.000 1.668 415 H HN 0.013 8.446 8.280 0.255 0.000 0.550 416 A N 2.730 125.576 122.820 0.044 0.000 2.070 416 A HA -0.209 4.158 4.320 0.078 0.000 0.220 416 A C 0.669 178.285 177.584 0.054 0.000 1.159 416 A CA 2.422 54.489 52.037 0.049 0.000 0.656 416 A CB 0.034 19.038 19.000 0.007 0.000 0.800 416 A HN -0.435 7.666 8.150 -0.018 0.039 0.453 417 E N -4.631 115.568 120.200 -0.002 0.000 2.482 417 E HA -0.166 4.192 4.350 0.013 0.000 0.196 417 E C -0.228 176.454 176.600 0.137 0.000 1.047 417 E CA 0.289 56.681 56.400 -0.013 0.000 0.869 417 E CB -0.066 29.538 29.700 -0.159 0.000 0.836 417 E HN 0.099 8.385 8.360 -0.057 0.040 0.520 418 W N -0.487 120.857 121.300 0.074 0.000 2.689 418 W HA 0.338 5.215 4.660 0.034 -0.197 0.340 418 W C 0.295 176.835 176.519 0.035 0.000 1.060 418 W CA -2.326 55.049 57.345 0.050 0.000 1.218 418 W CB 2.131 31.623 29.460 0.053 0.000 1.410 418 W HN -0.651 7.657 8.180 0.310 0.058 0.528 419 T N -0.088 114.603 114.554 0.228 0.000 2.788 419 T HA 0.129 4.542 4.350 0.105 0.000 0.287 419 T C 0.862 175.586 174.700 0.041 0.000 1.007 419 T CA -1.197 60.962 62.100 0.098 0.000 1.005 419 T CB 1.917 70.805 68.868 0.032 0.000 1.012 419 T HN 0.299 8.976 8.240 0.206 -0.314 0.530 420 E N 1.101 121.310 120.200 0.015 0.000 2.058 420 E HA -0.390 3.952 4.350 -0.012 0.000 0.194 420 E C 1.841 178.391 176.600 -0.084 0.000 0.997 420 E CA 4.311 60.697 56.400 -0.024 0.000 0.801 420 E CB -0.103 29.587 29.700 -0.016 0.000 0.746 420 E HN 0.687 9.060 8.360 0.023 0.000 0.450 421 D N -2.514 117.836 120.400 -0.083 0.000 2.144 421 D HA -0.221 4.369 4.640 -0.083 0.000 0.199 421 D C 2.674 178.867 176.300 -0.177 0.000 0.984 421 D CA 3.169 57.107 54.000 -0.104 0.000 0.834 421 D CB -0.649 40.096 40.800 -0.092 0.000 0.955 421 D HN 0.129 8.463 8.370 -0.061 0.000 0.465 422 Q N -0.376 119.267 119.800 -0.260 0.000 2.079 422 Q HA -0.298 3.800 4.340 -0.402 0.000 0.200 422 Q C 2.314 177.814 176.000 -0.833 0.000 0.974 422 Q CA 2.953 58.459 55.803 -0.496 0.000 0.840 422 Q CB -0.007 28.417 28.738 -0.523 0.000 0.898 422 Q HN -0.565 7.585 8.270 -0.199 0.000 0.430 423 A N 0.066 122.435 122.820 -0.752 0.000 1.902 423 A HA -0.235 3.205 4.320 -1.466 0.000 0.217 423 A C 2.170 179.498 177.584 -0.426 0.000 1.181 423 A CA 3.076 54.651 52.037 -0.769 0.000 0.623 423 A CB -0.736 18.133 19.000 -0.220 0.000 0.818 423 A HN -0.306 7.559 8.150 -0.475 0.000 0.443 424 L N -2.439 118.637 121.223 -0.245 0.000 2.083 424 L HA -0.417 3.827 4.340 -0.159 0.000 0.209 424 L C 1.994 178.818 176.870 -0.076 0.000 1.083 424 L CA 3.096 57.850 54.840 -0.143 0.000 0.752 424 L CB -0.326 41.679 42.059 -0.088 0.000 0.899 424 L HN -0.295 7.803 8.230 -0.221 0.000 0.433 425 Y N 0.047 120.213 120.300 -0.223 0.000 2.181 425 Y HA -0.480 4.023 4.550 -0.078 0.000 0.288 425 Y C 1.237 177.078 175.900 -0.098 0.000 1.146 425 Y CA 3.637 61.652 58.100 -0.141 0.000 1.164 425 Y CB -0.127 38.236 38.460 -0.162 0.000 0.982 425 Y HN -0.352 7.917 8.280 -0.019 0.000 0.515 426 A N -0.768 121.982 122.820 -0.116 0.000 1.933 426 A HA -0.346 3.950 4.320 -0.041 0.000 0.218 426 A C 2.042 179.675 177.584 0.082 0.000 1.175 426 A CA 3.065 55.053 52.037 -0.083 0.000 0.628 426 A CB -1.010 17.849 19.000 -0.236 0.000 0.814 426 A HN -0.242 7.751 8.150 -0.263 0.000 0.444 427 I N -1.840 118.752 120.570 0.036 0.000 2.179 427 I HA -0.609 3.771 4.170 0.350 0.000 0.242 427 I C 1.647 177.822 176.117 0.096 0.000 1.088 427 I CA 4.282 65.639 61.300 0.095 0.000 1.357 427 I CB -0.320 37.561 38.000 -0.199 0.000 1.051 427 I HN -0.513 7.653 8.210 -0.074 0.000 0.409 428 D N -0.718 119.682 120.400 0.000 0.000 2.178 428 D HA -0.275 4.361 4.640 -0.007 0.000 0.201 428 D C 2.527 178.825 176.300 -0.002 0.000 0.980 428 D CA 3.376 57.363 54.000 -0.022 0.000 0.842 428 D CB -0.401 40.358 40.800 -0.069 0.000 0.948 428 D HN -0.113 8.235 8.370 -0.037 0.000 0.472 429 Y N 1.300 121.504 120.300 -0.160 0.000 2.128 429 Y HA -0.421 4.028 4.550 -0.168 0.000 0.284 429 Y C 1.742 177.652 175.900 0.016 0.000 1.154 429 Y CA 3.982 61.999 58.100 -0.138 0.000 1.149 429 Y CB -0.014 38.329 38.460 -0.196 0.000 0.976 429 Y HN -0.319 7.989 8.280 0.046 0.000 0.505 430 I N -1.555 119.219 120.570 0.341 0.000 2.202 430 I HA -0.651 3.728 4.170 0.349 0.000 0.242 430 I C 1.954 178.211 176.117 0.234 0.000 1.091 430 I CA 4.300 65.785 61.300 0.308 0.000 1.368 430 I CB -0.161 38.017 38.000 0.296 0.000 1.058 430 I HN -0.718 7.688 8.210 0.326 0.000 0.410 431 K N 0.172 120.681 120.400 0.182 0.000 2.057 431 K HA -0.207 4.440 4.320 0.150 -0.238 0.207 431 K C 2.863 179.525 176.600 0.104 0.000 1.049 431 K CA 3.252 59.617 56.287 0.130 0.000 0.931 431 K CB -0.296 32.248 32.500 0.072 0.000 0.714 431 K HN -0.218 8.141 8.250 0.181 0.000 0.440 432 N N -0.084 118.651 118.700 0.059 0.000 2.084 432 N HA -0.289 4.482 4.740 0.052 0.000 0.190 432 N C 1.946 177.489 175.510 0.055 0.000 1.030 432 N CA 2.943 56.013 53.050 0.032 0.000 0.849 432 N CB -0.407 38.047 38.487 -0.056 0.000 1.012 432 N HN -0.035 8.369 8.380 0.040 0.000 0.423 433 Y N 1.159 121.414 120.300 -0.076 0.000 2.145 433 Y HA -0.310 4.180 4.550 -0.100 0.000 0.286 433 Y C 1.708 177.601 175.900 -0.012 0.000 1.145 433 Y CA 3.771 61.826 58.100 -0.075 0.000 1.148 433 Y CB 0.185 38.593 38.460 -0.086 0.000 0.981 433 Y HN -0.323 8.040 8.280 0.139 0.000 0.507 434 T N 1.235 115.783 114.554 -0.010 0.000 2.708 434 T HA -0.481 3.742 4.350 -0.211 0.000 0.266 434 T C 1.593 176.268 174.700 -0.041 0.000 1.037 434 T CA 5.353 67.407 62.100 -0.076 0.000 1.146 434 T CB -0.297 68.594 68.868 0.040 0.000 0.865 434 T HN -0.008 8.318 8.240 0.144 0.000 0.435 435 H N 2.938 121.984 119.070 -0.039 0.000 2.352 435 H HA -0.393 4.184 4.556 0.035 0.000 0.299 435 H C 2.020 177.328 175.328 -0.033 0.000 1.097 435 H CA 3.985 60.030 56.048 -0.004 0.000 1.311 435 H CB -0.196 29.571 29.762 0.008 0.000 1.377 435 H HN 0.097 8.485 8.280 0.179 0.000 0.504 436 G N -1.855 106.863 108.800 -0.137 0.000 2.469 436 G HA2 -0.439 3.408 3.960 -0.190 0.000 0.219 436 G HA3 -0.439 3.414 3.960 -0.179 0.000 0.219 436 G C 1.357 176.129 174.900 -0.214 0.000 1.150 436 G CA 2.236 47.219 45.100 -0.196 0.000 0.763 436 G HN -0.059 8.198 8.290 -0.056 0.000 0.561 437 K N 1.513 121.754 120.400 -0.265 0.000 2.155 437 K HA -0.148 4.087 4.320 -0.141 0.000 0.203 437 K C 2.517 179.096 176.600 -0.034 0.000 1.052 437 K CA 1.445 57.622 56.287 -0.183 0.000 0.948 437 K CB -0.581 31.745 32.500 -0.291 0.000 0.728 437 K HN -0.711 7.335 8.250 -0.339 0.000 0.448 438 I N 0.944 121.504 120.570 -0.017 0.000 2.179 438 I HA -0.479 3.881 4.170 0.318 0.000 0.242 438 I C 1.631 177.803 176.117 0.092 0.000 1.088 438 I CA 4.355 65.749 61.300 0.156 0.000 1.357 438 I CB -0.033 38.071 38.000 0.174 0.000 1.051 438 I HN -0.125 7.958 8.210 -0.073 0.083 0.409 439 V N 0.176 120.021 119.914 -0.115 0.000 2.295 439 V HA -0.653 3.432 4.120 -0.057 0.000 0.246 439 V C 1.813 177.908 176.094 0.003 0.000 1.049 439 V CA 4.980 67.218 62.300 -0.102 0.000 1.024 439 V CB -0.411 31.278 31.823 -0.223 0.000 0.648 439 V HN 0.068 8.108 8.190 -0.250 0.000 0.447 440 K N -0.746 119.668 120.400 0.023 0.000 2.057 440 K HA -0.381 4.021 4.320 0.137 0.000 0.207 440 K C 2.530 179.302 176.600 0.287 0.000 1.049 440 K CA 3.609 59.986 56.287 0.150 0.000 0.931 440 K CB -0.324 32.258 32.500 0.136 0.000 0.714 440 K HN -0.198 8.038 8.250 -0.023 0.000 0.440 441 S N 0.429 116.248 115.700 0.198 0.000 2.370 441 S HA -0.388 4.235 4.470 0.255 0.000 0.226 441 S C 1.874 176.478 174.600 0.005 0.000 1.033 441 S CA 3.887 62.202 58.200 0.192 0.000 1.011 441 S CB -0.161 63.204 63.200 0.275 0.000 0.852 441 S HN -0.113 8.290 8.310 0.155 0.000 0.457 442 E N 1.603 121.729 120.200 -0.123 0.000 2.072 442 E HA -0.376 3.615 4.350 -0.598 0.000 0.191 442 E C 1.913 178.409 176.600 -0.174 0.000 0.985 442 E CA 2.909 59.117 56.400 -0.318 0.000 0.801 442 E CB -0.068 29.498 29.700 -0.222 0.000 0.750 442 E HN -0.322 8.018 8.360 -0.034 0.000 0.452 443 Y N 2.053 122.251 120.300 -0.169 0.000 2.114 443 Y HA -0.348 4.054 4.550 -0.247 0.000 0.282 443 Y C 1.700 177.400 175.900 -0.333 0.000 1.165 443 Y CA 3.370 61.310 58.100 -0.266 0.000 1.148 443 Y CB 0.020 38.282 38.460 -0.330 0.000 0.972 443 Y HN -0.266 8.076 8.280 0.104 0.000 0.504 444 W N -3.190 118.026 121.300 -0.140 0.000 2.453 444 W HA -0.288 4.198 4.660 -0.290 0.000 0.289 444 W C 2.177 178.557 176.519 -0.230 0.000 1.215 444 W CA 3.729 60.967 57.345 -0.180 0.000 1.297 444 W CB 0.261 29.721 29.460 0.001 0.000 1.113 444 W HN -0.505 7.793 8.180 0.196 0.000 0.551 445 L N -0.588 120.612 121.223 -0.039 0.000 2.042 445 L HA -0.438 3.819 4.340 -0.138 0.000 0.210 445 L C 2.185 178.902 176.870 -0.254 0.000 1.076 445 L CA 3.263 57.994 54.840 -0.180 0.000 0.749 445 L CB -0.192 41.681 42.059 -0.311 0.000 0.893 445 L HN 0.022 8.236 8.230 -0.028 0.000 0.432 446 A N -1.802 120.842 122.820 -0.293 0.000 1.902 446 A HA -0.378 3.808 4.320 -0.223 0.000 0.217 446 A C 1.393 178.806 177.584 -0.286 0.000 1.181 446 A CA 3.308 55.180 52.037 -0.274 0.000 0.623 446 A CB -0.927 17.909 19.000 -0.274 0.000 0.818 446 A HN 0.181 8.145 8.150 -0.311 0.000 0.443 447 K N -0.889 119.264 120.400 -0.411 0.000 2.026 447 K HA -0.341 3.760 4.320 -0.365 0.000 0.208 447 K C 2.070 178.573 176.600 -0.162 0.000 1.048 447 K CA 3.097 59.159 56.287 -0.375 0.000 0.929 447 K CB -0.105 32.047 32.500 -0.580 0.000 0.713 447 K HN -0.467 7.471 8.250 -0.521 0.000 0.439 448 M N -0.411 119.131 119.600 -0.098 0.000 2.067 448 M HA -0.372 4.108 4.480 0.000 0.000 0.260 448 M C 2.427 178.752 176.300 0.041 0.000 1.069 448 M CA 3.734 59.022 55.300 -0.021 0.000 1.117 448 M CB 0.037 32.622 32.600 -0.025 0.000 1.334 448 M HN -0.610 7.619 8.290 -0.102 0.000 0.407 449 I N -0.509 120.010 120.570 -0.085 0.000 2.151 449 I HA -0.597 3.536 4.170 -0.062 0.000 0.243 449 I C 1.944 178.100 176.117 0.064 0.000 1.080 449 I CA 3.982 65.242 61.300 -0.068 0.000 1.339 449 I CB -0.376 37.504 38.000 -0.200 0.000 1.039 449 I HN 0.135 8.239 8.210 -0.177 0.000 0.409 450 D N -0.856 119.539 120.400 -0.008 0.000 2.264 450 D HA -0.173 4.477 4.640 0.017 0.000 0.208 450 D C 2.139 178.452 176.300 0.021 0.000 0.966 450 D CA 2.989 56.988 54.000 -0.002 0.000 0.864 450 D CB -0.540 40.224 40.800 -0.059 0.000 0.933 450 D HN -0.168 8.165 8.370 -0.063 0.000 0.499 451 L N -1.634 119.600 121.223 0.019 0.000 2.395 451 L HA -0.233 4.086 4.340 -0.035 0.000 0.218 451 L C 1.180 178.033 176.870 -0.028 0.000 1.130 451 L CA 1.396 56.219 54.840 -0.029 0.000 0.826 451 L CB -0.228 41.779 42.059 -0.087 0.000 0.941 451 L HN -0.622 7.489 8.230 0.019 0.131 0.451 452 F N 0.054 119.975 119.950 -0.049 0.000 2.102 452 F HA -0.233 4.277 4.527 -0.029 0.000 0.298 452 F C -1.164 174.628 175.800 -0.014 0.000 1.105 452 F CA 6.653 64.636 58.000 -0.029 0.000 1.239 452 F CB -3.173 35.814 39.000 -0.022 0.000 0.991 452 F HN -0.464 7.889 8.300 0.329 0.145 0.474 453 P HA -0.253 4.228 4.420 0.102 0.000 0.217 453 P C 1.182 178.507 177.300 0.041 0.000 1.150 453 P CA 3.393 66.549 63.100 0.093 0.000 0.832 453 P CB -0.426 31.317 31.700 0.071 0.000 0.787 454 V N -1.798 118.127 119.914 0.018 0.000 2.307 454 V HA -0.542 3.576 4.120 -0.004 0.000 0.245 454 V C 1.570 177.648 176.094 -0.027 0.000 1.045 454 V CA 4.077 66.371 62.300 -0.009 0.000 1.024 454 V CB -0.381 31.430 31.823 -0.022 0.000 0.651 454 V HN -0.632 7.571 8.190 0.023 0.000 0.449 455 A N -0.734 122.051 122.820 -0.059 0.000 1.865 455 A HA -0.416 3.854 4.320 -0.082 0.000 0.217 455 A C 1.690 179.245 177.584 -0.049 0.000 1.191 455 A CA 3.685 55.668 52.037 -0.090 0.000 0.623 455 A CB -0.756 18.121 19.000 -0.204 0.000 0.826 455 A HN 0.147 8.254 8.150 -0.071 0.000 0.444 456 K N -1.693 118.698 120.400 -0.014 0.000 2.044 456 K HA -0.268 4.058 4.320 0.010 0.000 0.210 456 K C 3.669 180.274 176.600 0.008 0.000 1.049 456 K CA 2.883 59.180 56.287 0.017 0.000 0.927 456 K CB -0.528 32.009 32.500 0.061 0.000 0.713 456 K HN -0.021 8.229 8.250 -0.000 0.000 0.443 457 R N -1.520 118.986 120.500 0.009 0.000 2.189 457 R HA -0.172 4.174 4.340 0.009 0.000 0.223 457 R C 2.016 178.314 176.300 -0.003 0.000 1.092 457 R CA 2.338 58.441 56.100 0.006 0.000 0.989 457 R CB -0.177 30.128 30.300 0.008 0.000 0.876 457 R HN -0.095 8.182 8.270 0.012 0.000 0.457 458 A N -3.260 119.553 122.820 -0.012 0.000 2.208 458 A HA 0.085 4.397 4.320 -0.013 0.000 0.209 458 A C -0.072 177.503 177.584 -0.016 0.000 1.161 458 A CA 0.143 52.170 52.037 -0.016 0.000 0.782 458 A CB 0.063 19.048 19.000 -0.025 0.000 0.816 458 A HN -0.284 7.737 8.150 -0.016 0.119 0.477 459 G N -2.003 106.789 108.800 -0.014 0.000 2.132 459 G HA2 -0.381 3.575 3.960 -0.007 0.000 0.228 459 G HA3 -0.381 3.573 3.960 -0.010 0.000 0.228 459 G C -0.159 174.729 174.900 -0.019 0.000 1.000 459 G CA -0.163 44.930 45.100 -0.012 0.000 0.693 459 G HN -0.515 7.603 8.290 -0.012 0.165 0.515 460 V N 0.735 120.630 119.914 -0.031 0.000 2.788 460 V HA -0.174 3.922 4.120 -0.040 0.000 0.307 460 V C -0.007 176.068 176.094 -0.031 0.000 1.069 460 V CA 0.888 63.162 62.300 -0.043 0.000 1.173 460 V CB 0.942 32.719 31.823 -0.077 0.000 0.925 460 V HN -0.576 7.593 8.190 -0.035 0.000 0.492 461 S N 6.336 122.019 115.700 -0.029 0.000 2.585 461 S HA 0.017 4.481 4.470 -0.011 0.000 0.273 461 S C 1.016 175.609 174.600 -0.011 0.000 1.339 461 S CA -0.536 57.654 58.200 -0.016 0.000 1.028 461 S CB 1.309 64.501 63.200 -0.015 0.000 0.906 461 S HN -0.027 8.263 8.310 -0.033 0.000 0.528 462 E N 2.977 123.177 120.200 0.001 0.000 2.160 462 E HA -0.333 4.030 4.350 0.021 0.000 0.195 462 E C 1.874 178.480 176.600 0.010 0.000 0.991 462 E CA 3.341 59.748 56.400 0.012 0.000 0.810 462 E CB -0.601 29.107 29.700 0.015 0.000 0.742 462 E HN 0.831 9.192 8.360 0.002 0.000 0.466 463 D N -1.180 119.220 120.400 0.001 0.000 2.104 463 D HA -0.223 4.419 4.640 0.004 0.000 0.194 463 D C 2.464 178.761 176.300 -0.004 0.000 0.994 463 D CA 3.540 57.540 54.000 -0.000 0.000 0.830 463 D CB -0.606 40.191 40.800 -0.004 0.000 0.959 463 D HN 0.167 8.523 8.370 -0.002 0.012 0.452 464 V N 0.199 120.102 119.914 -0.018 0.000 2.358 464 V HA -0.457 3.645 4.120 -0.030 0.000 0.246 464 V C 1.787 177.853 176.094 -0.046 0.000 1.047 464 V CA 3.986 66.264 62.300 -0.037 0.000 1.035 464 V CB 0.055 31.843 31.823 -0.057 0.000 0.658 464 V HN -0.537 7.641 8.190 -0.020 0.000 0.452 465 L N -0.878 120.323 121.223 -0.037 0.000 2.079 465 L HA -0.513 3.760 4.340 -0.112 0.000 0.210 465 L C 2.033 178.979 176.870 0.126 0.000 1.081 465 L CA 3.523 58.368 54.840 0.009 0.000 0.752 465 L CB -0.770 41.333 42.059 0.074 0.000 0.896 465 L HN -0.122 8.090 8.230 -0.030 0.000 0.433 466 N N -1.709 117.035 118.700 0.074 0.000 2.188 466 N HA -0.411 4.379 4.740 0.084 0.000 0.184 466 N C 1.817 177.364 175.510 0.061 0.000 1.018 466 N CA 3.516 56.605 53.050 0.065 0.000 0.858 466 N CB -0.018 38.485 38.487 0.027 0.000 0.989 466 N HN 0.156 8.564 8.380 0.046 0.000 0.426 467 Q N 0.854 120.678 119.800 0.040 0.000 2.061 467 Q HA -0.350 4.010 4.340 0.033 0.000 0.204 467 Q C 1.948 177.991 176.000 0.071 0.000 0.984 467 Q CA 3.212 59.037 55.803 0.037 0.000 0.846 467 Q CB 0.058 28.803 28.738 0.012 0.000 0.902 467 Q HN -0.348 7.937 8.270 0.025 0.000 0.421 468 A N -0.882 121.987 122.820 0.081 0.000 1.902 468 A HA -0.384 4.003 4.320 0.112 0.000 0.217 468 A C 1.958 179.737 177.584 0.325 0.000 1.181 468 A CA 3.106 55.236 52.037 0.155 0.000 0.623 468 A CB -0.649 18.347 19.000 -0.006 0.000 0.818 468 A HN -0.260 7.917 8.150 0.044 0.000 0.443 469 R N -2.388 118.307 120.500 0.326 0.000 2.096 469 R HA -0.336 4.150 4.340 0.242 0.000 0.235 469 R C 2.612 178.988 176.300 0.128 0.000 1.127 469 R CA 3.657 59.882 56.100 0.209 0.000 0.968 469 R CB -0.167 30.188 30.300 0.092 0.000 0.861 469 R HN -0.027 8.338 8.270 0.291 0.080 0.440 470 E N -0.878 119.381 120.200 0.098 0.000 2.106 470 E HA -0.252 4.120 4.350 0.038 0.000 0.192 470 E C 2.251 178.937 176.600 0.144 0.000 0.984 470 E CA 2.469 58.912 56.400 0.072 0.000 0.806 470 E CB -0.323 29.397 29.700 0.033 0.000 0.750 470 E HN -0.495 7.921 8.360 0.094 0.000 0.458 471 L N -1.131 120.188 121.223 0.161 0.000 2.083 471 L HA -0.355 4.092 4.340 0.178 0.000 0.209 471 L C 1.664 178.686 176.870 0.252 0.000 1.083 471 L CA 3.096 58.046 54.840 0.184 0.000 0.752 471 L CB -0.318 41.826 42.059 0.142 0.000 0.899 471 L HN -0.550 7.769 8.230 0.148 0.000 0.433 472 H N 0.533 119.673 119.070 0.117 0.000 2.319 472 H HA -0.444 4.155 4.556 0.073 0.000 0.299 472 H C 2.084 177.461 175.328 0.081 0.000 1.092 472 H CA 3.083 59.167 56.048 0.061 0.000 1.302 472 H CB 0.514 30.240 29.762 -0.060 0.000 1.373 472 H HN -0.115 8.275 8.280 0.314 0.079 0.497 473 Y N -0.363 119.947 120.300 0.017 0.000 2.081 473 Y HA -0.527 3.916 4.550 -0.179 0.000 0.280 473 Y C 1.655 177.588 175.900 0.055 0.000 1.163 473 Y CA 3.789 61.849 58.100 -0.065 0.000 1.135 473 Y CB -0.198 38.205 38.460 -0.097 0.000 0.970 473 Y HN -0.398 8.026 8.280 0.239 0.000 0.498 474 D N -1.854 118.766 120.400 0.366 0.000 2.117 474 D HA -0.375 4.370 4.640 0.175 0.000 0.198 474 D C 2.207 178.681 176.300 0.290 0.000 0.982 474 D CA 3.093 57.273 54.000 0.301 0.000 0.828 474 D CB -0.594 40.457 40.800 0.418 0.000 0.967 474 D HN -0.677 7.923 8.370 0.384 0.000 0.464 475 A N -0.118 122.897 122.820 0.325 0.000 1.908 475 A HA -0.424 4.110 4.320 0.358 0.000 0.218 475 A C 1.448 179.249 177.584 0.362 0.000 1.181 475 A CA 3.142 55.377 52.037 0.330 0.000 0.627 475 A CB -0.514 18.635 19.000 0.249 0.000 0.818 475 A HN 0.161 8.498 8.150 0.312 0.000 0.445 476 H N -0.050 119.174 119.070 0.256 0.000 2.270 476 H HA -0.326 4.554 4.556 0.540 0.000 0.299 476 H C 2.099 177.524 175.328 0.162 0.000 1.077 476 H CA 4.105 60.333 56.048 0.300 0.000 1.294 476 H CB 0.467 30.270 29.762 0.069 0.000 1.371 476 H HN -0.150 8.382 8.280 0.418 0.000 0.491 477 L N -0.301 120.917 121.223 -0.009 0.000 1.990 477 L HA -0.407 3.803 4.340 -0.217 0.000 0.213 477 L C 1.404 178.137 176.870 -0.228 0.000 1.072 477 L CA 3.224 57.900 54.840 -0.273 0.000 0.755 477 L CB -0.459 41.269 42.059 -0.551 0.000 0.889 477 L HN -0.177 8.024 8.230 -0.047 0.000 0.432 478 Y N -5.695 114.696 120.300 0.153 0.000 2.571 478 Y HA -0.072 4.558 4.550 0.134 0.000 0.294 478 Y C 1.895 178.022 175.900 0.378 0.000 1.141 478 Y CA 1.625 59.851 58.100 0.209 0.000 1.308 478 Y CB -0.728 37.864 38.460 0.221 0.000 1.002 478 Y HN -0.283 7.954 8.280 -0.071 0.000 0.551 479 W N 0.519 121.969 121.300 0.250 0.000 2.633 479 W HA -0.146 4.725 4.660 0.351 0.000 0.295 479 W C 1.005 177.616 176.519 0.153 0.000 1.133 479 W CA 2.137 59.620 57.345 0.230 0.000 1.490 479 W CB 0.932 30.450 29.460 0.097 0.000 1.127 479 W HN -0.590 7.724 8.180 0.446 0.134 0.538 480 E N 2.542 122.249 120.200 -0.822 0.000 2.268 480 E HA -0.312 2.661 4.350 -2.295 0.000 0.195 480 E C 1.920 178.027 176.600 -0.822 0.000 0.995 480 E CA 2.575 58.104 56.400 -1.452 0.000 0.836 480 E CB 0.009 28.942 29.700 -1.278 0.000 0.763 480 E HN 0.270 8.363 8.360 -0.446 0.000 0.491 481 W N -0.194 120.606 121.300 -0.832 0.000 2.305 481 W HA -0.395 3.728 4.660 -0.896 0.000 0.308 481 W C 1.755 177.603 176.519 -1.119 0.000 1.226 481 W CA 3.642 60.363 57.345 -1.040 0.000 1.253 481 W CB -0.041 28.652 29.460 -1.279 0.000 1.146 481 W HN -0.508 7.452 8.180 -0.339 0.016 0.507 482 W N -5.697 115.534 121.300 -0.115 0.000 2.640 482 W HA -0.245 4.421 4.660 0.010 0.000 0.268 482 W C 1.961 178.393 176.519 -0.146 0.000 1.263 482 W CA 1.842 59.149 57.345 -0.064 0.000 1.344 482 W CB 0.328 29.805 29.460 0.029 0.000 1.093 482 W HN -0.119 7.687 8.180 -0.409 0.129 0.603 483 T N -0.700 113.738 114.554 -0.194 0.000 2.942 483 T HA -0.252 4.080 4.350 -0.030 0.000 0.265 483 T C 1.341 175.919 174.700 -0.204 0.000 1.062 483 T CA 3.108 65.106 62.100 -0.172 0.000 1.139 483 T CB -0.812 67.901 68.868 -0.258 0.000 0.883 483 T HN -0.599 7.392 8.240 -0.416 0.000 0.468 484 A N 2.725 125.339 122.820 -0.343 0.000 1.898 484 A HA -0.172 4.057 4.320 -0.151 0.000 0.216 484 A C 0.690 178.136 177.584 -0.230 0.000 1.181 484 A CA 1.830 53.685 52.037 -0.303 0.000 0.620 484 A CB -0.289 18.388 19.000 -0.539 0.000 0.819 484 A HN -0.103 7.761 8.150 -0.476 0.000 0.442 485 E N -1.701 118.315 120.200 -0.306 0.000 2.338 485 E HA -0.042 4.351 4.350 -0.174 -0.147 0.272 485 E C 0.274 176.867 176.600 -0.012 0.000 1.029 485 E CA -0.452 55.835 56.400 -0.189 0.000 0.872 485 E CB 0.797 30.333 29.700 -0.273 0.000 1.015 485 E HN -0.608 7.523 8.360 -0.383 0.000 0.417 486 N N 5.933 124.653 118.700 0.034 0.000 2.412 486 N HA -0.043 4.702 4.740 0.008 0.000 0.184 486 N C 0.197 175.693 175.510 -0.024 0.000 1.101 486 N CA 1.615 54.675 53.050 0.018 0.000 0.881 486 N CB 0.787 39.293 38.487 0.033 0.000 0.969 486 N HN 0.309 9.005 8.380 0.065 -0.277 0.459 487 S N -2.615 113.042 115.700 -0.073 0.000 2.575 487 S HA 0.028 4.381 4.470 -0.195 0.000 0.215 487 S C 0.614 175.232 174.600 0.030 0.000 0.966 487 S CA 0.277 58.361 58.200 -0.192 0.000 0.911 487 S CB 1.378 64.143 63.200 -0.725 0.000 0.780 487 S HN -0.427 8.207 8.310 -0.024 -0.339 0.514 488 V N -0.178 119.801 119.914 0.108 0.000 5.479 488 V HA -0.561 3.686 4.120 0.211 0.000 0.289 488 V C -0.429 175.782 176.094 0.195 0.000 0.595 488 V CA 1.085 63.483 62.300 0.165 0.000 0.649 488 V CB -2.366 29.522 31.823 0.109 0.000 0.390 488 V HN -0.461 7.739 8.190 0.109 0.056 0.974 489 G N -1.998 106.956 108.800 0.257 0.000 2.241 489 G HA2 -0.490 3.593 3.960 0.205 0.000 0.244 489 G HA3 -0.490 3.540 3.960 0.116 0.000 0.244 489 G C 0.753 175.778 174.900 0.207 0.000 0.998 489 G CA 0.691 45.909 45.100 0.196 0.000 0.621 489 G HN -0.208 8.279 8.290 0.333 0.003 0.519 490 F N 2.372 122.377 119.950 0.093 0.000 2.161 490 F HA -0.417 4.201 4.527 0.151 0.000 0.300 490 F C 0.670 176.628 175.800 0.263 0.000 1.089 490 F CA 3.455 61.528 58.000 0.122 0.000 1.282 490 F CB 0.255 39.279 39.000 0.039 0.000 1.010 490 F HN -0.679 7.638 8.300 0.300 0.163 0.485 491 H N -5.070 114.206 119.070 0.343 0.000 2.491 491 H HA -0.292 4.515 4.556 0.419 0.000 0.290 491 H C -1.164 174.333 175.328 0.283 0.000 1.050 491 H CA 2.023 58.295 56.048 0.373 0.000 1.309 491 H CB 0.955 30.968 29.762 0.420 0.000 1.392 491 H HN -0.565 7.862 8.280 0.263 0.011 0.554 492 N N -5.017 113.872 118.700 0.315 0.000 3.029 492 N HA 0.260 5.087 4.740 0.146 0.000 0.198 492 N C -2.619 172.953 175.510 0.104 0.000 1.444 492 N CA -1.357 51.821 53.050 0.214 0.000 0.784 492 N CB -0.054 38.616 38.487 0.306 0.000 1.539 492 N HN -0.635 7.890 8.380 0.295 0.032 0.582 493 P HA 0.024 4.534 4.420 0.004 -0.088 0.217 493 P C 0.878 178.172 177.300 -0.011 0.000 1.150 493 P CA 2.264 65.368 63.100 0.007 0.000 0.832 493 P CB 0.572 32.281 31.700 0.015 0.000 0.787 494 D N -1.647 118.756 120.400 0.005 0.000 2.149 494 D HA -0.213 4.434 4.640 0.012 0.000 0.201 494 D C 2.048 178.361 176.300 0.022 0.000 0.972 494 D CA 3.379 57.386 54.000 0.012 0.000 0.835 494 D CB -0.665 40.145 40.800 0.016 0.000 0.966 494 D HN 0.154 8.531 8.370 0.011 0.000 0.476 495 Q N 1.242 121.072 119.800 0.049 0.000 2.079 495 Q HA -0.332 4.151 4.340 0.239 0.000 0.200 495 Q C 1.988 177.905 176.000 -0.138 0.000 0.974 495 Q CA 3.023 58.899 55.803 0.123 0.000 0.840 495 Q CB 0.030 28.911 28.738 0.238 0.000 0.898 495 Q HN -0.723 7.779 8.270 0.063 -0.195 0.430 496 A N -0.380 122.097 122.820 -0.571 0.000 1.908 496 A HA -0.433 2.287 4.320 -2.666 0.000 0.218 496 A C 1.458 178.623 177.584 -0.697 0.000 1.181 496 A CA 3.519 54.702 52.037 -1.423 0.000 0.627 496 A CB -0.852 17.431 19.000 -1.194 0.000 0.818 496 A HN -0.111 7.801 8.150 -0.396 0.000 0.445 497 R N -1.603 118.733 120.500 -0.274 0.000 2.066 497 R HA -0.349 3.937 4.340 -0.090 0.000 0.232 497 R C 1.791 178.067 176.300 -0.041 0.000 1.131 497 R CA 3.471 59.530 56.100 -0.069 0.000 0.955 497 R CB -0.128 30.238 30.300 0.110 0.000 0.851 497 R HN -0.376 7.775 8.270 -0.199 0.000 0.432 498 E N -1.183 119.023 120.200 0.010 0.000 2.077 498 E HA -0.330 4.040 4.350 0.032 0.000 0.193 498 E C 2.157 178.844 176.600 0.145 0.000 0.989 498 E CA 3.042 59.490 56.400 0.081 0.000 0.800 498 E CB -0.206 29.574 29.700 0.133 0.000 0.746 498 E HN -0.502 7.866 8.360 0.013 0.000 0.452 499 S N 0.171 115.979 115.700 0.181 0.000 2.348 499 S HA -0.291 4.304 4.470 0.210 0.000 0.221 499 S C 2.224 176.918 174.600 0.155 0.000 1.033 499 S CA 3.463 61.776 58.200 0.188 0.000 1.010 499 S CB -0.082 63.302 63.200 0.306 0.000 0.891 499 S HN -0.248 8.128 8.310 0.111 0.000 0.442 500 L N 0.989 122.216 121.223 0.007 0.000 2.083 500 L HA -0.305 4.158 4.340 0.206 0.000 0.209 500 L C 2.596 179.508 176.870 0.070 0.000 1.083 500 L CA 3.134 58.015 54.840 0.068 0.000 0.752 500 L CB -0.053 41.964 42.059 -0.070 0.000 0.899 500 L HN 0.013 8.143 8.230 -0.166 0.000 0.433 501 M N -2.343 117.268 119.600 0.017 0.000 2.159 501 M HA -0.498 3.978 4.480 -0.005 0.000 0.263 501 M C 2.374 178.677 176.300 0.004 0.000 1.063 501 M CA 4.499 59.801 55.300 0.002 0.000 1.110 501 M CB -0.298 32.298 32.600 -0.008 0.000 1.374 501 M HN -0.267 8.022 8.290 -0.003 0.000 0.411 502 T N 1.693 116.256 114.554 0.015 0.000 2.746 502 T HA -0.394 3.939 4.350 -0.029 0.000 0.267 502 T C 1.933 176.699 174.700 0.109 0.000 1.039 502 T CA 4.823 66.918 62.100 -0.007 0.000 1.142 502 T CB -0.690 68.070 68.868 -0.179 0.000 0.866 502 T HN -0.393 7.779 8.240 0.022 0.082 0.444 503 S N 2.527 118.363 115.700 0.227 0.000 2.359 503 S HA -0.419 4.271 4.470 0.368 0.000 0.223 503 S C 2.150 176.847 174.600 0.162 0.000 1.039 503 S CA 3.583 61.960 58.200 0.295 0.000 1.042 503 S CB -0.350 63.077 63.200 0.378 0.000 0.915 503 S HN -0.282 8.174 8.310 0.243 0.000 0.439 504 I N 0.996 121.619 120.570 0.088 0.000 2.208 504 I HA -0.550 3.622 4.170 0.003 0.000 0.245 504 I C 1.648 177.664 176.117 -0.169 0.000 1.097 504 I CA 4.282 65.553 61.300 -0.047 0.000 1.363 504 I CB -0.153 37.791 38.000 -0.092 0.000 1.051 504 I HN -0.371 7.899 8.210 0.100 0.000 0.413 505 S N 0.493 116.132 115.700 -0.102 0.000 2.370 505 S HA -0.422 3.942 4.470 -0.177 0.000 0.226 505 S C 2.170 176.733 174.600 -0.061 0.000 1.033 505 S CA 3.695 61.828 58.200 -0.110 0.000 1.011 505 S CB -0.288 62.874 63.200 -0.063 0.000 0.852 505 S HN -0.276 8.001 8.310 -0.055 0.000 0.457 506 K N 1.142 121.557 120.400 0.026 0.000 2.057 506 K HA -0.154 4.204 4.320 0.063 0.000 0.206 506 K C 2.604 179.239 176.600 0.058 0.000 1.050 506 K CA 2.448 58.782 56.287 0.078 0.000 0.935 506 K CB -0.266 32.341 32.500 0.179 0.000 0.715 506 K HN -0.312 7.973 8.250 0.059 0.000 0.439 507 S N 0.573 116.308 115.700 0.059 0.000 2.370 507 S HA -0.330 4.186 4.470 0.076 0.000 0.226 507 S C 1.966 176.586 174.600 0.034 0.000 1.033 507 S CA 3.651 61.894 58.200 0.071 0.000 1.011 507 S CB -0.177 63.112 63.200 0.147 0.000 0.852 507 S HN -0.045 8.308 8.310 0.072 0.000 0.457 508 K N 0.985 121.302 120.400 -0.138 0.000 2.063 508 K HA -0.375 3.823 4.320 -0.205 0.000 0.208 508 K C 1.817 178.363 176.600 -0.090 0.000 1.048 508 K CA 3.595 59.732 56.287 -0.250 0.000 0.928 508 K CB -0.198 31.984 32.500 -0.530 0.000 0.713 508 K HN -0.084 8.041 8.250 -0.209 0.000 0.442 509 E N -0.624 119.536 120.200 -0.066 0.000 2.058 509 E HA -0.352 3.976 4.350 -0.037 0.000 0.194 509 E C 2.042 178.639 176.600 -0.005 0.000 0.997 509 E CA 3.067 59.450 56.400 -0.028 0.000 0.801 509 E CB -0.076 29.617 29.700 -0.011 0.000 0.746 509 E HN -0.461 7.856 8.360 -0.072 0.000 0.450 510 A N -0.746 122.084 122.820 0.017 0.000 1.930 510 A HA -0.336 3.988 4.320 0.005 0.000 0.217 510 A C 2.000 179.580 177.584 -0.006 0.000 1.175 510 A CA 3.160 55.207 52.037 0.017 0.000 0.627 510 A CB -0.455 18.581 19.000 0.061 0.000 0.815 510 A HN -0.381 7.785 8.150 0.026 0.000 0.443 511 V N -0.684 119.250 119.914 0.033 0.000 2.295 511 V HA -0.674 3.457 4.120 0.018 0.000 0.246 511 V C 1.818 177.923 176.094 0.018 0.000 1.049 511 V CA 4.764 67.094 62.300 0.050 0.000 1.024 511 V CB -0.176 31.756 31.823 0.181 0.000 0.648 511 V HN 0.090 8.313 8.190 0.054 0.000 0.447 512 S N 0.044 115.755 115.700 0.018 0.000 2.356 512 S HA -0.378 4.099 4.470 0.012 0.000 0.223 512 S C 1.987 176.574 174.600 -0.021 0.000 1.032 512 S CA 3.537 61.738 58.200 0.002 0.000 1.005 512 S CB -0.024 63.172 63.200 -0.006 0.000 0.867 512 S HN -0.475 7.846 8.310 0.020 0.000 0.449 513 L N 2.221 123.425 121.223 -0.031 0.000 1.990 513 L HA -0.327 3.990 4.340 -0.039 0.000 0.213 513 L C 1.086 177.910 176.870 -0.076 0.000 1.072 513 L CA 3.399 58.210 54.840 -0.048 0.000 0.755 513 L CB -0.139 41.891 42.059 -0.048 0.000 0.889 513 L HN -0.476 7.739 8.230 -0.026 0.000 0.432 514 L N -2.359 118.800 121.223 -0.108 0.000 2.056 514 L HA -0.498 3.735 4.340 -0.178 0.000 0.207 514 L C 2.177 178.984 176.870 -0.104 0.000 1.078 514 L CA 3.373 58.118 54.840 -0.157 0.000 0.749 514 L CB -0.757 41.154 42.059 -0.246 0.000 0.901 514 L HN -0.067 8.103 8.230 -0.101 0.000 0.433 515 N N -0.575 118.086 118.700 -0.066 0.000 2.069 515 N HA -0.330 4.382 4.740 -0.047 0.000 0.191 515 N C 2.238 177.726 175.510 -0.037 0.000 1.031 515 N CA 3.292 56.317 53.050 -0.041 0.000 0.852 515 N CB -0.583 37.895 38.487 -0.014 0.000 1.018 515 N HN -0.023 8.324 8.380 -0.056 0.000 0.423 516 D N -0.016 120.363 120.400 -0.034 0.000 2.117 516 D HA -0.234 4.393 4.640 -0.022 0.000 0.197 516 D C 1.940 178.219 176.300 -0.035 0.000 0.987 516 D CA 3.388 57.371 54.000 -0.028 0.000 0.829 516 D CB -0.523 40.262 40.800 -0.024 0.000 0.961 516 D HN -0.220 8.130 8.370 -0.034 0.000 0.460 517 A N -0.292 122.498 122.820 -0.049 0.000 1.902 517 A HA -0.232 4.062 4.320 -0.043 0.000 0.217 517 A C 2.272 179.826 177.584 -0.051 0.000 1.181 517 A CA 3.048 55.053 52.037 -0.053 0.000 0.623 517 A CB -0.515 18.442 19.000 -0.073 0.000 0.818 517 A HN -0.420 7.695 8.150 -0.057 0.000 0.443 518 I N -1.310 119.225 120.570 -0.058 0.000 2.179 518 I HA -0.622 3.519 4.170 -0.049 0.000 0.242 518 I C 1.579 177.676 176.117 -0.033 0.000 1.088 518 I CA 4.605 65.876 61.300 -0.048 0.000 1.357 518 I CB -0.212 37.757 38.000 -0.052 0.000 1.051 518 I HN -0.014 8.156 8.210 -0.067 0.000 0.409 519 D N -0.059 120.324 120.400 -0.030 0.000 2.149 519 D HA -0.304 4.325 4.640 -0.019 0.000 0.198 519 D C 2.034 178.323 176.300 -0.019 0.000 0.990 519 D CA 3.044 57.031 54.000 -0.021 0.000 0.839 519 D CB -0.540 40.250 40.800 -0.017 0.000 0.948 519 D HN -0.289 8.062 8.370 -0.032 0.000 0.460 520 A N -0.510 122.297 122.820 -0.021 0.000 1.940 520 A HA -0.229 4.081 4.320 -0.016 0.000 0.219 520 A C 1.893 179.466 177.584 -0.018 0.000 1.176 520 A CA 2.382 54.407 52.037 -0.019 0.000 0.631 520 A CB -0.134 18.854 19.000 -0.021 0.000 0.814 520 A HN -0.092 8.044 8.150 -0.025 0.000 0.446 521 Q N -2.696 117.091 119.800 -0.021 0.000 2.167 521 Q HA -0.201 4.129 4.340 -0.017 0.000 0.202 521 Q C 2.287 178.278 176.000 -0.015 0.000 0.970 521 Q CA 1.831 57.623 55.803 -0.018 0.000 0.855 521 Q CB 0.228 28.953 28.738 -0.022 0.000 0.911 521 Q HN -0.440 7.724 8.270 -0.025 0.091 0.438 522 V N -2.153 117.752 119.914 -0.015 0.000 2.427 522 V HA -0.244 3.869 4.120 -0.012 0.000 0.248 522 V C 0.045 176.133 176.094 -0.010 0.000 1.051 522 V CA 1.829 64.122 62.300 -0.012 0.000 1.048 522 V CB 0.484 32.299 31.823 -0.013 0.000 0.666 522 V HN -0.553 7.627 8.190 -0.018 0.000 0.456 523 A N 0.000 122.813 122.820 -0.011 0.000 2.254 523 A HA 0.000 4.320 4.320 -0.000 0.000 0.244 523 A CA 0.000 52.032 52.037 -0.009 0.000 0.836 523 A CB 0.000 19.000 19.000 -0.000 0.000 0.831 523 A HN 0.000 nan 8.150 nan 0.000 0.486