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 3fo3_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 4.710 4.740 -0.051 0.000 0.220 5 N C 0.000 175.471 175.510 -0.065 0.000 1.280 5 N CA 0.000 53.021 53.050 -0.048 0.000 0.885 5 N CB 0.000 38.464 38.487 -0.039 0.000 1.341 6 L N 1.060 122.227 121.223 -0.094 0.000 2.456 6 L HA -0.017 4.251 4.340 -0.119 0.000 0.272 6 L C -0.140 176.667 176.870 -0.104 0.000 1.189 6 L CA 0.441 55.202 54.840 -0.131 0.000 0.846 6 L CB 0.524 42.436 42.059 -0.245 0.000 1.111 6 L HN 0.106 8.277 8.230 -0.098 0.000 0.475 7 K N 3.212 123.556 120.400 -0.093 0.000 2.323 7 K HA 0.421 4.706 4.320 -0.058 0.000 0.259 7 K C -2.252 174.306 176.600 -0.070 0.000 0.947 7 K CA -3.020 53.227 56.287 -0.066 0.000 0.819 7 K CB 0.887 33.358 32.500 -0.048 0.000 1.109 7 K HN -0.120 8.074 8.250 -0.094 0.000 0.429 8 P HA -0.027 4.498 4.420 -0.056 -0.139 0.272 8 P C -1.073 176.202 177.300 -0.042 0.000 1.223 8 P CA -0.521 62.552 63.100 -0.045 0.000 0.784 8 P CB 0.678 32.367 31.700 -0.019 0.000 0.923 9 V N -3.748 116.138 119.914 -0.047 0.000 2.975 9 V HA 0.240 4.330 4.120 -0.050 0.000 0.318 9 V C -1.122 174.927 176.094 -0.074 0.000 1.077 9 V CA -2.710 59.557 62.300 -0.056 0.000 1.000 9 V CB 1.900 33.689 31.823 -0.057 0.000 1.066 9 V HN -0.083 8.377 8.190 -0.045 -0.297 0.452 10 D N 1.152 121.502 120.400 -0.083 0.000 2.383 10 D HA -0.002 4.587 4.640 -0.086 0.000 0.245 10 D C 0.328 176.515 176.300 -0.188 0.000 1.263 10 D CA -0.322 53.617 54.000 -0.102 0.000 0.936 10 D CB -0.021 40.733 40.800 -0.077 0.000 1.053 10 D HN 0.162 8.488 8.370 -0.074 0.000 0.507 11 A N 7.525 130.187 122.820 -0.263 0.000 1.972 11 A HA -0.213 3.770 4.320 -0.562 0.000 0.219 11 A C 1.218 178.326 177.584 -0.793 0.000 1.169 11 A CA 2.442 54.130 52.037 -0.581 0.000 0.635 11 A CB 0.041 18.663 19.000 -0.631 0.000 0.810 11 A HN 0.158 8.190 8.150 -0.197 0.000 0.446 12 M N -3.011 116.376 119.600 -0.356 0.000 2.213 12 M HA -0.373 4.104 4.480 -0.005 0.000 0.263 12 M C 1.925 178.171 176.300 -0.089 0.000 1.062 12 M CA 1.475 56.703 55.300 -0.121 0.000 1.105 12 M CB -1.570 31.042 32.600 0.020 0.000 1.385 12 M HN -0.456 7.823 8.290 -0.222 -0.122 0.417 13 Q N 0.455 120.179 119.800 -0.126 0.000 2.050 13 Q HA -0.278 4.033 4.340 -0.049 0.000 0.202 13 Q C 2.891 178.839 176.000 -0.087 0.000 0.980 13 Q CA 3.101 58.853 55.803 -0.086 0.000 0.840 13 Q CB -0.174 28.511 28.738 -0.088 0.000 0.898 13 Q HN -0.449 7.877 8.270 -0.143 -0.142 0.424 14 C N -0.284 118.920 119.300 -0.161 0.000 2.413 14 C HA -0.275 4.196 4.460 0.019 0.000 0.276 14 C C 2.729 177.782 174.990 0.105 0.000 1.248 14 C CA 3.746 62.732 59.018 -0.053 0.000 1.742 14 C CB -1.939 25.705 27.740 -0.160 0.000 2.017 14 C HN -0.516 7.569 8.230 -0.241 0.000 0.481 15 F N -3.257 116.713 119.950 0.033 0.000 2.451 15 F HA -0.127 4.438 4.527 0.063 0.000 0.299 15 F C 1.047 176.849 175.800 0.002 0.000 1.101 15 F CA -0.456 57.563 58.000 0.033 0.000 1.436 15 F CB -1.145 37.870 39.000 0.025 0.000 1.074 15 F HN -0.381 7.724 8.300 -0.168 0.095 0.553 16 D N -1.332 119.155 120.400 0.145 0.000 2.264 16 D HA -0.149 4.531 4.640 0.066 0.000 0.208 16 D C 0.378 176.676 176.300 -0.004 0.000 0.966 16 D CA 2.315 56.347 54.000 0.053 0.000 0.864 16 D CB 0.391 41.198 40.800 0.011 0.000 0.933 16 D HN -0.430 7.867 8.370 0.107 0.137 0.499 17 C N -2.351 116.915 119.300 -0.055 0.000 2.464 17 C HA 0.176 nan 4.460 nan 0.000 0.348 17 C C 0.806 175.680 174.990 -0.194 0.000 1.367 17 C CA 0.088 58.989 59.018 -0.195 0.000 2.012 17 C CB 0.298 27.814 27.740 -0.372 0.000 2.434 17 C HN -0.470 7.718 8.230 -0.035 0.020 0.536 18 H N 2.351 121.482 119.070 0.102 0.000 2.745 18 H HA 0.348 4.957 4.556 0.088 0.000 0.235 18 H C 1.458 176.848 175.328 0.104 0.000 1.815 18 H CA -0.603 55.512 56.048 0.112 0.000 1.321 18 H CB -0.075 29.756 29.762 0.115 0.000 1.716 18 H HN 0.095 nan 8.280 nan 0.000 0.546 19 T N 0.683 115.310 114.554 0.121 0.000 2.867 19 T HA -0.120 4.230 4.350 -0.000 0.000 0.268 19 T C 1.708 176.415 174.700 0.011 0.000 1.057 19 T CA 0.720 62.843 62.100 0.038 0.000 1.136 19 T CB 0.475 69.349 68.868 0.009 0.000 0.874 19 T HN 0.138 nan 8.240 nan 0.000 0.466 20 Q N 1.865 121.700 119.800 0.059 0.000 2.083 20 Q HA -0.239 4.103 4.340 0.002 0.000 0.198 20 Q C 1.478 177.516 176.000 0.064 0.000 0.969 20 Q CA 2.704 58.534 55.803 0.045 0.000 0.838 20 Q CB -0.026 28.735 28.738 0.038 0.000 0.900 20 Q HN -0.030 8.299 8.270 0.098 0.000 0.436 21 I N -1.696 118.929 120.570 0.091 0.000 2.226 21 I HA -0.409 3.767 4.170 0.010 0.000 0.245 21 I C 1.951 178.036 176.117 -0.053 0.000 1.100 21 I CA 2.322 63.630 61.300 0.014 0.000 1.374 21 I CB -1.447 36.505 38.000 -0.080 0.000 1.057 21 I HN -0.196 8.099 8.210 0.143 0.000 0.413 22 E N 1.472 121.512 120.200 -0.267 0.000 2.058 22 E HA -0.511 2.775 4.350 -1.773 0.000 0.194 22 E C 2.104 178.454 176.600 -0.416 0.000 0.997 22 E CA 3.765 59.622 56.400 -0.906 0.000 0.801 22 E CB -0.203 28.987 29.700 -0.851 0.000 0.746 22 E HN -0.158 8.128 8.360 -0.123 0.000 0.450 23 D N -1.172 119.114 120.400 -0.190 0.000 2.144 23 D HA -0.216 4.357 4.640 -0.111 0.000 0.199 23 D C 2.555 178.838 176.300 -0.028 0.000 0.984 23 D CA 2.898 56.841 54.000 -0.094 0.000 0.834 23 D CB -0.273 40.495 40.800 -0.053 0.000 0.955 23 D HN -0.470 7.811 8.370 -0.149 0.000 0.465 24 M N -1.116 118.500 119.600 0.027 0.000 2.123 24 M HA -0.300 4.226 4.480 0.077 0.000 0.263 24 M C 1.897 178.282 176.300 0.141 0.000 1.069 24 M CA 3.976 59.338 55.300 0.103 0.000 1.133 24 M CB 0.323 33.032 32.600 0.181 0.000 1.356 24 M HN -0.424 7.881 8.290 0.025 0.000 0.415 25 H N 0.259 119.373 119.070 0.074 0.000 2.363 25 H HA -0.039 4.881 4.556 0.212 -0.238 0.301 25 H C 2.353 177.741 175.328 0.101 0.000 1.074 25 H CA 4.175 60.317 56.048 0.156 0.000 1.354 25 H CB 1.461 31.385 29.762 0.270 0.000 1.397 25 H HN 0.089 8.504 8.280 0.225 0.000 0.516 26 T N -4.412 110.201 114.554 0.098 0.000 2.995 26 T HA -0.103 4.325 4.350 0.130 0.000 0.269 26 T C 1.423 176.130 174.700 0.012 0.000 1.091 26 T CA 2.827 64.962 62.100 0.059 0.000 1.128 26 T CB -0.309 68.548 68.868 -0.019 0.000 0.891 26 T HN -0.230 8.025 8.240 0.024 0.000 0.492 27 V N -0.094 119.821 119.914 0.001 0.000 2.825 27 V HA 0.188 4.308 4.120 0.000 0.000 0.246 27 V C 1.047 177.137 176.094 -0.006 0.000 1.068 27 V CA 0.541 62.841 62.300 -0.001 0.000 1.088 27 V CB 0.142 31.965 31.823 0.001 0.000 0.733 27 V HN -0.367 7.796 8.190 0.006 0.030 0.468 28 G N -1.061 107.730 108.800 -0.013 0.000 2.508 28 G HA2 0.162 4.110 3.960 -0.020 0.000 0.278 28 G HA3 0.162 4.259 3.960 -0.027 -0.154 0.278 28 G C -0.232 174.641 174.900 -0.044 0.000 1.389 28 G CA -0.649 44.435 45.100 -0.027 0.000 1.050 28 G HN -0.768 7.517 8.290 -0.009 0.000 0.522 29 K N -1.265 119.095 120.400 -0.066 0.000 2.444 29 K HA 0.020 4.331 4.320 -0.015 0.000 0.193 29 K C 0.304 176.926 176.600 0.036 0.000 1.024 29 K CA 1.002 57.264 56.287 -0.042 0.000 1.077 29 K CB 0.181 32.641 32.500 -0.067 0.000 0.833 29 K HN -0.248 7.945 8.250 -0.096 0.000 0.517 30 H N -2.340 116.667 119.070 -0.106 0.000 2.505 30 H HA 0.253 4.751 4.556 -0.098 0.000 0.286 30 H C 0.343 175.435 175.328 -0.394 0.000 1.072 30 H CA -1.116 54.836 56.048 -0.160 0.000 1.141 30 H CB 0.016 29.727 29.762 -0.085 0.000 1.550 30 H HN -0.122 8.102 8.280 -0.012 0.050 0.547 31 A N -0.272 122.419 122.820 -0.214 0.000 2.024 31 A HA -0.170 3.951 4.320 -0.562 -0.138 0.220 31 A C 0.269 177.839 177.584 -0.025 0.000 1.164 31 A CA 2.528 54.416 52.037 -0.249 0.000 0.643 31 A CB 0.062 19.031 19.000 -0.052 0.000 0.806 31 A HN -0.810 7.219 8.150 -0.106 0.057 0.451 32 T N -8.330 106.231 114.554 0.012 0.000 3.086 32 T HA 0.076 4.489 4.350 0.105 0.000 0.250 32 T C 0.352 175.099 174.700 0.078 0.000 1.074 32 T CA -0.712 61.428 62.100 0.068 0.000 0.988 32 T CB 0.108 68.998 68.868 0.037 0.000 0.988 32 T HN -0.393 7.819 8.240 -0.005 0.025 0.530 33 V N 4.813 124.768 119.914 0.069 0.000 2.368 33 V HA 0.016 4.115 4.120 -0.036 0.000 0.266 33 V C -0.290 175.946 176.094 0.238 0.000 1.045 33 V CA -0.221 62.094 62.300 0.025 0.000 0.899 33 V CB -1.152 30.520 31.823 -0.251 0.000 1.006 33 V HN -0.354 7.692 8.190 0.041 0.169 0.470 34 N N 5.571 124.409 118.700 0.229 0.000 2.508 34 N HA -0.092 4.742 4.740 0.156 0.000 0.264 34 N C 1.381 176.998 175.510 0.179 0.000 1.216 34 N CA 0.516 53.680 53.050 0.191 0.000 0.943 34 N CB 2.480 41.044 38.487 0.128 0.000 1.113 34 N HN 0.113 8.632 8.380 0.232 0.000 0.447 35 C N 2.253 121.600 119.300 0.078 0.000 2.410 35 C HA -0.218 4.348 4.460 0.177 0.000 0.281 35 C C 1.685 176.735 174.990 0.100 0.000 1.318 35 C CA 2.255 61.342 59.018 0.114 0.000 1.776 35 C CB -1.658 26.111 27.740 0.048 0.000 1.942 35 C HN 0.741 8.978 8.230 0.011 0.000 0.508 36 V N 1.072 120.997 119.914 0.019 0.000 2.867 36 V HA -0.225 4.089 4.120 -0.018 -0.205 0.260 36 V C 1.237 177.250 176.094 -0.135 0.000 1.099 36 V CA 2.694 64.958 62.300 -0.060 0.000 1.122 36 V CB -0.604 31.150 31.823 -0.116 0.000 0.708 36 V HN -0.537 7.905 8.190 0.007 -0.248 0.490 37 H N -3.014 116.022 119.070 -0.056 0.000 2.489 37 H HA -0.185 4.320 4.556 -0.085 0.000 0.293 37 H C 0.452 175.702 175.328 -0.131 0.000 1.066 37 H CA 3.441 59.434 56.048 -0.092 0.000 1.305 37 H CB 0.085 29.782 29.762 -0.107 0.000 1.386 37 H HN -0.425 7.861 8.280 0.058 0.029 0.551 38 C N -6.546 112.699 119.300 -0.091 0.000 3.931 38 C HA 0.215 4.553 4.460 -0.204 0.000 0.378 38 C C -1.795 172.932 174.990 -0.437 0.000 1.554 38 C CA -0.138 58.704 59.018 -0.293 0.000 1.926 38 C CB 2.083 29.564 27.740 -0.433 0.000 2.837 38 C HN -0.369 7.792 8.230 -0.068 0.028 0.701 39 H N -0.693 118.366 119.070 -0.020 0.000 2.679 39 H HA 0.854 5.603 4.556 -0.032 -0.213 0.360 39 H C -2.141 173.170 175.328 -0.029 0.000 1.105 39 H CA -1.425 54.605 56.048 -0.030 0.000 1.196 39 H CB 3.191 32.932 29.762 -0.034 0.000 1.636 39 H HN -0.149 8.112 8.280 -0.033 0.000 0.531 40 D N 2.629 123.089 120.400 0.101 0.000 2.454 40 D HA 0.290 4.954 4.640 0.040 0.000 0.225 40 D C -1.314 175.025 176.300 0.064 0.000 1.081 40 D CA -1.014 53.019 54.000 0.054 0.000 0.864 40 D CB 0.640 41.457 40.800 0.029 0.000 1.040 40 D HN 0.224 8.655 8.370 0.101 0.000 0.517 41 A N 5.567 128.429 122.820 0.069 0.000 2.564 41 A HA 0.290 4.683 4.320 0.122 0.000 0.279 41 A C 0.348 177.985 177.584 0.088 0.000 1.232 41 A CA -0.182 51.918 52.037 0.106 0.000 0.950 41 A CB 0.781 19.856 19.000 0.125 0.000 1.138 41 A HN 0.412 8.595 8.150 0.056 0.000 0.526 42 T N 2.436 117.017 114.554 0.045 0.000 2.652 42 T HA -0.469 3.885 4.350 0.006 0.000 0.267 42 T C 1.972 176.686 174.700 0.023 0.000 1.039 42 T CA 5.647 67.758 62.100 0.019 0.000 1.153 42 T CB -0.388 68.485 68.868 0.008 0.000 0.863 42 T HN -0.481 7.955 8.240 0.039 -0.173 0.428 43 E N -0.764 119.461 120.200 0.041 0.000 2.152 43 E HA -0.355 4.006 4.350 0.018 0.000 0.192 43 E C 1.748 178.387 176.600 0.065 0.000 0.983 43 E CA 2.856 59.279 56.400 0.039 0.000 0.818 43 E CB -0.231 29.492 29.700 0.037 0.000 0.758 43 E HN 0.285 8.672 8.360 0.045 0.000 0.467 44 H N 0.428 119.491 119.070 -0.012 0.000 2.290 44 H HA -0.278 4.395 4.556 -0.011 -0.123 0.298 44 H C 1.812 177.131 175.328 -0.015 0.000 1.087 44 H CA 2.861 58.902 56.048 -0.011 0.000 1.291 44 H CB -0.289 29.466 29.762 -0.011 0.000 1.369 44 H HN -0.383 8.012 8.280 0.191 0.000 0.492 45 V N -1.947 117.866 119.914 -0.169 0.000 2.490 45 V HA -0.364 3.531 4.120 -0.374 0.000 0.250 45 V C 1.074 177.076 176.094 -0.152 0.000 1.061 45 V CA 3.451 65.613 62.300 -0.231 0.000 1.064 45 V CB -0.791 30.958 31.823 -0.123 0.000 0.670 45 V HN -0.077 8.093 8.190 -0.033 0.000 0.461 46 E N -3.459 116.690 120.200 -0.085 0.000 2.274 46 E HA -0.079 4.235 4.350 -0.061 0.000 0.194 46 E C 0.997 177.561 176.600 -0.059 0.000 0.996 46 E CA 1.952 58.316 56.400 -0.059 0.000 0.840 46 E CB 0.050 29.731 29.700 -0.031 0.000 0.772 46 E HN -0.300 8.010 8.360 -0.059 0.015 0.491 47 T N -7.202 107.312 114.554 -0.067 0.000 2.958 47 T HA 0.121 4.448 4.350 -0.038 0.000 0.256 47 T C 0.312 174.977 174.700 -0.059 0.000 0.983 47 T CA -0.620 61.454 62.100 -0.043 0.000 0.924 47 T CB 1.032 69.898 68.868 -0.004 0.000 1.136 47 T HN -0.386 7.651 8.240 -0.083 0.153 0.506 48 A N 3.532 126.274 122.820 -0.130 0.000 2.351 48 A HA 0.101 4.602 4.320 -0.057 -0.215 0.257 48 A C -0.255 177.263 177.584 -0.110 0.000 1.087 48 A CA -0.518 51.438 52.037 -0.136 0.000 0.798 48 A CB 1.329 20.122 19.000 -0.345 0.000 1.033 48 A HN -0.321 7.711 8.150 -0.196 0.000 0.488 49 S N 1.198 116.852 115.700 -0.077 0.000 2.751 49 S HA 0.253 4.671 4.470 -0.087 0.000 0.310 49 S C 1.734 176.286 174.600 -0.081 0.000 1.128 49 S CA -1.029 57.126 58.200 -0.075 0.000 0.931 49 S CB 2.467 65.637 63.200 -0.050 0.000 1.177 49 S HN -0.040 8.238 8.310 -0.052 0.000 0.530 50 S N -0.114 115.537 115.700 -0.081 0.000 2.469 50 S HA -0.119 4.276 4.470 -0.124 0.000 0.238 50 S C 1.405 175.971 174.600 -0.058 0.000 0.998 50 S CA 2.658 60.805 58.200 -0.087 0.000 0.957 50 S CB -0.667 62.489 63.200 -0.073 0.000 0.764 50 S HN 0.580 8.846 8.310 -0.073 0.000 0.514 51 R N -0.882 119.594 120.500 -0.039 0.000 2.437 51 R HA 0.173 4.502 4.340 -0.019 0.000 0.257 51 R C -1.225 175.067 176.300 -0.014 0.000 0.927 51 R CA -0.543 55.544 56.100 -0.023 0.000 1.078 51 R CB 1.177 31.465 30.300 -0.021 0.000 1.161 51 R HN -0.594 7.602 8.270 -0.041 0.050 0.529 52 R N -0.724 119.769 120.500 -0.012 0.000 2.510 52 R HA 0.375 4.716 4.340 0.001 0.000 0.287 52 R C -0.987 175.329 176.300 0.027 0.000 1.084 52 R CA -0.430 55.670 56.100 0.001 0.000 0.934 52 R CB 1.547 31.843 30.300 -0.007 0.000 1.201 52 R HN -0.708 7.444 8.270 -0.020 0.106 0.431 53 M N 4.578 124.210 119.600 0.053 0.000 2.149 53 M HA -0.323 4.293 4.480 0.226 0.000 0.261 53 M C 0.664 177.067 176.300 0.172 0.000 1.064 53 M CA 3.366 58.750 55.300 0.140 0.000 1.102 53 M CB 0.200 32.839 32.600 0.066 0.000 1.369 53 M HN 0.326 8.635 8.290 0.032 0.000 0.408 54 G N -3.349 105.499 108.800 0.080 0.000 2.547 54 G HA2 -0.496 3.486 3.960 0.037 0.000 0.271 54 G HA3 -0.496 3.505 3.960 0.068 0.000 0.271 54 G C -0.629 174.325 174.900 0.091 0.000 1.209 54 G CA -0.304 44.837 45.100 0.070 0.000 0.959 54 G HN -0.255 8.042 8.290 0.047 0.021 0.563 55 E N 3.060 123.320 120.200 0.100 0.000 2.414 55 E HA -0.167 4.209 4.350 0.043 0.000 0.263 55 E C -0.116 176.531 176.600 0.078 0.000 1.000 55 E CA -0.061 56.385 56.400 0.076 0.000 0.914 55 E CB 0.698 30.438 29.700 0.067 0.000 0.948 55 E HN -0.049 8.367 8.360 0.092 0.000 0.444 56 R N 4.375 124.874 120.500 -0.002 0.000 2.370 56 R HA -0.007 4.238 4.340 -0.158 0.000 0.309 56 R C -1.800 174.442 176.300 -0.096 0.000 1.059 56 R CA -1.765 54.283 56.100 -0.086 0.000 0.981 56 R CB 0.519 30.784 30.300 -0.058 0.000 0.972 56 R HN 0.217 8.487 8.270 0.000 0.000 0.437 57 P HA 0.032 4.529 4.420 -0.023 -0.091 0.272 57 P C -1.786 175.493 177.300 -0.036 0.000 1.223 57 P CA -0.385 62.649 63.100 -0.110 0.000 0.784 57 P CB 1.206 32.771 31.700 -0.225 0.000 0.923 58 V N 1.476 121.405 119.914 0.025 0.000 2.432 58 V HA 0.157 4.301 4.120 0.041 0.000 0.275 58 V C -0.294 175.851 176.094 0.086 0.000 1.043 58 V CA -0.308 62.020 62.300 0.047 0.000 0.925 58 V CB 0.613 32.460 31.823 0.040 0.000 0.985 58 V HN 0.147 8.358 8.190 0.034 0.000 0.466 59 T N 9.369 123.973 114.554 0.084 0.000 2.779 59 T HA 0.640 5.199 4.350 0.027 -0.194 0.280 59 T C -0.253 174.442 174.700 -0.009 0.000 0.987 59 T CA -0.747 61.382 62.100 0.049 0.000 0.966 59 T CB 0.799 69.718 68.868 0.086 0.000 0.933 59 T HN 0.260 8.542 8.240 0.072 0.000 0.442 60 R N 7.017 127.471 120.500 -0.076 0.000 2.389 60 R HA 0.014 4.363 4.340 0.014 0.000 0.295 60 R C -0.391 175.897 176.300 -0.020 0.000 1.075 60 R CA 0.848 56.926 56.100 -0.037 0.000 1.005 60 R CB 0.720 30.979 30.300 -0.070 0.000 0.987 60 R HN 0.487 8.673 8.270 -0.140 0.000 0.452 61 M N 1.413 121.056 119.600 0.071 0.000 2.300 61 M HA 0.085 4.766 4.480 0.335 0.000 0.313 61 M C -1.414 174.845 176.300 -0.067 0.000 0.988 61 M CA -1.157 54.270 55.300 0.211 0.000 1.012 61 M CB 0.879 33.695 32.600 0.360 0.000 1.586 61 M HN 0.255 8.600 8.290 0.091 0.000 0.562 62 D N -2.036 118.159 120.400 -0.342 0.000 2.399 62 D HA -0.126 3.571 4.640 -1.571 0.000 0.241 62 D C 1.169 177.284 176.300 -0.307 0.000 1.133 62 D CA -0.299 53.260 54.000 -0.735 0.000 0.890 62 D CB 0.666 41.213 40.800 -0.421 0.000 1.201 62 D HN -0.733 7.526 8.370 -0.185 0.000 0.432 63 L N 0.190 121.273 121.223 -0.234 0.000 2.291 63 L HA -0.222 4.080 4.340 -0.062 0.000 0.214 63 L C 2.093 178.914 176.870 -0.083 0.000 1.120 63 L CA 2.970 57.789 54.840 -0.035 0.000 0.799 63 L CB -0.288 41.875 42.059 0.173 0.000 0.925 63 L HN 0.531 8.599 8.230 -0.270 0.000 0.446 64 E N -0.869 119.212 120.200 -0.198 0.000 2.338 64 E HA -0.348 3.643 4.350 -0.598 0.000 0.197 64 E C 1.316 177.785 176.600 -0.219 0.000 1.007 64 E CA 2.431 58.622 56.400 -0.349 0.000 0.849 64 E CB -0.743 28.778 29.700 -0.298 0.000 0.774 64 E HN 0.058 8.353 8.360 -0.157 -0.029 0.506 65 A N -1.693 121.046 122.820 -0.134 0.000 2.019 65 A HA -0.224 4.054 4.320 -0.070 0.000 0.219 65 A C 0.864 178.403 177.584 -0.074 0.000 1.164 65 A CA 2.745 54.733 52.037 -0.081 0.000 0.644 65 A CB -0.391 18.575 19.000 -0.056 0.000 0.805 65 A HN -0.403 7.736 8.150 -0.128 -0.066 0.449 66 C N -4.509 114.752 119.300 -0.066 0.000 2.611 66 C HA 0.125 4.585 4.460 0.001 0.000 0.282 66 C C 1.485 176.445 174.990 -0.052 0.000 1.321 66 C CA 0.619 59.634 59.018 -0.004 0.000 1.747 66 C CB -0.111 27.678 27.740 0.082 0.000 2.124 66 C HN -0.503 7.663 8.230 -0.072 0.021 0.531 67 A N -0.301 122.408 122.820 -0.185 0.000 2.121 67 A HA -0.244 nan 4.320 nan 0.000 0.218 67 A C 1.323 178.764 177.584 -0.238 0.000 1.154 67 A CA 2.932 54.794 52.037 -0.291 0.000 0.679 67 A CB -0.782 17.679 19.000 -0.898 0.000 0.795 67 A HN -0.261 7.643 8.150 -0.248 0.097 0.458 68 T N -2.273 112.154 114.554 -0.212 0.000 2.857 68 T HA -0.160 nan 4.350 nan 0.000 0.266 68 T C 2.216 176.798 174.700 -0.197 0.000 1.048 68 T CA 2.062 64.059 62.100 -0.172 0.000 1.139 68 T CB -0.524 68.272 68.868 -0.120 0.000 0.874 68 T HN -0.232 7.887 8.240 -0.203 0.000 0.455 69 C N 1.032 120.156 119.300 -0.294 0.000 2.563 69 C HA 0.192 4.652 4.460 -0.000 0.000 0.268 69 C C 0.265 174.916 174.990 -0.564 0.000 1.365 69 C CA -0.156 58.584 59.018 -0.463 0.000 1.754 69 C CB -0.637 26.708 27.740 -0.659 0.000 1.932 69 C HN 0.106 nan 8.230 nan 0.000 0.536 70 H N -0.048 118.958 119.070 -0.108 0.000 2.535 70 H HA 0.310 4.800 4.556 -0.110 0.000 0.232 70 H C -0.879 174.398 175.328 -0.085 0.000 1.405 70 H CA -0.986 55.000 56.048 -0.104 0.000 1.224 70 H CB -0.829 28.872 29.762 -0.102 0.000 1.763 70 H HN -0.157 7.918 8.280 -0.164 0.106 0.529 71 T N 3.051 117.596 114.554 -0.014 0.000 2.788 71 T HA -0.272 4.181 4.350 0.052 -0.072 0.268 71 T C 0.698 175.400 174.700 0.003 0.000 1.044 71 T CA 4.452 66.558 62.100 0.008 0.000 1.139 71 T CB -0.048 68.799 68.868 -0.034 0.000 0.867 71 T HN 0.244 8.450 8.240 -0.056 0.000 0.454 72 A N 1.003 123.736 122.820 -0.145 0.000 1.902 72 A HA -0.494 3.666 4.320 -0.267 0.000 0.217 72 A C 1.736 179.191 177.584 -0.215 0.000 1.181 72 A CA 3.452 55.278 52.037 -0.352 0.000 0.623 72 A CB -0.622 17.817 19.000 -0.935 0.000 0.818 72 A HN 0.393 8.447 8.150 -0.161 0.000 0.443 73 Q N -1.179 118.523 119.800 -0.165 0.000 2.079 73 Q HA -0.266 4.003 4.340 -0.118 0.000 0.200 73 Q C 2.229 178.200 176.000 -0.048 0.000 0.974 73 Q CA 3.192 58.870 55.803 -0.208 0.000 0.840 73 Q CB -0.296 28.117 28.738 -0.542 0.000 0.898 73 Q HN -0.365 7.808 8.270 -0.162 0.000 0.430 74 F N 2.092 121.993 119.950 -0.082 0.000 2.069 74 F HA -0.439 4.126 4.527 0.063 0.000 0.298 74 F C 1.272 177.121 175.800 0.080 0.000 1.113 74 F CA 3.639 61.653 58.000 0.023 0.000 1.214 74 F CB 0.250 39.248 39.000 -0.004 0.000 0.978 74 F HN -0.347 8.060 8.300 0.179 0.000 0.474 75 N N -1.944 116.825 118.700 0.115 0.000 2.188 75 N HA -0.370 4.325 4.740 -0.076 0.000 0.184 75 N C 2.044 177.525 175.510 -0.049 0.000 1.018 75 N CA 2.870 55.925 53.050 0.008 0.000 0.858 75 N CB -0.155 38.382 38.487 0.083 0.000 0.989 75 N HN 0.062 8.562 8.380 0.200 0.000 0.426 76 S N 0.382 116.105 115.700 0.037 0.000 2.383 76 S HA -0.140 4.550 4.470 0.042 -0.194 0.227 76 S C 1.972 176.591 174.600 0.033 0.000 1.026 76 S CA 2.585 60.834 58.200 0.081 0.000 0.981 76 S CB -0.327 63.011 63.200 0.231 0.000 0.818 76 S HN -0.552 7.797 8.310 0.066 0.000 0.472 77 F N 3.824 123.733 119.950 -0.068 0.000 2.126 77 F HA -0.228 4.539 4.527 0.002 -0.239 0.299 77 F C 1.882 177.550 175.800 -0.220 0.000 1.096 77 F CA 2.713 60.654 58.000 -0.099 0.000 1.255 77 F CB 0.456 39.381 39.000 -0.125 0.000 0.997 77 F HN -0.410 8.000 8.300 0.183 0.000 0.479 78 V N -8.936 110.611 119.914 -0.612 0.000 3.461 78 V HA -0.081 3.483 4.120 -0.926 0.000 0.267 78 V C -0.395 175.404 176.094 -0.492 0.000 1.186 78 V CA -0.813 61.071 62.300 -0.694 0.000 1.154 78 V CB -1.316 30.135 31.823 -0.619 0.000 0.802 78 V HN -0.706 7.208 8.190 -0.459 0.000 0.474 79 E N 0.296 120.278 120.200 -0.364 0.000 2.452 79 E HA -0.213 4.002 4.350 -0.225 0.000 0.261 79 E C -0.471 175.935 176.600 -0.324 0.000 0.987 79 E CA 0.368 56.607 56.400 -0.268 0.000 0.926 79 E CB 1.219 30.810 29.700 -0.180 0.000 0.934 79 E HN -0.741 7.379 8.360 -0.326 0.045 0.452 80 V N 5.040 124.765 119.914 -0.315 0.000 2.383 80 V HA -0.034 3.924 4.120 -0.270 0.000 0.275 80 V C -0.712 175.112 176.094 -0.449 0.000 1.036 80 V CA -0.358 61.737 62.300 -0.341 0.000 0.889 80 V CB 0.427 32.087 31.823 -0.272 0.000 0.985 80 V HN 0.019 8.035 8.190 -0.289 0.000 0.459 81 R N 6.688 127.010 120.500 -0.296 0.000 2.308 81 R HA 0.157 4.352 4.340 -0.241 0.000 0.325 81 R C 0.827 176.997 176.300 -0.216 0.000 1.161 81 R CA -0.530 55.424 56.100 -0.243 0.000 1.022 81 R CB -0.220 29.977 30.300 -0.171 0.000 1.091 81 R HN -0.032 8.103 8.270 -0.225 0.000 0.497 82 H N 5.544 124.590 119.070 -0.040 0.000 2.491 82 H HA -0.251 4.293 4.556 -0.021 0.000 0.290 82 H C 0.806 176.094 175.328 -0.068 0.000 1.050 82 H CA 2.960 58.989 56.048 -0.032 0.000 1.309 82 H CB 0.131 29.885 29.762 -0.012 0.000 1.392 82 H HN 0.303 8.437 8.280 -0.243 0.000 0.554 83 E N -2.127 118.055 120.200 -0.029 0.000 2.418 83 E HA -0.136 4.137 4.350 -0.129 0.000 0.197 83 E C -0.305 176.014 176.600 -0.469 0.000 1.026 83 E CA 1.074 57.367 56.400 -0.179 0.000 0.862 83 E CB -0.513 29.111 29.700 -0.127 0.000 0.799 83 E HN 0.242 8.552 8.360 -0.036 0.028 0.518 84 S N 1.212 116.735 115.700 -0.295 0.000 2.494 84 S HA 0.031 4.280 4.470 -0.369 0.000 0.312 84 S C -0.389 174.079 174.600 -0.219 0.000 1.121 84 S CA -0.165 57.860 58.200 -0.291 0.000 1.068 84 S CB -0.858 62.240 63.200 -0.170 0.000 1.141 84 S HN -0.833 7.221 8.310 -0.194 0.140 0.527 85 H N 6.501 125.547 119.070 -0.040 0.000 3.034 85 H HA 0.009 4.546 4.556 -0.032 0.000 0.324 85 H C -0.897 174.398 175.328 -0.055 0.000 1.015 85 H CA -1.850 54.174 56.048 -0.041 0.000 1.429 85 H CB -0.801 28.936 29.762 -0.040 0.000 1.429 85 H HN -0.317 7.572 8.280 -0.652 0.000 0.585 86 P HA 0.211 4.600 4.420 -0.052 0.000 0.287 86 P C -0.588 176.709 177.300 -0.005 0.000 1.270 86 P CA -0.547 62.535 63.100 -0.030 0.000 0.844 86 P CB 1.349 32.986 31.700 -0.106 0.000 1.068 87 R N -2.145 118.347 120.500 -0.012 0.000 3.516 87 R HA -0.381 3.971 4.340 0.020 0.000 0.271 87 R C -1.415 174.898 176.300 0.021 0.000 1.098 87 R CA 0.501 56.613 56.100 0.021 0.000 0.732 87 R CB -1.210 29.125 30.300 0.060 0.000 1.152 87 R HN 0.349 8.601 8.270 -0.030 0.000 0.455 88 L N 0.515 121.742 121.223 0.005 0.000 2.259 88 L HA 0.192 4.533 4.340 0.002 0.000 0.288 88 L C -1.348 175.507 176.870 -0.024 0.000 1.051 88 L CA -1.429 53.410 54.840 -0.001 0.000 0.824 88 L CB -0.123 41.945 42.059 0.015 0.000 1.206 88 L HN -0.092 8.130 8.230 -0.001 0.007 0.429 89 E N 7.582 127.779 120.200 -0.006 0.000 2.415 89 E HA -0.210 4.260 4.350 -0.015 -0.129 0.263 89 E C -0.615 175.964 176.600 -0.035 0.000 0.995 89 E CA 0.419 56.817 56.400 -0.004 0.000 0.915 89 E CB 0.102 29.828 29.700 0.044 0.000 0.951 89 E HN 0.545 8.910 8.360 0.008 0.000 0.449 90 K N 4.961 125.299 120.400 -0.105 0.000 2.228 90 K HA -0.073 4.178 4.320 -0.114 0.000 0.202 90 K C 0.396 176.981 176.600 -0.025 0.000 1.051 90 K CA 2.005 58.204 56.287 -0.146 0.000 0.960 90 K CB 0.521 32.787 32.500 -0.389 0.000 0.743 90 K HN 0.221 8.387 8.250 -0.139 0.000 0.458 91 A N -2.150 120.716 122.820 0.077 0.000 3.033 91 A HA 0.303 5.008 4.320 0.252 -0.234 0.250 91 A C -0.667 177.001 177.584 0.141 0.000 1.633 91 A CA -0.714 51.449 52.037 0.209 0.000 1.290 91 A CB -0.815 18.398 19.000 0.355 0.000 1.048 91 A HN -0.638 7.867 8.150 0.087 -0.302 0.648 92 T N -2.998 111.615 114.554 0.099 0.000 2.896 92 T HA 0.342 4.739 4.350 0.077 0.000 0.297 92 T C -1.568 173.178 174.700 0.076 0.000 1.108 92 T CA -1.974 60.171 62.100 0.074 0.000 1.004 92 T CB 1.018 69.912 68.868 0.044 0.000 1.159 92 T HN -0.625 7.597 8.240 0.088 0.071 0.499 93 P HA -0.030 4.439 4.420 0.083 0.000 0.222 93 P C -0.021 177.320 177.300 0.069 0.000 1.147 93 P CA 1.652 64.793 63.100 0.067 0.000 0.790 93 P CB 0.035 31.762 31.700 0.046 0.000 0.780 94 T N -8.925 105.655 114.554 0.043 0.000 3.086 94 T HA 0.069 4.434 4.350 0.026 0.000 0.250 94 T C 0.307 175.012 174.700 0.009 0.000 1.074 94 T CA -0.588 61.524 62.100 0.021 0.000 0.988 94 T CB -0.003 68.862 68.868 -0.006 0.000 0.988 94 T HN -0.106 8.123 8.240 0.034 0.032 0.530 95 S N 1.127 116.847 115.700 0.034 0.000 2.788 95 S HA 0.204 4.666 4.470 -0.014 0.000 0.291 95 S C -0.226 174.419 174.600 0.074 0.000 1.061 95 S CA -1.305 56.904 58.200 0.016 0.000 0.923 95 S CB 1.623 64.818 63.200 -0.008 0.000 1.339 95 S HN -0.366 7.930 8.310 0.054 0.047 0.591 96 R N -0.399 120.128 120.500 0.045 0.000 2.153 96 R HA 0.052 4.491 4.340 0.165 0.000 0.218 96 R C -0.123 176.297 176.300 0.199 0.000 1.072 96 R CA 1.085 57.252 56.100 0.111 0.000 0.990 96 R CB 0.218 30.520 30.300 0.002 0.000 0.889 96 R HN 0.321 8.585 8.270 -0.010 0.000 0.452 97 S N -1.251 114.541 115.700 0.153 0.000 2.279 97 S HA 0.670 5.466 4.470 0.330 -0.129 0.176 97 S C -2.291 172.466 174.600 0.262 0.000 1.554 97 S CA -2.376 55.983 58.200 0.265 0.000 1.242 97 S CB 0.320 63.686 63.200 0.276 0.000 1.163 97 S HN -0.554 7.814 8.310 0.097 0.000 0.449 98 P HA -0.154 4.523 4.420 0.147 -0.168 0.216 98 P C -0.104 177.294 177.300 0.163 0.000 1.150 98 P CA 1.845 65.040 63.100 0.159 0.000 0.843 98 P CB 0.402 32.173 31.700 0.118 0.000 0.787 99 M N -4.937 114.764 119.600 0.168 0.000 2.549 99 M HA 0.124 4.663 4.480 0.098 0.000 0.273 99 M C -0.103 176.316 176.300 0.198 0.000 1.213 99 M CA -0.604 54.764 55.300 0.114 0.000 0.976 99 M CB -0.316 32.280 32.600 -0.006 0.000 1.457 99 M HN -0.236 8.494 8.290 0.178 -0.334 0.485 100 F N 2.570 122.620 119.950 0.166 0.000 2.126 100 F HA -0.433 4.310 4.527 0.361 0.000 0.299 100 F C 0.850 176.770 175.800 0.200 0.000 1.096 100 F CA 4.135 62.295 58.000 0.266 0.000 1.255 100 F CB 0.230 39.412 39.000 0.303 0.000 0.997 100 F HN -0.432 8.091 8.300 0.480 0.065 0.479 101 D N -2.270 118.226 120.400 0.159 0.000 2.117 101 D HA -0.394 4.206 4.640 -0.067 0.000 0.197 101 D C 1.978 178.263 176.300 -0.026 0.000 0.987 101 D CA 4.233 58.238 54.000 0.008 0.000 0.829 101 D CB -0.240 40.585 40.800 0.040 0.000 0.961 101 D HN 0.371 8.883 8.370 0.236 0.000 0.460 102 K N -0.559 119.852 120.400 0.020 0.000 2.057 102 K HA -0.246 4.096 4.320 0.037 0.000 0.206 102 K C 2.677 179.359 176.600 0.137 0.000 1.050 102 K CA 2.673 58.985 56.287 0.041 0.000 0.935 102 K CB -0.280 32.226 32.500 0.010 0.000 0.715 102 K HN -0.617 7.655 8.250 0.037 0.000 0.439 103 L N -1.317 119.953 121.223 0.078 0.000 2.156 103 L HA -0.098 4.365 4.340 0.204 0.000 0.208 103 L C 1.923 179.015 176.870 0.369 0.000 1.095 103 L CA 2.660 57.595 54.840 0.158 0.000 0.770 103 L CB 0.279 42.228 42.059 -0.182 0.000 0.914 103 L HN -0.558 7.684 8.230 0.021 0.000 0.439 104 I N -2.861 117.739 120.570 0.049 0.000 3.956 104 I HA -0.050 4.261 4.170 0.234 0.000 0.333 104 I C -1.640 174.410 176.117 -0.113 0.000 1.302 104 I CA -2.000 59.250 61.300 -0.084 0.000 1.122 104 I CB 0.540 38.064 38.000 -0.793 0.000 1.013 104 I HN 0.013 8.150 8.210 -0.122 0.000 0.405 105 A N 0.479 123.225 122.820 -0.124 0.000 2.580 105 A HA -0.244 3.961 4.320 -0.192 0.000 0.244 105 A C 0.614 178.076 177.584 -0.203 0.000 1.045 105 A CA 2.030 53.928 52.037 -0.233 0.000 0.761 105 A CB -0.388 18.442 19.000 -0.284 0.000 0.962 105 A HN -0.479 7.589 8.150 -0.046 0.054 0.512 106 G N 2.081 110.820 108.800 -0.102 0.000 2.253 106 G HA2 -0.238 3.739 3.960 0.029 0.000 0.209 106 G HA3 -0.238 3.836 3.960 0.192 0.000 0.209 106 G C -0.921 173.965 174.900 -0.024 0.000 0.997 106 G CA -0.093 45.037 45.100 0.049 0.000 0.640 106 G HN 0.412 8.629 8.290 -0.122 0.000 0.496 107 H N 1.610 120.418 119.070 -0.437 0.000 2.499 107 H HA 0.339 4.617 4.556 -0.463 0.000 0.340 107 H C 0.553 175.805 175.328 -0.127 0.000 1.148 107 H CA -0.967 54.734 56.048 -0.579 0.000 1.215 107 H CB 3.240 32.246 29.762 -1.259 0.000 1.529 107 H HN -0.240 7.811 8.280 -0.290 0.055 0.510 108 G N 4.131 112.696 108.800 -0.391 0.000 2.470 108 G HA2 -0.249 3.915 3.960 0.339 0.000 0.220 108 G HA3 -0.249 3.719 3.960 0.012 0.000 0.220 108 G C 1.458 176.617 174.900 0.430 0.000 1.121 108 G CA 1.659 46.833 45.100 0.123 0.000 0.766 108 G HN 0.687 8.377 8.290 -1.000 0.000 0.553 109 F N 2.119 122.255 119.950 0.309 0.000 2.408 109 F HA -0.138 4.547 4.527 0.264 0.000 0.300 109 F C 1.888 177.847 175.800 0.265 0.000 1.090 109 F CA 0.489 58.666 58.000 0.296 0.000 1.427 109 F CB -0.793 38.375 39.000 0.280 0.000 1.070 109 F HN -0.458 8.513 8.300 1.160 0.025 0.549 110 A N -0.410 122.551 122.820 0.235 0.000 2.076 110 A HA -0.258 4.108 4.320 0.077 0.000 0.220 110 A C 1.330 178.866 177.584 -0.079 0.000 1.160 110 A CA 2.260 54.297 52.037 0.000 0.000 0.653 110 A CB -0.796 18.066 19.000 -0.230 0.000 0.801 110 A HN -0.519 7.716 8.150 0.181 0.024 0.455 111 F N -3.293 116.725 119.950 0.114 0.000 2.259 111 F HA -0.156 4.416 4.527 0.074 0.000 0.298 111 F C 0.586 176.441 175.800 0.092 0.000 1.088 111 F CA 2.789 60.837 58.000 0.080 0.000 1.358 111 F CB 0.967 39.992 39.000 0.042 0.000 1.040 111 F HN -0.704 7.763 8.300 0.326 0.029 0.505 112 E N -2.901 117.450 120.200 0.253 0.000 2.552 112 E HA 0.077 4.713 4.350 0.192 -0.171 0.297 112 E C -2.394 174.306 176.600 0.167 0.000 1.038 112 E CA 0.200 56.711 56.400 0.186 0.000 0.856 112 E CB 2.118 31.901 29.700 0.139 0.000 1.222 112 E HN -0.757 7.761 8.360 0.265 0.000 0.422 113 H N 6.309 125.406 119.070 0.045 0.000 3.162 113 H HA 0.244 4.703 4.556 -0.163 0.000 0.309 113 H C -2.725 172.585 175.328 -0.031 0.000 1.156 113 H CA -0.750 55.270 56.048 -0.047 0.000 1.586 113 H CB 1.682 31.488 29.762 0.073 0.000 1.740 113 H HN 0.139 9.006 8.280 0.224 -0.453 0.525 114 A N 6.305 129.089 122.820 -0.060 0.000 2.264 114 A HA 0.413 4.825 4.320 -0.124 -0.166 0.304 114 A C -0.277 177.180 177.584 -0.211 0.000 1.100 114 A CA -1.149 50.818 52.037 -0.117 0.000 0.839 114 A CB 2.044 21.029 19.000 -0.025 0.000 1.121 114 A HN 0.105 8.270 8.150 0.025 0.000 0.496 115 E N 1.160 121.263 120.200 -0.162 0.000 2.404 115 E HA -0.015 4.230 4.350 -0.175 0.000 0.261 115 E C -1.464 175.096 176.600 -0.067 0.000 1.074 115 E CA -1.458 54.864 56.400 -0.129 0.000 0.917 115 E CB 0.015 29.664 29.700 -0.085 0.000 0.965 115 E HN -0.340 7.944 8.360 -0.126 0.000 0.433 116 P HA 0.023 4.440 4.420 -0.004 0.000 0.272 116 P C -1.601 175.676 177.300 -0.038 0.000 1.223 116 P CA 0.197 63.285 63.100 -0.021 0.000 0.784 116 P CB 0.834 32.529 31.700 -0.008 0.000 0.923 117 R N -0.559 119.931 120.500 -0.017 0.000 3.150 117 R HA 0.295 4.601 4.340 -0.057 0.000 0.236 117 R C -0.709 175.592 176.300 0.003 0.000 1.469 117 R CA -1.793 54.295 56.100 -0.020 0.000 1.045 117 R CB 1.451 31.737 30.300 -0.023 0.000 1.481 117 R HN 0.043 8.318 8.270 0.009 0.000 0.506 118 S N -1.481 114.243 115.700 0.041 0.000 2.563 118 S HA 0.139 4.498 4.470 -0.185 0.000 0.284 118 S C 1.713 176.308 174.600 -0.009 0.000 1.331 118 S CA 0.744 58.908 58.200 -0.060 0.000 1.047 118 S CB 0.454 63.599 63.200 -0.091 0.000 0.859 118 S HN 0.209 8.568 8.310 0.083 0.000 0.514 119 H N 4.735 123.711 119.070 -0.156 0.000 2.426 119 H HA -0.364 4.168 4.556 -0.041 0.000 0.298 119 H C 2.076 177.278 175.328 -0.211 0.000 1.107 119 H CA 3.240 59.212 56.048 -0.127 0.000 1.298 119 H CB 0.080 29.820 29.762 -0.036 0.000 1.377 119 H HN 0.739 8.886 8.280 -0.222 0.000 0.519 120 A N -0.906 121.680 122.820 -0.390 0.000 1.986 120 A HA -0.263 3.831 4.320 -0.377 0.000 0.220 120 A C 0.810 178.147 177.584 -0.413 0.000 1.171 120 A CA 2.268 53.987 52.037 -0.530 0.000 0.640 120 A CB -0.544 17.931 19.000 -0.875 0.000 0.811 120 A HN 0.416 8.239 8.150 -0.513 0.020 0.451 121 F N -5.383 114.535 119.950 -0.054 0.000 2.732 121 F HA 0.131 4.650 4.527 -0.012 0.000 0.303 121 F C 0.864 176.637 175.800 -0.046 0.000 1.110 121 F CA -0.101 57.885 58.000 -0.023 0.000 1.355 121 F CB -0.494 38.510 39.000 0.007 0.000 1.081 121 F HN -0.775 7.444 8.300 -0.083 0.032 0.565 122 M N 0.298 119.939 119.600 0.069 0.000 2.108 122 M HA -0.357 4.145 4.480 0.038 0.000 0.261 122 M C 0.948 177.179 176.300 -0.115 0.000 1.066 122 M CA 4.709 60.006 55.300 -0.005 0.000 1.107 122 M CB -0.519 32.055 32.600 -0.044 0.000 1.356 122 M HN -0.428 7.837 8.290 0.040 0.050 0.406 123 L N -1.957 119.140 121.223 -0.211 0.000 2.072 123 L HA -0.175 3.848 4.340 -0.528 0.000 0.205 123 L C 1.092 177.639 176.870 -0.538 0.000 1.079 123 L CA 2.814 57.376 54.840 -0.463 0.000 0.752 123 L CB -0.271 41.494 42.059 -0.490 0.000 0.906 123 L HN -0.191 7.936 8.230 -0.170 0.000 0.436 124 V N -5.076 114.671 119.914 -0.278 0.000 2.407 124 V HA -0.461 3.483 4.120 -0.293 0.000 0.248 124 V C 1.800 177.789 176.094 -0.174 0.000 1.055 124 V CA 3.045 65.201 62.300 -0.241 0.000 1.049 124 V CB -1.060 30.676 31.823 -0.144 0.000 0.662 124 V HN -0.352 7.731 8.190 -0.178 0.000 0.455 125 D N 0.333 120.715 120.400 -0.030 0.000 2.144 125 D HA -0.264 4.392 4.640 0.025 0.000 0.200 125 D C 1.892 178.191 176.300 -0.001 0.000 0.978 125 D CA 3.440 57.451 54.000 0.018 0.000 0.833 125 D CB -0.568 40.274 40.800 0.070 0.000 0.961 125 D HN 0.086 8.466 8.370 0.016 0.000 0.470 126 H N 1.631 120.622 119.070 -0.131 0.000 2.352 126 H HA -0.280 4.261 4.556 -0.026 0.000 0.299 126 H C 2.054 177.450 175.328 0.114 0.000 1.097 126 H CA 3.295 59.289 56.048 -0.090 0.000 1.311 126 H CB 0.071 29.676 29.762 -0.260 0.000 1.377 126 H HN -0.650 7.629 8.280 -0.002 0.000 0.504 127 F N -4.359 115.508 119.950 -0.138 0.000 2.186 127 F HA -0.174 4.257 4.527 -0.161 0.000 0.299 127 F C 1.252 177.030 175.800 -0.037 0.000 1.090 127 F CA 1.924 59.809 58.000 -0.192 0.000 1.307 127 F CB 0.281 38.978 39.000 -0.504 0.000 1.019 127 F HN -0.473 7.629 8.300 -0.192 0.082 0.489 128 V N -8.976 110.963 119.914 0.042 0.000 3.590 128 V HA 0.234 4.527 4.120 0.024 -0.159 0.265 128 V C 0.298 176.409 176.094 0.027 0.000 1.239 128 V CA -0.971 61.318 62.300 -0.019 0.000 1.117 128 V CB -0.072 31.617 31.823 -0.223 0.000 0.818 128 V HN -0.755 7.419 8.190 -0.026 0.000 0.451 129 V N 1.463 121.398 119.914 0.035 0.000 2.872 129 V HA -0.285 3.863 4.120 0.046 0.000 0.307 129 V C 0.662 176.781 176.094 0.043 0.000 1.072 129 V CA 1.351 63.672 62.300 0.034 0.000 1.148 129 V CB 0.649 32.475 31.823 0.006 0.000 0.954 129 V HN -0.624 7.582 8.190 0.026 0.000 0.490 130 D N 6.702 127.139 120.400 0.061 0.000 2.264 130 D HA -0.182 4.494 4.640 0.060 0.000 0.208 130 D C 1.626 177.945 176.300 0.031 0.000 0.966 130 D CA 3.471 57.513 54.000 0.071 0.000 0.864 130 D CB -0.076 40.801 40.800 0.129 0.000 0.933 130 D HN 0.197 8.952 8.370 0.073 -0.341 0.499 131 R N -3.467 117.044 120.500 0.019 0.000 2.299 131 R HA -0.092 4.224 4.340 -0.041 0.000 0.197 131 R C 0.211 176.445 176.300 -0.110 0.000 0.971 131 R CA 2.062 58.147 56.100 -0.025 0.000 1.030 131 R CB -0.682 29.622 30.300 0.006 0.000 0.932 131 R HN 0.075 8.323 8.270 0.018 0.033 0.477 132 A N -0.561 122.190 122.820 -0.115 0.000 1.909 132 A HA 0.078 4.222 4.320 -0.294 0.000 0.209 132 A C -0.397 176.923 177.584 -0.440 0.000 1.247 132 A CA 1.868 53.743 52.037 -0.270 0.000 0.660 132 A CB 1.485 20.343 19.000 -0.235 0.000 0.910 132 A HN -0.560 7.499 8.150 -0.058 0.056 0.465 133 Y N -4.091 116.166 120.300 -0.072 0.000 2.721 133 Y HA 0.393 5.082 4.550 -0.070 -0.181 0.251 133 Y C 0.437 176.278 175.900 -0.098 0.000 1.136 133 Y CA -1.702 56.338 58.100 -0.101 0.000 1.142 133 Y CB 0.882 39.233 38.460 -0.183 0.000 1.212 133 Y HN -0.321 8.010 8.280 0.086 0.000 0.565 134 G N 0.141 108.951 108.800 0.018 0.000 2.203 134 G HA2 -0.470 3.466 3.960 -0.039 0.000 0.263 134 G HA3 -0.470 3.755 3.960 0.075 -0.220 0.263 134 G C -0.038 174.936 174.900 0.123 0.000 1.012 134 G CA 0.839 45.964 45.100 0.041 0.000 0.749 134 G HN 0.280 8.545 8.290 -0.043 0.000 0.512 135 G N -3.179 105.655 108.800 0.056 0.000 2.162 135 G HA2 -0.480 3.485 3.960 0.008 0.000 0.260 135 G HA3 -0.480 3.517 3.960 0.061 0.000 0.260 135 G C 0.198 175.014 174.900 -0.140 0.000 0.976 135 G CA 0.513 45.625 45.100 0.019 0.000 0.655 135 G HN 0.161 8.457 8.290 0.044 0.020 0.533 136 R N -0.556 119.757 120.500 -0.312 0.000 2.091 136 R HA -0.278 3.235 4.340 -1.379 0.000 0.238 136 R C -0.628 175.262 176.300 -0.684 0.000 1.136 136 R CA 2.942 58.501 56.100 -0.901 0.000 0.959 136 R CB 0.723 30.392 30.300 -1.051 0.000 0.856 136 R HN -0.434 7.578 8.270 -0.174 0.154 0.437 137 F N -5.118 114.678 119.950 -0.258 0.000 2.421 137 F HA 0.941 5.553 4.527 -0.241 -0.229 0.337 137 F C -0.322 175.332 175.800 -0.244 0.000 1.105 137 F CA -2.316 55.532 58.000 -0.253 0.000 1.049 137 F CB 0.735 39.553 39.000 -0.304 0.000 1.139 137 F HN -0.294 7.763 8.300 -0.404 0.000 0.479 138 Q N -0.930 118.828 119.800 -0.069 0.000 2.456 138 Q HA 0.257 4.465 4.340 -0.220 0.000 0.284 138 Q C -1.064 174.783 176.000 -0.254 0.000 1.061 138 Q CA -2.049 53.644 55.803 -0.184 0.000 0.799 138 Q CB 4.435 33.083 28.738 -0.150 0.000 1.445 138 Q HN 0.173 8.426 8.270 -0.028 0.000 0.411 139 F N 0.543 120.360 119.950 -0.221 0.000 2.553 139 F HA -0.149 4.430 4.527 -0.150 -0.141 0.356 139 F C 1.834 177.524 175.800 -0.184 0.000 1.142 139 F CA 2.015 59.892 58.000 -0.205 0.000 1.322 139 F CB 0.265 39.111 39.000 -0.257 0.000 1.126 139 F HN 0.377 8.563 8.300 -0.190 0.000 0.599 140 K N 1.620 122.077 120.400 0.095 0.000 2.152 140 K HA -0.368 3.963 4.320 0.018 0.000 0.206 140 K C -0.359 176.252 176.600 0.019 0.000 1.048 140 K CA 2.584 58.896 56.287 0.041 0.000 0.933 140 K CB 0.343 32.878 32.500 0.059 0.000 0.721 140 K HN 0.380 8.721 8.250 0.151 0.000 0.447 141 N N -5.536 113.175 118.700 0.018 0.000 3.020 141 N HA 0.042 4.765 4.740 -0.029 0.000 0.248 141 N C -0.512 174.977 175.510 -0.036 0.000 1.480 141 N CA -1.269 51.784 53.050 0.005 0.000 0.874 141 N CB 0.366 38.899 38.487 0.075 0.000 1.433 141 N HN -0.750 7.656 8.380 0.048 0.003 0.530 142 W N -1.628 119.678 121.300 0.009 0.000 2.699 142 W HA -0.103 4.521 4.660 -0.059 0.000 0.249 142 W C 1.660 178.116 176.519 -0.106 0.000 1.280 142 W CA 2.163 59.480 57.345 -0.047 0.000 1.345 142 W CB 0.087 29.528 29.460 -0.031 0.000 1.128 142 W HN 0.505 8.898 8.180 0.355 0.000 0.642 143 Q N -0.497 119.365 119.800 0.104 0.000 2.230 143 Q HA -0.261 4.095 4.340 0.027 0.000 0.202 143 Q C 2.016 177.981 176.000 -0.059 0.000 0.963 143 Q CA 2.801 58.619 55.803 0.025 0.000 0.866 143 Q CB -0.367 28.392 28.738 0.035 0.000 0.931 143 Q HN -0.265 8.249 8.270 0.118 -0.173 0.452 144 K N -1.626 118.711 120.400 -0.104 0.000 2.442 144 K HA -0.070 4.225 4.320 -0.042 0.000 0.198 144 K C 1.752 178.102 176.600 -0.417 0.000 1.042 144 K CA 1.145 57.352 56.287 -0.133 0.000 0.958 144 K CB -0.821 31.699 32.500 0.033 0.000 0.766 144 K HN -0.545 7.742 8.250 -0.079 -0.085 0.474 145 V N -6.028 113.476 119.914 -0.684 0.000 2.867 145 V HA -0.193 3.013 4.120 -1.523 0.000 0.260 145 V C 0.971 176.806 176.094 -0.433 0.000 1.099 145 V CA 2.922 64.681 62.300 -0.903 0.000 1.122 145 V CB -1.658 29.775 31.823 -0.650 0.000 0.708 145 V HN -0.453 7.368 8.190 -0.529 0.051 0.490 146 T N -5.736 108.727 114.554 -0.152 0.000 3.081 146 T HA -0.140 4.255 4.350 0.075 0.000 0.255 146 T C 0.246 175.098 174.700 0.253 0.000 1.113 146 T CA 1.019 63.156 62.100 0.062 0.000 1.082 146 T CB -0.087 68.812 68.868 0.050 0.000 0.939 146 T HN -0.559 7.553 8.240 -0.146 0.041 0.506 147 D N 3.694 124.230 120.400 0.225 0.000 2.522 147 D HA 0.172 4.888 4.640 0.127 0.000 0.218 147 D C 0.686 177.067 176.300 0.134 0.000 1.149 147 D CA -1.628 52.474 54.000 0.170 0.000 0.981 147 D CB -0.434 40.431 40.800 0.107 0.000 1.041 147 D HN -0.538 7.774 8.370 0.156 0.151 0.518 148 G N 2.681 111.449 108.800 -0.054 0.000 2.402 148 G HA2 -0.328 2.989 3.960 -1.073 0.000 0.216 148 G HA3 -0.328 3.230 3.960 -0.670 0.000 0.216 148 G C 0.780 175.491 174.900 -0.316 0.000 1.162 148 G CA 2.319 47.076 45.100 -0.572 0.000 0.777 148 G HN -0.215 8.094 8.290 0.032 0.000 0.539 149 M N 1.993 121.503 119.600 -0.149 0.000 2.159 149 M HA -0.218 4.215 4.480 -0.079 0.000 0.263 149 M C 1.973 178.272 176.300 -0.002 0.000 1.063 149 M CA 1.476 56.742 55.300 -0.057 0.000 1.110 149 M CB -0.460 32.142 32.600 0.004 0.000 1.374 149 M HN -0.098 8.126 8.290 -0.110 0.000 0.411 150 G N -2.197 106.609 108.800 0.011 0.000 2.421 150 G HA2 -0.398 3.591 3.960 0.049 0.000 0.216 150 G HA3 -0.398 3.755 3.960 0.054 -0.161 0.216 150 G C 0.525 175.441 174.900 0.028 0.000 1.171 150 G CA 1.894 47.018 45.100 0.040 0.000 0.775 150 G HN -0.249 8.344 8.290 0.011 -0.297 0.543 151 A N 1.663 124.487 122.820 0.006 0.000 1.908 151 A HA -0.293 4.022 4.320 -0.010 0.000 0.218 151 A C 1.927 179.491 177.584 -0.034 0.000 1.181 151 A CA 2.881 54.906 52.037 -0.020 0.000 0.627 151 A CB -0.480 18.506 19.000 -0.023 0.000 0.818 151 A HN -0.483 7.667 8.150 0.001 0.000 0.445 152 V N -1.478 118.418 119.914 -0.029 0.000 2.358 152 V HA -0.396 3.769 4.120 0.075 0.000 0.246 152 V C 2.353 178.553 176.094 0.177 0.000 1.047 152 V CA 3.550 65.891 62.300 0.068 0.000 1.035 152 V CB -0.826 31.032 31.823 0.059 0.000 0.658 152 V HN -0.492 7.654 8.190 -0.073 0.000 0.452 153 R N -2.178 118.407 120.500 0.143 0.000 2.096 153 R HA -0.221 4.240 4.340 0.202 0.000 0.235 153 R C 0.811 177.220 176.300 0.181 0.000 1.127 153 R CA 2.102 58.304 56.100 0.170 0.000 0.968 153 R CB 0.955 31.322 30.300 0.111 0.000 0.861 153 R HN -0.289 8.042 8.270 0.101 0.000 0.440 154 G N -6.675 102.163 108.800 0.064 0.000 2.380 154 G HA2 0.009 4.071 3.960 -0.132 0.000 0.305 154 G HA3 0.009 3.938 3.960 -0.051 0.000 0.305 154 G C -1.531 173.274 174.900 -0.159 0.000 1.672 154 G CA 0.007 45.068 45.100 -0.065 0.000 0.904 154 G HN -0.636 7.678 8.290 0.039 0.000 0.686 155 A N 3.581 126.197 122.820 -0.341 0.000 1.917 155 A HA -0.214 3.865 4.320 -0.402 0.000 0.219 155 A C 1.211 178.376 177.584 -0.698 0.000 1.182 155 A CA 3.217 54.904 52.037 -0.583 0.000 0.633 155 A CB 0.135 18.642 19.000 -0.822 0.000 0.819 155 A HN 0.365 8.197 8.150 -0.355 0.105 0.448 156 W N -7.662 113.560 121.300 -0.129 0.000 3.077 156 W HA -0.029 4.511 4.660 -0.201 0.000 0.245 156 W C 0.780 177.248 176.519 -0.085 0.000 1.316 156 W CA -0.267 56.984 57.345 -0.156 0.000 1.537 156 W CB -0.610 28.738 29.460 -0.187 0.000 1.131 156 W HN -0.108 7.788 8.180 -0.455 0.011 0.695 157 T N -5.408 109.171 114.554 0.041 0.000 3.055 157 T HA -0.036 4.358 4.350 0.074 0.000 0.265 157 T C 0.741 175.468 174.700 0.045 0.000 1.111 157 T CA 1.449 63.581 62.100 0.052 0.000 1.118 157 T CB 0.095 68.991 68.868 0.048 0.000 0.909 157 T HN -0.375 7.703 8.240 -0.017 0.152 0.501 158 V N -5.923 113.997 119.914 0.010 0.000 3.502 158 V HA 0.283 4.461 4.120 0.097 0.000 0.288 158 V C -1.569 174.547 176.094 0.037 0.000 1.461 158 V CA -0.090 62.254 62.300 0.073 0.000 1.029 158 V CB 1.019 32.945 31.823 0.172 0.000 0.843 158 V HN -0.527 7.490 8.190 -0.057 0.139 0.438 159 L N -1.095 120.071 121.223 -0.095 0.000 2.303 159 L HA 0.842 5.232 4.340 -0.164 -0.148 0.266 159 L C 0.025 176.925 176.870 0.050 0.000 1.011 159 L CA -1.775 52.973 54.840 -0.152 0.000 0.818 159 L CB 3.364 45.141 42.059 -0.471 0.000 1.326 159 L HN -0.690 7.477 8.230 -0.105 0.000 0.435 160 T N -4.579 110.004 114.554 0.048 0.000 2.924 160 T HA 0.336 4.749 4.350 0.106 0.000 0.291 160 T C -2.302 172.486 174.700 0.146 0.000 1.045 160 T CA -1.829 60.322 62.100 0.084 0.000 1.015 160 T CB 2.697 71.574 68.868 0.014 0.000 1.103 160 T HN 0.554 8.787 8.240 -0.013 0.000 0.496 161 D N 1.030 121.478 120.400 0.079 0.000 2.344 161 D HA 0.261 5.112 4.640 0.136 -0.130 0.239 161 D C 0.133 176.338 176.300 -0.158 0.000 1.064 161 D CA -1.947 52.071 54.000 0.030 0.000 0.829 161 D CB 2.549 43.346 40.800 -0.005 0.000 1.129 161 D HN 0.089 8.472 8.370 0.023 0.000 0.506 162 A N 4.998 127.599 122.820 -0.365 0.000 2.019 162 A HA -0.206 3.975 4.320 -0.231 0.000 0.219 162 A C 0.110 177.549 177.584 -0.241 0.000 1.164 162 A CA 1.646 53.450 52.037 -0.390 0.000 0.644 162 A CB 0.535 19.077 19.000 -0.764 0.000 0.805 162 A HN 0.420 8.265 8.150 -0.508 0.000 0.449 163 D N -4.538 115.720 120.400 -0.236 0.000 2.527 163 D HA 0.422 5.051 4.640 -0.019 0.000 0.242 163 D C -2.172 174.098 176.300 -0.049 0.000 1.285 163 D CA -1.982 51.992 54.000 -0.042 0.000 0.886 163 D CB 0.942 41.831 40.800 0.148 0.000 1.402 163 D HN -0.542 7.904 8.370 -0.327 -0.273 0.528 164 P HA -0.013 4.487 4.420 -0.093 -0.136 0.226 164 P C -0.456 176.823 177.300 -0.036 0.000 1.146 164 P CA 0.894 63.952 63.100 -0.070 0.000 0.773 164 P CB 0.402 32.054 31.700 -0.079 0.000 0.772 165 E N -4.517 115.677 120.200 -0.009 0.000 2.489 165 E HA 0.073 4.422 4.350 -0.002 0.000 0.193 165 E C -0.138 176.474 176.600 0.019 0.000 1.057 165 E CA -0.155 56.247 56.400 0.004 0.000 0.866 165 E CB 0.278 29.983 29.700 0.009 0.000 0.916 165 E HN -0.381 8.155 8.360 -0.003 -0.178 0.500 166 S N -2.550 113.169 115.700 0.031 0.000 2.570 166 S HA 0.297 4.790 4.470 0.038 0.000 0.286 166 S C -1.051 173.579 174.600 0.049 0.000 1.099 166 S CA -1.296 56.932 58.200 0.046 0.000 0.913 166 S CB 2.786 66.025 63.200 0.064 0.000 1.085 166 S HN -0.495 7.793 8.310 0.030 0.041 0.480 167 S N 0.308 116.043 115.700 0.058 0.000 2.730 167 S HA 0.178 4.689 4.470 0.068 0.000 0.244 167 S C -1.015 173.637 174.600 0.088 0.000 1.022 167 S CA -0.127 58.117 58.200 0.074 0.000 1.014 167 S CB 1.073 64.325 63.200 0.087 0.000 0.963 167 S HN 0.509 8.852 8.310 0.055 0.000 0.540 168 D N 0.825 121.269 120.400 0.072 0.000 2.304 168 D HA -0.015 4.666 4.640 0.069 0.000 0.247 168 D C -0.507 175.836 176.300 0.073 0.000 1.089 168 D CA -0.732 53.305 54.000 0.062 0.000 0.910 168 D CB 0.875 41.691 40.800 0.027 0.000 1.199 168 D HN -0.667 7.742 8.370 0.064 0.000 0.426 169 Q N -0.030 119.808 119.800 0.063 0.000 2.296 169 Q HA -0.049 4.344 4.340 0.089 0.000 0.263 169 Q C -0.376 175.622 176.000 -0.003 0.000 1.026 169 Q CA 0.739 56.573 55.803 0.052 0.000 0.912 169 Q CB 0.224 28.979 28.738 0.029 0.000 1.198 169 Q HN 0.366 8.671 8.270 0.059 0.000 0.407 170 R N 3.154 123.647 120.500 -0.011 0.000 2.734 170 R HA 0.376 4.644 4.340 -0.121 0.000 0.271 170 R C -0.940 175.263 176.300 -0.161 0.000 1.021 170 R CA -1.364 54.652 56.100 -0.140 0.000 0.893 170 R CB 1.167 31.308 30.300 -0.265 0.000 1.244 170 R HN 0.340 8.651 8.270 0.069 0.000 0.464 171 R N 2.365 122.739 120.500 -0.211 0.000 2.316 171 R HA 0.270 4.610 4.340 -0.000 0.000 0.314 171 R C -0.591 175.534 176.300 -0.291 0.000 1.069 171 R CA 0.374 56.381 56.100 -0.156 0.000 0.959 171 R CB 0.584 30.808 30.300 -0.127 0.000 0.987 171 R HN 0.433 nan 8.270 nan 0.000 0.446 172 F N 3.264 123.174 119.950 -0.068 0.000 2.582 172 F HA 0.025 4.524 4.527 -0.046 0.000 0.290 172 F C -0.053 175.731 175.800 -0.027 0.000 1.115 172 F CA 1.431 59.401 58.000 -0.051 0.000 1.445 172 F CB 1.192 40.151 39.000 -0.068 0.000 1.126 172 F HN 0.705 9.063 8.300 0.280 0.109 0.574 173 L N -2.102 119.206 121.223 0.142 0.000 2.342 173 L HA 0.398 4.792 4.340 0.090 0.000 0.271 173 L C 0.257 177.160 176.870 0.055 0.000 1.008 173 L CA -1.361 53.535 54.840 0.093 0.000 0.818 173 L CB 2.465 44.585 42.059 0.102 0.000 1.296 173 L HN -0.697 7.620 8.230 0.145 0.000 0.427 174 S N 0.044 115.779 115.700 0.059 0.000 2.368 174 S HA -0.202 4.285 4.470 0.028 0.000 0.225 174 S C 1.019 175.671 174.600 0.086 0.000 1.030 174 S CA 2.127 60.359 58.200 0.054 0.000 0.999 174 S CB -0.067 63.169 63.200 0.060 0.000 0.844 174 S HN 0.293 8.644 8.310 0.067 0.000 0.459 175 Q N 1.954 121.834 119.800 0.134 0.000 2.923 175 Q HA 0.293 4.848 4.340 0.358 0.000 0.363 175 Q C -1.329 174.830 176.000 0.265 0.000 1.159 175 Q CA -0.868 55.096 55.803 0.267 0.000 1.073 175 Q CB -1.514 27.373 28.738 0.247 0.000 1.364 175 Q HN 0.520 8.864 8.270 0.123 0.000 0.466 176 T N -5.514 109.028 114.554 -0.020 0.000 2.887 176 T HA 0.552 4.943 4.350 -0.096 -0.098 0.292 176 T C -2.230 172.030 174.700 -0.734 0.000 1.087 176 T CA -1.784 60.188 62.100 -0.212 0.000 1.009 176 T CB 3.757 72.582 68.868 -0.073 0.000 1.203 176 T HN -0.712 7.423 8.240 -0.076 0.060 0.518 177 A N -1.659 120.780 122.820 -0.634 0.000 2.485 177 A HA 0.414 4.362 4.320 -0.619 0.000 0.292 177 A C -1.864 175.547 177.584 -0.288 0.000 1.147 177 A CA -1.321 50.356 52.037 -0.600 0.000 0.750 177 A CB 2.590 21.195 19.000 -0.658 0.000 1.331 177 A HN 0.151 8.062 8.150 -0.399 0.000 0.419 178 T N -4.033 110.383 114.554 -0.230 0.000 3.416 178 T HA 0.297 4.597 4.350 -0.200 -0.070 0.245 178 T C 0.050 174.648 174.700 -0.170 0.000 1.081 178 T CA -1.118 60.874 62.100 -0.180 0.000 1.190 178 T CB -1.717 67.078 68.868 -0.121 0.000 1.068 178 T HN 0.013 8.114 8.240 -0.233 0.000 0.580 179 A N 1.483 124.203 122.820 -0.167 0.000 2.067 179 A HA -0.073 4.205 4.320 -0.070 0.000 0.217 179 A C -0.357 177.175 177.584 -0.088 0.000 1.156 179 A CA 1.096 53.078 52.037 -0.091 0.000 0.683 179 A CB 0.021 19.007 19.000 -0.023 0.000 0.808 179 A HN -0.146 7.897 8.150 -0.179 0.000 0.455 180 A N -2.293 120.375 122.820 -0.253 0.000 2.498 180 A HA -0.124 4.174 4.320 -0.036 0.000 0.239 180 A C -0.852 176.698 177.584 -0.056 0.000 1.068 180 A CA 0.372 52.271 52.037 -0.231 0.000 0.766 180 A CB 0.661 19.152 19.000 -0.847 0.000 1.003 180 A HN -0.469 7.414 8.150 -0.393 0.032 0.497 181 N N 1.600 120.363 118.700 0.104 0.000 2.732 181 N HA 0.293 5.133 4.740 0.166 0.000 0.259 181 N C -1.697 173.962 175.510 0.249 0.000 1.402 181 N CA -1.691 51.460 53.050 0.169 0.000 0.829 181 N CB -0.107 38.469 38.487 0.148 0.000 1.495 181 N HN -0.623 7.849 8.380 0.152 0.000 0.511 182 P HA -0.124 4.642 4.420 0.578 0.000 0.220 182 P C 0.617 178.069 177.300 0.252 0.000 1.148 182 P CA 1.980 65.323 63.100 0.404 0.000 0.803 182 P CB 0.147 32.061 31.700 0.357 0.000 0.782 183 V N -1.916 118.153 119.914 0.258 0.000 2.407 183 V HA -0.453 3.770 4.120 0.172 0.000 0.248 183 V C 1.961 178.065 176.094 0.016 0.000 1.055 183 V CA 3.893 66.303 62.300 0.184 0.000 1.049 183 V CB -1.101 30.878 31.823 0.260 0.000 0.662 183 V HN -0.267 8.273 8.190 0.278 -0.184 0.455 184 C N -0.363 118.960 119.300 0.038 0.000 2.391 184 C HA -0.315 4.104 4.460 -0.069 0.000 0.276 184 C C 2.147 176.947 174.990 -0.318 0.000 1.217 184 C CA 3.570 62.535 59.018 -0.090 0.000 1.766 184 C CB -2.158 25.582 27.740 -0.000 0.000 2.046 184 C HN -0.488 7.954 8.230 0.114 -0.143 0.475 185 L N -1.909 119.100 121.223 -0.356 0.000 2.265 185 L HA -0.279 3.656 4.340 -0.676 0.000 0.215 185 L C 2.343 178.962 176.870 -0.418 0.000 1.117 185 L CA 2.210 56.725 54.840 -0.541 0.000 0.782 185 L CB -1.577 40.058 42.059 -0.706 0.000 0.914 185 L HN -0.468 7.603 8.230 -0.227 0.023 0.441 186 N N -1.018 117.483 118.700 -0.332 0.000 2.364 186 N HA -0.212 4.487 4.740 -0.068 0.000 0.183 186 N C 0.288 175.691 175.510 -0.179 0.000 1.022 186 N CA 3.094 56.028 53.050 -0.194 0.000 0.883 186 N CB 0.145 38.512 38.487 -0.200 0.000 0.965 186 N HN -0.460 7.690 8.380 -0.336 0.029 0.438 187 C N -3.860 115.295 119.300 -0.243 0.000 2.780 187 C HA 0.185 4.516 4.460 -0.215 0.000 0.287 187 C C 0.327 175.141 174.990 -0.294 0.000 1.288 187 C CA -0.862 58.002 59.018 -0.256 0.000 1.713 187 C CB -1.492 26.066 27.740 -0.302 0.000 1.955 187 C HN -0.382 7.654 8.230 -0.279 0.026 0.613 188 K N -3.036 117.171 120.400 -0.322 0.000 2.474 188 K HA 0.273 4.411 4.320 -0.304 0.000 0.202 188 K C -1.031 175.397 176.600 -0.286 0.000 1.248 188 K CA -0.491 55.589 56.287 -0.345 0.000 0.946 188 K CB 2.588 34.781 32.500 -0.511 0.000 1.102 188 K HN -0.136 7.750 8.250 -0.322 0.171 0.541 189 T N -1.006 113.408 114.554 -0.232 0.000 2.830 189 T HA 0.335 4.581 4.350 -0.174 0.000 0.322 189 T C -2.450 172.216 174.700 -0.057 0.000 1.501 189 T CA -0.066 61.942 62.100 -0.153 0.000 1.036 189 T CB 2.081 70.864 68.868 -0.142 0.000 1.379 189 T HN -0.403 7.708 8.240 -0.215 0.000 0.493 190 Q N 1.078 120.826 119.800 -0.087 0.000 2.115 190 Q HA 0.456 4.587 4.340 -0.349 0.000 0.249 190 Q C 0.426 176.472 176.000 0.076 0.000 0.830 190 Q CA -0.988 54.739 55.803 -0.128 0.000 1.104 190 Q CB 1.043 29.727 28.738 -0.090 0.000 1.207 190 Q HN 0.440 9.013 8.270 -0.129 -0.380 0.464 191 D N 1.229 121.743 120.400 0.191 0.000 2.190 191 D HA -0.286 4.561 4.640 0.346 0.000 0.200 191 D C -0.166 176.308 176.300 0.290 0.000 0.992 191 D CA 3.304 57.474 54.000 0.283 0.000 0.854 191 D CB -0.272 40.667 40.800 0.232 0.000 0.936 191 D HN -0.361 8.105 8.370 0.161 0.000 0.462 192 H N -7.109 112.084 119.070 0.205 0.000 2.536 192 H HA 0.063 4.860 4.556 0.402 0.000 0.276 192 H C 0.665 176.177 175.328 0.307 0.000 1.019 192 H CA -1.143 55.107 56.048 0.337 0.000 1.159 192 H CB -1.698 28.343 29.762 0.465 0.000 1.373 192 H HN -0.228 8.275 8.280 0.421 0.030 0.584 193 I N 1.711 122.219 120.570 -0.104 0.000 2.423 193 I HA -0.375 3.690 4.170 -0.175 0.000 0.254 193 I C -0.614 175.551 176.117 0.081 0.000 1.151 193 I CA 2.981 64.236 61.300 -0.076 0.000 1.421 193 I CB 0.024 38.004 38.000 -0.034 0.000 1.079 193 I HN -0.580 7.519 8.210 -0.064 0.073 0.431 194 L N -5.646 115.674 121.223 0.161 0.000 2.607 194 L HA -0.039 4.474 4.340 0.288 0.000 0.228 194 L C -0.338 176.784 176.870 0.420 0.000 1.123 194 L CA 0.123 55.115 54.840 0.254 0.000 0.890 194 L CB -0.474 41.669 42.059 0.141 0.000 1.103 194 L HN -0.174 8.130 8.230 0.160 0.021 0.468 195 D N -2.848 117.828 120.400 0.459 0.000 2.503 195 D HA 0.267 5.168 4.640 0.435 0.000 0.218 195 D C -2.141 174.519 176.300 0.599 0.000 1.183 195 D CA 0.166 54.471 54.000 0.508 0.000 0.827 195 D CB 2.538 43.657 40.800 0.531 0.000 1.034 195 D HN -0.152 8.312 8.370 0.443 0.172 0.510 196 W N 0.036 121.491 121.300 0.259 0.000 2.715 196 W HA 0.500 5.442 4.660 0.175 -0.177 0.331 196 W C -2.829 173.533 176.519 -0.261 0.000 1.031 196 W CA -1.692 55.732 57.345 0.133 0.000 1.237 196 W CB 2.898 32.556 29.460 0.330 0.000 1.378 196 W HN -0.948 7.511 8.180 0.465 0.000 0.454 197 A N 5.970 128.473 122.820 -0.528 0.000 2.332 197 A HA 0.031 3.776 4.320 -1.177 -0.131 0.258 197 A C -0.846 176.451 177.584 -0.479 0.000 1.087 197 A CA -0.902 50.722 52.037 -0.689 0.000 0.802 197 A CB 1.854 20.675 19.000 -0.298 0.000 1.042 197 A HN 0.445 8.336 8.150 -0.433 0.000 0.489 198 Y N 3.039 123.116 120.300 -0.372 0.000 2.881 198 Y HA -0.436 4.069 4.550 -0.074 0.000 0.335 198 Y C 0.267 176.068 175.900 -0.166 0.000 1.263 198 Y CA 2.745 60.745 58.100 -0.165 0.000 1.572 198 Y CB 0.460 38.858 38.460 -0.105 0.000 1.237 198 Y HN -0.015 8.175 8.280 -0.151 0.000 0.568 199 M N 3.819 123.155 119.600 -0.440 0.000 2.931 199 M HA -0.493 3.915 4.480 -0.269 -0.089 0.190 199 M C 0.717 176.858 176.300 -0.266 0.000 0.626 199 M CA 0.704 55.797 55.300 -0.345 0.000 0.722 199 M CB -2.233 30.123 32.600 -0.406 0.000 2.597 199 M HN 0.360 8.613 8.290 -0.371 -0.186 0.299 200 G N -2.763 105.586 108.800 -0.751 0.000 2.143 200 G HA2 -0.517 2.014 3.960 -2.381 0.000 0.248 200 G HA3 -0.517 2.693 3.960 -1.251 0.000 0.248 200 G C -0.987 173.523 174.900 -0.651 0.000 0.991 200 G CA 0.212 44.492 45.100 -1.367 0.000 0.689 200 G HN 0.503 8.096 8.290 -0.878 0.171 0.522 201 D N 0.687 120.852 120.400 -0.392 0.000 2.400 201 D HA -0.028 4.518 4.640 -0.157 0.000 0.238 201 D C -0.360 175.850 176.300 -0.150 0.000 1.157 201 D CA 0.631 54.518 54.000 -0.188 0.000 0.889 201 D CB 0.580 41.333 40.800 -0.078 0.000 1.199 201 D HN -0.876 7.233 8.370 -0.372 0.037 0.436 202 E N 1.232 121.386 120.200 -0.077 0.000 2.414 202 E HA -0.119 4.208 4.350 -0.037 0.000 0.263 202 E C -0.989 175.647 176.600 0.060 0.000 1.000 202 E CA 1.531 57.916 56.400 -0.026 0.000 0.914 202 E CB 0.234 29.919 29.700 -0.026 0.000 0.948 202 E HN 0.210 8.528 8.360 -0.071 0.000 0.444 203 H N 4.699 123.759 119.070 -0.016 0.000 3.086 203 H HA 0.062 4.638 4.556 0.034 0.000 0.353 203 H C 0.477 175.822 175.328 0.028 0.000 1.134 203 H CA -0.512 55.561 56.048 0.042 0.000 1.248 203 H CB 2.336 32.185 29.762 0.146 0.000 1.878 203 H HN -0.274 8.077 8.280 0.117 0.000 0.527 204 E N 6.111 126.366 120.200 0.092 0.000 2.209 204 E HA -0.278 4.092 4.350 0.034 0.000 0.196 204 E C -0.473 176.205 176.600 0.130 0.000 0.993 204 E CA 1.877 58.324 56.400 0.077 0.000 0.819 204 E CB -0.710 28.981 29.700 -0.015 0.000 0.745 204 E HN 0.461 8.733 8.360 -0.145 0.000 0.477 205 A N -1.758 121.251 122.820 0.315 0.000 2.275 205 A HA 0.079 4.340 4.320 -0.099 0.000 0.212 205 A C -0.595 176.946 177.584 -0.070 0.000 1.201 205 A CA -0.056 51.937 52.037 -0.074 0.000 0.843 205 A CB 0.525 19.226 19.000 -0.499 0.000 0.873 205 A HN -0.427 8.222 8.150 0.872 0.025 0.492 206 A N -1.612 121.313 122.820 0.175 0.000 2.289 206 A HA 0.108 4.624 4.320 0.327 0.000 0.298 206 A C -0.496 177.095 177.584 0.012 0.000 1.208 206 A CA -0.708 51.460 52.037 0.218 0.000 0.845 206 A CB 0.457 19.593 19.000 0.227 0.000 1.125 206 A HN -0.682 7.452 8.150 0.243 0.161 0.517 207 K N 5.049 125.393 120.400 -0.094 0.000 2.097 207 K HA -0.114 3.954 4.320 -0.419 0.000 0.205 207 K C 0.140 176.364 176.600 -0.627 0.000 1.050 207 K CA 1.879 57.882 56.287 -0.473 0.000 0.938 207 K CB 0.592 32.689 32.500 -0.672 0.000 0.718 207 K HN 0.355 8.603 8.250 -0.003 0.000 0.442 208 W N -4.872 116.467 121.300 0.065 0.000 2.864 208 W HA 0.220 4.810 4.660 -0.116 0.000 0.343 208 W C -1.479 174.981 176.519 -0.098 0.000 1.109 208 W CA -2.221 55.080 57.345 -0.072 0.000 1.192 208 W CB 2.490 31.766 29.460 -0.306 0.000 1.426 208 W HN -0.605 7.649 8.180 0.123 0.000 0.529 209 S N -0.990 114.758 115.700 0.081 0.000 2.752 209 S HA 0.472 4.450 4.470 -0.821 0.000 0.284 209 S C 0.646 175.192 174.600 -0.090 0.000 1.189 209 S CA -0.372 57.650 58.200 -0.296 0.000 0.835 209 S CB 2.758 65.838 63.200 -0.201 0.000 1.192 209 S HN 0.485 8.893 8.310 0.164 0.000 0.506 210 R N 0.155 120.551 120.500 -0.173 0.000 2.159 210 R HA -0.210 4.285 4.340 0.258 0.000 0.237 210 R C 0.889 177.249 176.300 0.099 0.000 1.131 210 R CA 3.089 59.238 56.100 0.082 0.000 0.982 210 R CB 0.265 30.590 30.300 0.041 0.000 0.868 210 R HN 0.191 8.259 8.270 -0.337 0.000 0.453 211 T N -7.813 106.773 114.554 0.052 0.000 3.122 211 T HA 0.188 4.583 4.350 0.076 0.000 0.250 211 T C 0.632 175.394 174.700 0.103 0.000 1.067 211 T CA -0.922 61.219 62.100 0.068 0.000 0.966 211 T CB -0.029 68.860 68.868 0.035 0.000 1.002 211 T HN -0.668 7.547 8.240 0.013 0.032 0.542 212 S N 2.456 118.242 115.700 0.143 0.000 2.589 212 S HA -0.038 4.556 4.470 0.208 0.000 0.265 212 S C 0.301 175.030 174.600 0.215 0.000 1.342 212 S CA 0.019 58.349 58.200 0.217 0.000 1.005 212 S CB 0.395 63.800 63.200 0.341 0.000 0.909 212 S HN -0.478 7.862 8.310 0.138 0.052 0.555 213 E N 1.687 122.037 120.200 0.249 0.000 2.220 213 E HA -0.010 4.451 4.350 0.185 0.000 0.272 213 E C 0.484 177.239 176.600 0.259 0.000 1.099 213 E CA -0.593 55.941 56.400 0.223 0.000 0.907 213 E CB -0.327 29.498 29.700 0.209 0.000 1.022 213 E HN 0.319 8.848 8.360 0.282 0.000 0.428 214 V N 6.619 126.690 119.914 0.262 0.000 2.490 214 V HA -0.286 4.068 4.120 0.391 0.000 0.250 214 V C 0.439 176.761 176.094 0.380 0.000 1.061 214 V CA 2.895 65.408 62.300 0.355 0.000 1.064 214 V CB 0.024 32.057 31.823 0.350 0.000 0.670 214 V HN 0.757 9.084 8.190 0.228 0.000 0.461 215 V N -0.263 119.845 119.914 0.324 0.000 2.427 215 V HA -0.445 3.887 4.120 0.354 0.000 0.248 215 V C 2.026 178.208 176.094 0.147 0.000 1.051 215 V CA 4.264 66.726 62.300 0.270 0.000 1.048 215 V CB -0.960 30.972 31.823 0.182 0.000 0.666 215 V HN 0.400 8.744 8.190 0.281 0.014 0.456 216 E N -0.719 119.578 120.200 0.161 0.000 2.072 216 E HA -0.366 4.054 4.350 0.117 0.000 0.191 216 E C 2.104 178.703 176.600 -0.003 0.000 0.985 216 E CA 2.631 59.131 56.400 0.167 0.000 0.801 216 E CB -0.355 29.553 29.700 0.346 0.000 0.750 216 E HN -0.659 7.820 8.360 0.199 0.000 0.452 217 F N 0.197 119.843 119.950 -0.506 0.000 2.102 217 F HA -0.345 2.779 4.527 -2.338 0.000 0.298 217 F C 1.765 177.257 175.800 -0.514 0.000 1.105 217 F CA 1.535 58.828 58.000 -1.179 0.000 1.239 217 F CB -0.315 38.159 39.000 -0.877 0.000 0.991 217 F HN -0.530 7.779 8.300 0.016 0.000 0.474 218 A N -0.203 122.508 122.820 -0.181 0.000 1.903 218 A HA -0.437 3.863 4.320 -0.034 0.000 0.219 218 A C 2.168 179.648 177.584 -0.173 0.000 1.191 218 A CA 3.214 55.167 52.037 -0.140 0.000 0.638 218 A CB -0.776 18.112 19.000 -0.186 0.000 0.823 218 A HN 0.378 8.529 8.150 0.002 0.000 0.451 219 R N -4.013 116.292 120.500 -0.324 0.000 2.241 219 R HA -0.217 3.451 4.340 -1.120 0.000 0.224 219 R C 1.098 177.239 176.300 -0.266 0.000 1.101 219 R CA 2.245 57.999 56.100 -0.576 0.000 0.995 219 R CB -0.140 29.862 30.300 -0.498 0.000 0.870 219 R HN -0.679 7.435 8.270 -0.259 0.000 0.463 220 D N -2.771 117.593 120.400 -0.058 0.000 2.339 220 D HA -0.004 4.700 4.640 0.107 0.000 0.217 220 D C -0.819 175.540 176.300 0.099 0.000 1.050 220 D CA 0.323 54.383 54.000 0.101 0.000 0.856 220 D CB 0.805 41.806 40.800 0.335 0.000 0.922 220 D HN -0.497 7.663 8.370 -0.104 0.148 0.518 221 L N -2.785 118.489 121.223 0.085 0.000 2.346 221 L HA 0.154 4.500 4.340 0.010 0.000 0.274 221 L C -1.716 175.197 176.870 0.070 0.000 1.007 221 L CA -0.903 53.955 54.840 0.030 0.000 0.818 221 L CB 2.025 44.002 42.059 -0.137 0.000 1.284 221 L HN -0.704 7.551 8.230 0.141 0.060 0.424 222 N N -0.833 117.766 118.700 -0.169 0.000 2.509 222 N HA 0.218 4.789 4.740 -0.281 0.000 0.254 222 N C -0.738 174.505 175.510 -0.446 0.000 1.064 222 N CA 0.765 53.577 53.050 -0.396 0.000 0.865 222 N CB 4.084 42.175 38.487 -0.660 0.000 1.659 222 N HN 0.636 9.246 8.380 -0.196 -0.348 0.495 223 H N -0.426 118.615 119.070 -0.048 0.000 2.457 223 H HA 0.510 5.031 4.556 -0.058 0.000 0.335 223 H C -2.576 172.679 175.328 -0.122 0.000 1.115 223 H CA -2.205 53.804 56.048 -0.065 0.000 1.219 223 H CB 1.403 31.146 29.762 -0.032 0.000 1.471 223 H HN -0.244 8.155 8.280 -0.295 -0.296 0.491 224 P HA 0.173 4.737 4.420 -0.130 -0.222 0.281 224 P C -0.465 176.772 177.300 -0.106 0.000 1.249 224 P CA -1.004 62.058 63.100 -0.064 0.000 0.810 224 P CB 1.356 33.051 31.700 -0.008 0.000 1.008 225 L N -0.519 120.585 121.223 -0.198 0.000 3.995 225 L HA -0.413 3.725 4.340 -0.337 0.000 0.513 225 L C -1.739 174.846 176.870 -0.475 0.000 1.147 225 L CA 0.588 55.232 54.840 -0.326 0.000 0.703 225 L CB -1.354 40.521 42.059 -0.308 0.000 1.306 225 L HN -0.191 7.917 8.230 -0.203 0.000 0.779 226 N N -1.402 116.987 118.700 -0.520 0.000 2.441 226 N HA -0.147 4.261 4.740 -0.552 0.000 0.251 226 N C 1.691 176.762 175.510 -0.733 0.000 1.242 226 N CA 0.669 53.280 53.050 -0.732 0.000 0.898 226 N CB 0.964 38.647 38.487 -1.339 0.000 1.100 226 N HN -0.423 7.668 8.380 -0.481 0.000 0.443 227 C N -0.066 118.912 119.300 -0.536 0.000 2.411 227 C HA -0.221 4.058 4.460 -0.302 0.000 0.279 227 C C 1.618 176.514 174.990 -0.157 0.000 1.288 227 C CA 2.845 61.696 59.018 -0.278 0.000 1.764 227 C CB -0.947 26.745 27.740 -0.080 0.000 1.974 227 C HN 0.864 8.821 8.230 -0.453 0.000 0.498 228 F N -3.199 116.715 119.950 -0.060 0.000 2.771 228 F HA 0.282 5.004 4.527 0.007 -0.191 0.299 228 F C 1.024 176.775 175.800 -0.081 0.000 1.177 228 F CA -1.230 56.744 58.000 -0.043 0.000 1.450 228 F CB -2.216 36.749 39.000 -0.059 0.000 1.114 228 F HN -0.438 7.508 8.300 -0.561 0.018 0.587 229 M N 0.952 120.397 119.600 -0.257 0.000 2.296 229 M HA -0.382 4.065 4.480 -0.056 0.000 0.265 229 M C 0.050 176.271 176.300 -0.131 0.000 1.064 229 M CA 4.174 59.374 55.300 -0.167 0.000 1.109 229 M CB -0.072 32.366 32.600 -0.270 0.000 1.396 229 M HN -0.173 7.678 8.290 -0.467 0.159 0.430 230 C N -6.603 112.563 119.300 -0.224 0.000 3.392 230 C HA 0.506 5.044 4.460 -0.208 -0.203 0.301 230 C C -1.007 173.768 174.990 -0.358 0.000 1.354 230 C CA -1.356 57.460 59.018 -0.337 0.000 1.732 230 C CB 1.171 28.591 27.740 -0.532 0.000 2.269 230 C HN -0.792 7.262 8.230 -0.257 0.022 0.673 231 H N -0.695 118.386 119.070 0.018 0.000 2.744 231 H HA 0.528 5.247 4.556 0.000 -0.162 0.339 231 H C -1.775 173.576 175.328 0.039 0.000 1.004 231 H CA -1.848 54.206 56.048 0.011 0.000 1.257 231 H CB 1.897 31.650 29.762 -0.015 0.000 1.552 231 H HN -0.604 7.678 8.280 0.003 0.000 0.522 232 D N 3.938 124.421 120.400 0.139 0.000 2.417 232 D HA 0.082 4.779 4.640 0.095 0.000 0.250 232 D C -0.064 176.260 176.300 0.041 0.000 1.166 232 D CA -1.302 52.754 54.000 0.094 0.000 0.881 232 D CB 2.193 43.061 40.800 0.113 0.000 1.164 232 D HN 0.141 8.587 8.370 0.127 0.000 0.467 233 P HA -0.139 4.347 4.420 0.110 0.000 0.223 233 P C 0.937 178.236 177.300 -0.002 0.000 1.151 233 P CA 1.684 64.730 63.100 -0.090 0.000 0.787 233 P CB 0.386 31.882 31.700 -0.339 0.000 0.788 234 H N -1.428 117.794 119.070 0.255 0.000 2.370 234 H HA 0.069 4.900 4.556 0.460 0.000 0.304 234 H C 2.424 177.889 175.328 0.230 0.000 1.055 234 H CA 3.376 59.619 56.048 0.326 0.000 1.373 234 H CB 0.866 30.792 29.762 0.273 0.000 1.423 234 H HN 0.018 8.425 8.280 -0.150 -0.218 0.533 235 S N -2.581 113.241 115.700 0.203 0.000 2.503 235 S HA 0.260 4.890 4.470 0.067 -0.120 0.217 235 S C 0.292 174.835 174.600 -0.095 0.000 0.999 235 S CA 0.474 58.714 58.200 0.067 0.000 0.914 235 S CB 0.860 64.106 63.200 0.076 0.000 0.782 235 S HN -0.225 8.499 8.310 0.196 -0.296 0.520 236 A N 1.136 123.835 122.820 -0.202 0.000 3.153 236 A HA -0.371 3.831 4.320 -0.385 -0.112 0.265 236 A C -0.315 177.182 177.584 -0.144 0.000 1.212 236 A CA 1.023 52.823 52.037 -0.394 0.000 1.018 236 A CB -1.713 16.788 19.000 -0.832 0.000 1.130 236 A HN 0.102 8.186 8.150 -0.110 0.000 0.873 237 G N -2.045 106.737 108.800 -0.031 0.000 2.562 237 G HA2 0.290 4.260 3.960 0.017 0.000 0.275 237 G HA3 0.290 4.270 3.960 0.033 0.000 0.275 237 G C -2.936 172.019 174.900 0.092 0.000 1.196 237 G CA -2.299 42.819 45.100 0.029 0.000 0.908 237 G HN -0.471 7.751 8.290 -0.013 0.061 0.524 238 P HA 0.441 5.101 4.420 0.125 -0.165 0.275 238 P C -1.174 176.165 177.300 0.066 0.000 1.227 238 P CA -0.550 62.609 63.100 0.097 0.000 0.781 238 P CB 0.876 32.628 31.700 0.087 0.000 0.906 239 R N -2.594 117.928 120.500 0.037 0.000 2.747 239 R HA 0.714 5.206 4.340 0.047 -0.123 0.272 239 R C -2.101 174.205 176.300 0.009 0.000 1.032 239 R CA -1.427 54.697 56.100 0.039 0.000 0.896 239 R CB 3.727 34.067 30.300 0.067 0.000 1.253 239 R HN 0.059 8.235 8.270 0.003 0.096 0.461 240 V N -6.897 113.029 119.914 0.020 0.000 2.960 240 V HA 0.871 5.210 4.120 -0.014 -0.228 0.315 240 V C -0.447 175.662 176.094 0.024 0.000 1.087 240 V CA -2.956 59.346 62.300 0.003 0.000 0.982 240 V CB 3.657 35.475 31.823 -0.008 0.000 1.039 240 V HN 0.249 8.458 8.190 0.031 0.000 0.437 241 V N -4.689 115.233 119.914 0.014 0.000 3.604 241 V HA 0.530 4.688 4.120 0.063 0.000 0.277 241 V C -0.072 176.027 176.094 0.010 0.000 1.399 241 V CA -0.754 61.568 62.300 0.037 0.000 1.034 241 V CB 1.072 32.932 31.823 0.062 0.000 0.824 241 V HN 0.350 8.876 8.190 -0.007 -0.340 0.439 242 R N 3.196 123.671 120.500 -0.041 0.000 2.351 242 R HA -0.060 4.232 4.340 -0.081 0.000 0.318 242 R C 0.719 176.922 176.300 -0.163 0.000 1.055 242 R CA -0.816 55.225 56.100 -0.099 0.000 0.968 242 R CB 0.032 30.270 30.300 -0.103 0.000 0.974 242 R HN -0.744 7.692 8.270 -0.044 -0.192 0.439 243 D N 7.905 128.228 120.400 -0.128 0.000 2.104 243 D HA -0.263 4.380 4.640 0.004 0.000 0.194 243 D C 1.755 177.781 176.300 -0.457 0.000 0.994 243 D CA 3.426 57.303 54.000 -0.205 0.000 0.830 243 D CB -0.906 39.742 40.800 -0.252 0.000 0.959 243 D HN 0.233 8.562 8.370 -0.069 0.000 0.452 244 G N -1.102 107.290 108.800 -0.681 0.000 2.432 244 G HA2 -0.249 3.287 3.960 -0.707 0.000 0.219 244 G HA3 -0.249 2.822 3.960 -1.482 0.000 0.219 244 G C 1.191 175.340 174.900 -1.252 0.000 1.135 244 G CA 1.609 46.068 45.100 -1.068 0.000 0.767 244 G HN 0.235 8.157 8.290 -0.614 0.000 0.550 245 L N 2.052 122.581 121.223 -1.158 0.000 2.072 245 L HA -0.158 3.784 4.340 -0.663 0.000 0.205 245 L C 1.427 178.036 176.870 -0.435 0.000 1.079 245 L CA 2.272 56.708 54.840 -0.673 0.000 0.752 245 L CB 0.011 41.869 42.059 -0.335 0.000 0.906 245 L HN -0.836 6.761 8.230 -1.031 0.015 0.436 246 I N -0.435 119.978 120.570 -0.262 0.000 2.264 246 I HA -0.549 3.559 4.170 -0.104 0.000 0.248 246 I C 2.197 178.278 176.117 -0.061 0.000 1.111 246 I CA 4.388 65.634 61.300 -0.090 0.000 1.382 246 I CB -0.582 37.462 38.000 0.073 0.000 1.060 246 I HN -0.487 7.572 8.210 -0.251 0.000 0.418 247 N N -0.092 118.551 118.700 -0.095 0.000 2.120 247 N HA -0.413 4.550 4.740 0.074 -0.179 0.188 247 N C 1.627 177.070 175.510 -0.111 0.000 1.024 247 N CA 3.787 56.801 53.050 -0.060 0.000 0.852 247 N CB 0.402 38.784 38.487 -0.174 0.000 1.003 247 N HN -0.101 8.168 8.380 -0.185 0.000 0.424 248 A N 0.197 122.876 122.820 -0.235 0.000 1.873 248 A HA -0.287 3.980 4.320 -0.089 0.000 0.215 248 A C 1.926 179.406 177.584 -0.173 0.000 1.186 248 A CA 3.301 55.211 52.037 -0.211 0.000 0.616 248 A CB -0.233 18.549 19.000 -0.362 0.000 0.823 248 A HN -0.550 7.400 8.150 -0.333 0.000 0.442 249 V N -2.304 117.442 119.914 -0.280 0.000 2.323 249 V HA -0.311 3.789 4.120 -0.034 0.000 0.244 249 V C 2.354 178.441 176.094 -0.011 0.000 1.041 249 V CA 4.418 66.644 62.300 -0.124 0.000 1.025 249 V CB -0.477 31.255 31.823 -0.151 0.000 0.656 249 V HN -0.340 7.637 8.190 -0.356 0.000 0.451 250 V N -0.984 118.914 119.914 -0.027 0.000 2.602 250 V HA -0.293 3.837 4.120 0.015 0.000 0.235 250 V C 2.605 178.708 176.094 0.016 0.000 1.087 250 V CA 3.721 66.023 62.300 0.003 0.000 1.117 250 V CB -0.031 31.788 31.823 -0.007 0.000 0.820 250 V HN 0.112 8.270 8.190 -0.054 0.000 0.490 251 D N 1.513 121.928 120.400 0.024 0.000 2.123 251 D HA -0.175 4.485 4.640 0.034 0.000 0.196 251 D C 1.976 178.301 176.300 0.042 0.000 0.992 251 D CA 3.074 57.099 54.000 0.042 0.000 0.833 251 D CB -0.280 40.567 40.800 0.079 0.000 0.954 251 D HN -0.521 7.864 8.370 0.025 0.000 0.455 252 R N -4.139 116.387 120.500 0.043 0.000 2.310 252 R HA 0.089 4.467 4.340 0.063 0.000 0.202 252 R C 0.344 176.686 176.300 0.070 0.000 0.933 252 R CA -0.142 55.995 56.100 0.063 0.000 1.054 252 R CB 0.340 30.687 30.300 0.079 0.000 0.985 252 R HN -0.462 7.827 8.270 0.031 0.000 0.489 253 G N -1.641 107.194 108.800 0.059 0.000 2.179 253 G HA2 -0.313 3.679 3.960 0.053 0.000 0.257 253 G HA3 -0.313 3.680 3.960 0.055 0.000 0.257 253 G C 0.335 175.285 174.900 0.083 0.000 1.010 253 G CA 0.933 46.070 45.100 0.061 0.000 0.736 253 G HN -0.458 7.691 8.290 0.048 0.169 0.513 254 L N -1.197 120.101 121.223 0.124 0.000 2.313 254 L HA -0.167 4.248 4.340 0.125 0.000 0.214 254 L C -0.065 176.914 176.870 0.182 0.000 1.119 254 L CA 0.464 55.411 54.840 0.179 0.000 0.809 254 L CB 0.171 42.438 42.059 0.345 0.000 0.933 254 L HN -0.786 7.496 8.230 0.120 0.021 0.449 255 G N -5.054 103.857 108.800 0.184 0.000 2.758 255 G HA2 -0.371 3.680 3.960 0.152 0.000 0.686 255 G HA3 -0.371 3.679 3.960 0.150 0.000 0.686 255 G C 0.012 175.105 174.900 0.322 0.000 1.389 255 G CA -0.471 44.742 45.100 0.188 0.000 0.845 255 G HN -0.603 7.778 8.290 0.151 0.000 0.572 256 T N -3.475 111.244 114.554 0.274 0.000 2.951 256 T HA -0.257 4.341 4.350 0.413 0.000 0.268 256 T C -0.183 174.519 174.700 0.003 0.000 1.073 256 T CA 2.086 64.357 62.100 0.285 0.000 1.134 256 T CB 0.256 69.274 68.868 0.250 0.000 0.884 256 T HN 0.416 8.800 8.240 0.241 0.000 0.479 257 Y N 0.237 120.577 120.300 0.066 0.000 2.749 257 Y HA 0.413 4.668 4.550 -0.492 0.000 0.343 257 Y C -2.080 173.584 175.900 -0.395 0.000 1.015 257 Y CA -3.010 54.935 58.100 -0.258 0.000 1.270 257 Y CB 0.205 38.589 38.460 -0.127 0.000 1.097 257 Y HN -0.537 7.905 8.280 0.271 0.000 0.571 258 P HA -0.028 4.396 4.420 -0.283 -0.174 0.221 258 P C -0.482 176.465 177.300 -0.587 0.000 1.145 258 P CA 1.144 63.919 63.100 -0.542 0.000 0.795 258 P CB 0.420 31.665 31.700 -0.757 0.000 0.775 259 H N -5.569 113.296 119.070 -0.342 0.000 2.529 259 H HA 0.182 4.670 4.556 -0.113 0.000 0.277 259 H C -0.856 174.417 175.328 -0.092 0.000 1.004 259 H CA 0.009 55.958 56.048 -0.167 0.000 1.167 259 H CB 0.083 29.759 29.762 -0.144 0.000 1.445 259 H HN -0.264 7.718 8.280 -0.441 0.033 0.554 260 D N 0.002 120.395 120.400 -0.012 0.000 2.328 260 D HA 0.421 5.062 4.640 0.001 0.000 0.243 260 D C -2.115 174.189 176.300 0.005 0.000 1.324 260 D CA -2.491 51.509 54.000 -0.000 0.000 0.966 260 D CB 1.336 42.121 40.800 -0.024 0.000 1.324 260 D HN -0.297 7.888 8.370 -0.046 0.158 0.549 261 P HA -0.115 4.318 4.420 0.023 0.000 0.218 261 P C 0.807 178.116 177.300 0.015 0.000 1.149 261 P CA 1.799 64.906 63.100 0.012 0.000 0.817 261 P CB 0.565 32.268 31.700 0.006 0.000 0.785 262 V N -1.590 118.323 119.914 -0.003 0.000 2.307 262 V HA -0.372 3.748 4.120 0.000 0.000 0.245 262 V C 1.914 177.996 176.094 -0.020 0.000 1.045 262 V CA 4.617 66.911 62.300 -0.009 0.000 1.024 262 V CB -0.594 31.218 31.823 -0.019 0.000 0.651 262 V HN -0.361 7.928 8.190 -0.009 -0.104 0.449 263 K N -0.555 119.808 120.400 -0.062 0.000 2.097 263 K HA -0.353 3.891 4.320 -0.127 0.000 0.206 263 K C 2.349 178.941 176.600 -0.013 0.000 1.049 263 K CA 3.479 59.682 56.287 -0.139 0.000 0.933 263 K CB -0.239 32.042 32.500 -0.366 0.000 0.717 263 K HN -0.340 8.165 8.250 -0.069 -0.296 0.442 264 S N -0.259 115.500 115.700 0.099 0.000 2.383 264 S HA -0.186 4.489 4.470 0.342 0.000 0.229 264 S C 1.577 176.256 174.600 0.132 0.000 1.030 264 S CA 3.313 61.634 58.200 0.201 0.000 1.002 264 S CB -0.619 62.675 63.200 0.157 0.000 0.829 264 S HN -0.165 8.188 8.310 0.072 0.000 0.467 265 E N 0.013 120.257 120.200 0.074 0.000 2.112 265 E HA -0.244 4.144 4.350 0.063 0.000 0.190 265 E C 2.487 179.120 176.600 0.054 0.000 0.979 265 E CA 2.531 58.966 56.400 0.057 0.000 0.814 265 E CB -0.124 29.598 29.700 0.035 0.000 0.762 265 E HN -0.610 7.690 8.360 0.055 0.093 0.460 266 Q N -1.808 118.017 119.800 0.041 0.000 2.172 266 Q HA -0.172 4.188 4.340 0.033 0.000 0.200 266 Q C 1.588 177.624 176.000 0.061 0.000 0.964 266 Q CA 1.888 57.712 55.803 0.035 0.000 0.855 266 Q CB 0.781 29.524 28.738 0.008 0.000 0.918 266 Q HN -0.582 7.705 8.270 0.030 0.000 0.444 267 Q N -2.166 117.692 119.800 0.098 0.000 2.831 267 Q HA 0.221 4.641 4.340 0.133 0.000 0.366 267 Q C -0.692 175.434 176.000 0.209 0.000 0.899 267 Q CA -1.244 54.655 55.803 0.161 0.000 0.987 267 Q CB 0.827 29.690 28.738 0.208 0.000 1.382 267 Q HN -0.451 7.880 8.270 0.102 0.000 0.403 268 G N -0.790 108.095 108.800 0.143 0.000 2.568 268 G HA2 0.283 4.377 3.960 0.160 0.000 0.293 268 G HA3 0.283 4.307 3.960 0.106 0.000 0.293 268 G C -2.751 172.212 174.900 0.105 0.000 1.347 268 G CA -1.858 43.320 45.100 0.131 0.000 1.039 268 G HN 0.002 8.663 8.290 0.113 -0.303 0.523 269 M N -1.112 118.537 119.600 0.081 0.000 2.393 269 M HA 0.772 5.485 4.480 0.059 -0.197 0.299 269 M C -1.104 175.217 176.300 0.035 0.000 1.103 269 M CA -0.680 54.654 55.300 0.057 0.000 0.910 269 M CB 4.137 36.764 32.600 0.046 0.000 1.659 269 M HN 0.137 8.474 8.290 0.078 0.000 0.445 270 T N 7.495 122.065 114.554 0.026 0.000 2.772 270 T HA 0.390 4.742 4.350 0.004 0.000 0.288 270 T C -1.534 173.161 174.700 -0.007 0.000 0.994 270 T CA -0.575 61.529 62.100 0.008 0.000 0.951 270 T CB 0.964 69.837 68.868 0.009 0.000 0.933 270 T HN 0.562 8.821 8.240 0.032 0.000 0.447 271 K N 7.657 128.040 120.400 -0.029 0.000 2.339 271 K HA 0.238 4.727 4.320 -0.042 -0.194 0.286 271 K C -0.757 175.791 176.600 -0.086 0.000 1.050 271 K CA 0.174 56.426 56.287 -0.058 0.000 0.956 271 K CB 0.794 33.242 32.500 -0.087 0.000 0.990 271 K HN 0.281 8.514 8.250 -0.029 0.000 0.475 272 V N 8.796 128.654 119.914 -0.093 0.000 2.448 272 V HA 0.261 4.260 4.120 -0.202 0.000 0.295 272 V C -1.275 174.666 176.094 -0.254 0.000 1.025 272 V CA -0.701 61.491 62.300 -0.181 0.000 0.859 272 V CB 2.603 34.341 31.823 -0.142 0.000 0.988 272 V HN 0.372 8.528 8.190 -0.056 0.000 0.431 273 T N 7.671 122.014 114.554 -0.352 0.000 2.823 273 T HA 0.776 5.193 4.350 -0.165 -0.166 0.279 273 T C -0.816 173.617 174.700 -0.447 0.000 0.998 273 T CA -0.895 61.037 62.100 -0.279 0.000 0.994 273 T CB 1.225 69.979 68.868 -0.189 0.000 0.960 273 T HN 0.114 8.146 8.240 -0.347 0.000 0.448 274 F N 4.839 124.807 119.950 0.030 0.000 2.522 274 F HA 0.379 4.948 4.527 0.070 0.000 0.324 274 F C -1.319 174.563 175.800 0.137 0.000 1.077 274 F CA -1.198 56.853 58.000 0.084 0.000 0.944 274 F CB 3.838 42.904 39.000 0.111 0.000 1.175 274 F HN 0.321 8.758 8.300 0.228 0.000 0.468 275 Q N 0.930 120.904 119.800 0.289 0.000 2.297 275 Q HA 0.727 5.360 4.340 0.255 -0.140 0.268 275 Q C -0.519 175.575 176.000 0.157 0.000 1.045 275 Q CA -1.027 54.906 55.803 0.216 0.000 0.861 275 Q CB 3.480 32.294 28.738 0.127 0.000 1.344 275 Q HN 0.322 8.760 8.270 0.281 0.000 0.452 276 R N -0.793 119.763 120.500 0.094 0.000 2.532 276 R HA 0.257 4.571 4.340 -0.042 0.000 0.297 276 R C 0.115 176.436 176.300 0.036 0.000 0.984 276 R CA -1.434 54.644 56.100 -0.037 0.000 0.884 276 R CB 1.420 31.531 30.300 -0.316 0.000 1.182 276 R HN 0.323 8.691 8.270 0.163 0.000 0.442 277 G N 3.673 112.478 108.800 0.010 0.000 2.283 277 G HA2 -0.344 3.618 3.960 0.004 0.000 0.280 277 G HA3 -0.344 3.622 3.960 0.011 0.000 0.280 277 G C -0.866 174.050 174.900 0.027 0.000 1.029 277 G CA 0.876 45.984 45.100 0.014 0.000 0.840 277 G HN 0.362 8.650 8.290 -0.005 0.000 0.505 278 R N -5.943 114.580 120.500 0.039 0.000 3.758 278 R HA -0.537 3.988 4.340 0.044 -0.159 0.299 278 R C -1.148 175.183 176.300 0.052 0.000 1.182 278 R CA 0.715 56.838 56.100 0.039 0.000 0.809 278 R CB -1.406 28.904 30.300 0.018 0.000 1.249 278 R HN 0.240 8.520 8.270 0.041 0.015 0.497 279 E N -1.086 119.169 120.200 0.092 0.000 2.238 279 E HA 0.216 4.615 4.350 0.082 0.000 0.267 279 E C -1.381 175.349 176.600 0.216 0.000 0.887 279 E CA -2.185 54.288 56.400 0.122 0.000 0.769 279 E CB 2.628 32.386 29.700 0.097 0.000 1.187 279 E HN -0.551 7.726 8.360 0.110 0.149 0.416 280 D N 2.389 122.897 120.400 0.180 0.000 2.525 280 D HA -0.196 4.539 4.640 0.158 0.000 0.235 280 D C -1.046 175.468 176.300 0.357 0.000 1.137 280 D CA 1.926 56.040 54.000 0.190 0.000 0.868 280 D CB -0.091 40.762 40.800 0.088 0.000 1.180 280 D HN 0.368 8.813 8.370 0.125 0.000 0.465 281 F N 5.150 125.146 119.950 0.076 0.000 2.347 281 F HA 0.206 4.596 4.527 -0.228 0.000 0.266 281 F C -2.100 173.696 175.800 -0.006 0.000 0.884 281 F CA 0.188 58.136 58.000 -0.088 0.000 1.123 281 F CB 3.516 42.414 39.000 -0.170 0.000 1.098 281 F HN 0.326 8.794 8.300 0.280 0.000 0.803 282 R N -3.907 116.533 120.500 -0.100 0.000 2.855 282 R HA 0.371 4.616 4.340 -0.158 0.000 0.266 282 R C -2.922 173.416 176.300 0.063 0.000 1.034 282 R CA -1.661 54.359 56.100 -0.133 0.000 0.944 282 R CB 3.241 33.412 30.300 -0.214 0.000 1.219 282 R HN -0.561 7.805 8.270 0.161 0.000 0.474 283 A N -0.999 121.868 122.820 0.078 0.000 2.587 283 A HA 1.108 5.667 4.320 0.091 -0.184 0.293 283 A C -2.066 175.599 177.584 0.135 0.000 1.087 283 A CA -1.339 50.720 52.037 0.036 0.000 0.692 283 A CB 3.397 22.214 19.000 -0.305 0.000 1.291 283 A HN 0.237 8.465 8.150 0.129 0.000 0.407 284 I N -6.000 114.651 120.570 0.136 0.000 3.145 284 I HA 0.586 4.824 4.170 0.113 0.000 0.313 284 I C -2.021 174.136 176.117 0.067 0.000 1.122 284 I CA -2.764 58.613 61.300 0.128 0.000 0.987 284 I CB 3.740 41.856 38.000 0.195 0.000 1.236 284 I HN 0.333 8.613 8.210 0.118 0.000 0.453 285 G N 0.096 108.930 108.800 0.057 0.000 2.814 285 G HA2 0.563 4.712 3.960 0.022 0.000 0.300 285 G HA3 0.563 4.536 3.960 0.022 0.000 0.300 285 G C -1.921 173.007 174.900 0.047 0.000 1.406 285 G CA -0.857 44.263 45.100 0.034 0.000 1.041 285 G HN 0.324 8.651 8.290 0.062 0.000 0.532 286 L N 6.623 127.875 121.223 0.050 0.000 2.367 286 L HA 0.096 4.475 4.340 0.065 0.000 0.275 286 L C -0.499 176.404 176.870 0.055 0.000 1.129 286 L CA 0.055 54.929 54.840 0.057 0.000 0.839 286 L CB 0.532 42.625 42.059 0.057 0.000 1.133 286 L HN 0.314 8.569 8.230 0.042 0.000 0.453 287 L N 2.815 124.076 121.223 0.062 0.000 2.334 287 L HA 0.185 4.744 4.340 0.076 -0.173 0.277 287 L C 0.026 176.938 176.870 0.071 0.000 1.075 287 L CA -0.291 54.593 54.840 0.073 0.000 0.804 287 L CB 0.866 42.974 42.059 0.081 0.000 1.174 287 L HN -0.021 8.247 8.230 0.063 0.000 0.438 288 D N 0.575 121.021 120.400 0.077 0.000 2.178 288 D HA -0.147 4.527 4.640 0.057 0.000 0.201 288 D C 0.038 176.378 176.300 0.068 0.000 0.980 288 D CA 2.430 56.470 54.000 0.067 0.000 0.842 288 D CB 0.545 41.387 40.800 0.070 0.000 0.948 288 D HN 0.180 8.602 8.370 0.087 0.000 0.472 289 T N -6.774 107.830 114.554 0.083 0.000 2.865 289 T HA 0.237 4.628 4.350 0.068 0.000 0.294 289 T C -1.510 173.243 174.700 0.089 0.000 1.119 289 T CA -2.288 59.861 62.100 0.081 0.000 1.007 289 T CB 3.171 72.091 68.868 0.086 0.000 1.225 289 T HN -0.825 7.451 8.240 0.095 0.021 0.515 290 A N 1.258 124.128 122.820 0.084 0.000 3.037 290 A HA 0.057 4.429 4.320 0.086 0.000 0.272 290 A C -0.791 176.849 177.584 0.093 0.000 1.723 290 A CA -0.471 51.618 52.037 0.087 0.000 1.413 290 A CB -0.634 18.419 19.000 0.088 0.000 1.112 290 A HN 0.247 8.443 8.150 0.077 0.000 0.606 291 D N 3.052 123.519 120.400 0.112 0.000 2.456 291 D HA 0.078 4.811 4.640 0.155 0.000 0.219 291 D C 0.662 177.041 176.300 0.132 0.000 1.126 291 D CA -1.090 53.002 54.000 0.152 0.000 0.890 291 D CB 0.889 41.820 40.800 0.218 0.000 1.025 291 D HN -0.608 7.801 8.370 0.109 0.026 0.511 292 S N 6.806 122.568 115.700 0.103 0.000 2.419 292 S HA -0.345 4.146 4.470 0.034 0.000 0.233 292 S C 1.658 176.311 174.600 0.089 0.000 1.016 292 S CA 2.692 60.929 58.200 0.062 0.000 0.974 292 S CB -0.395 62.818 63.200 0.023 0.000 0.786 292 S HN 0.291 8.661 8.310 0.101 0.000 0.492 293 N N 2.942 121.743 118.700 0.169 0.000 2.104 293 N HA -0.223 4.600 4.740 0.138 0.000 0.190 293 N C 2.200 177.832 175.510 0.203 0.000 1.024 293 N CA 2.843 56.019 53.050 0.210 0.000 0.853 293 N CB -0.447 38.275 38.487 0.392 0.000 1.008 293 N HN -0.356 8.324 8.380 0.211 -0.173 0.424 294 V N 0.369 120.403 119.914 0.201 0.000 2.535 294 V HA -0.311 3.969 4.120 0.267 0.000 0.246 294 V C 1.542 177.709 176.094 0.123 0.000 1.045 294 V CA 3.033 65.449 62.300 0.194 0.000 1.058 294 V CB -0.455 31.473 31.823 0.176 0.000 0.689 294 V HN -0.714 7.594 8.190 0.203 0.005 0.461 295 M N -0.870 118.774 119.600 0.075 0.000 2.080 295 M HA -0.511 3.971 4.480 0.002 0.000 0.260 295 M C 2.719 179.033 176.300 0.022 0.000 1.068 295 M CA 4.475 59.784 55.300 0.015 0.000 1.109 295 M CB -0.108 32.470 32.600 -0.036 0.000 1.342 295 M HN -0.597 7.741 8.290 0.080 0.000 0.405 296 C N -2.781 116.542 119.300 0.040 0.000 2.448 296 C HA -0.163 4.326 4.460 0.049 0.000 0.280 296 C C 1.700 176.763 174.990 0.123 0.000 1.398 296 C CA 2.395 61.444 59.018 0.051 0.000 1.774 296 C CB -2.240 25.481 27.740 -0.031 0.000 1.888 296 C HN -0.012 8.244 8.230 0.043 0.000 0.519 297 A N -1.400 121.514 122.820 0.157 0.000 2.248 297 A HA -0.253 4.202 4.320 0.225 0.000 0.210 297 A C 0.532 178.253 177.584 0.227 0.000 1.174 297 A CA 1.483 53.665 52.037 0.241 0.000 0.750 297 A CB -0.949 18.313 19.000 0.437 0.000 0.780 297 A HN -0.513 7.620 8.150 0.157 0.112 0.478 298 Q N -3.629 116.261 119.800 0.150 0.000 2.234 298 Q HA -0.295 4.190 4.340 0.242 0.000 0.206 298 Q C 0.169 176.262 176.000 0.154 0.000 0.980 298 Q CA 2.524 58.423 55.803 0.159 0.000 0.869 298 Q CB 0.427 29.183 28.738 0.031 0.000 0.912 298 Q HN -0.491 7.800 8.270 0.105 0.042 0.436 299 C N -7.474 111.829 119.300 0.006 0.000 3.484 299 C HA 0.304 4.648 4.460 -0.193 0.000 0.543 299 C C 0.575 175.358 174.990 -0.345 0.000 1.395 299 C CA -0.215 58.680 59.018 -0.204 0.000 2.412 299 C CB 2.852 30.405 27.740 -0.313 0.000 3.532 299 C HN -0.670 7.559 8.230 0.037 0.023 0.584 300 H N 3.685 122.664 119.070 -0.151 0.000 2.640 300 H HA 0.176 4.583 4.556 -0.248 0.000 0.220 300 H C -1.690 173.623 175.328 -0.024 0.000 1.852 300 H CA 0.680 56.646 56.048 -0.136 0.000 1.275 300 H CB -2.149 27.539 29.762 -0.123 0.000 1.675 300 H HN -0.205 8.129 8.280 0.090 0.000 0.523 301 V N -6.310 113.652 119.914 0.080 0.000 3.130 301 V HA 0.616 4.917 4.120 -0.038 -0.204 0.310 301 V C -1.457 174.633 176.094 -0.007 0.000 1.158 301 V CA -3.800 58.488 62.300 -0.020 0.000 1.029 301 V CB 3.644 35.359 31.823 -0.180 0.000 1.057 301 V HN -0.613 7.558 8.190 0.078 0.067 0.436 302 E N 3.029 123.146 120.200 -0.139 0.000 2.313 302 E HA 0.262 4.592 4.350 -0.250 -0.130 0.276 302 E C -1.231 175.470 176.600 0.168 0.000 1.031 302 E CA -1.055 55.252 56.400 -0.155 0.000 0.857 302 E CB 1.754 31.208 29.700 -0.411 0.000 1.040 302 E HN -0.085 8.601 8.360 -0.163 -0.423 0.408 303 Y N 2.150 122.508 120.300 0.096 0.000 2.638 303 Y HA 0.770 5.619 4.550 0.268 -0.139 0.335 303 Y C -1.974 174.135 175.900 0.350 0.000 1.155 303 Y CA -2.264 55.950 58.100 0.189 0.000 1.046 303 Y CB 2.687 41.109 38.460 -0.064 0.000 1.303 303 Y HN -0.381 7.735 8.280 -0.274 0.000 0.460 304 N N 0.735 119.582 118.700 0.245 0.000 2.421 304 N HA 0.359 5.234 4.740 0.027 -0.118 0.285 304 N C -1.156 174.582 175.510 0.380 0.000 1.027 304 N CA -1.249 51.871 53.050 0.116 0.000 0.918 304 N CB 2.721 41.111 38.487 -0.162 0.000 1.152 304 N HN 0.198 8.736 8.380 0.264 0.000 0.485 305 C N -0.433 119.107 119.300 0.401 0.000 3.235 305 C HA 0.656 5.524 4.460 0.357 -0.194 0.198 305 C C -2.012 173.173 174.990 0.324 0.000 1.527 305 C CA -2.935 56.356 59.018 0.456 0.000 1.167 305 C CB 0.044 28.177 27.740 0.655 0.000 1.938 305 C HN 0.519 8.914 8.230 0.276 0.000 0.593 306 N N -1.555 117.289 118.700 0.241 0.000 4.104 306 N HA 0.209 5.056 4.740 0.178 0.000 0.214 306 N C -3.661 171.968 175.510 0.198 0.000 1.270 306 N CA -0.550 52.625 53.050 0.207 0.000 0.894 306 N CB -0.440 38.184 38.487 0.227 0.000 1.495 306 N HN -0.589 7.919 8.380 0.214 0.000 0.506 307 P HA 0.270 4.839 4.420 0.088 -0.096 0.274 307 P C -0.970 176.319 177.300 -0.018 0.000 1.246 307 P CA -0.496 62.629 63.100 0.041 0.000 0.795 307 P CB 0.891 32.549 31.700 -0.071 0.000 1.006 308 G N -3.194 105.437 108.800 -0.281 0.000 2.827 308 G HA2 0.587 4.071 3.960 -0.795 0.000 0.202 308 G HA3 0.587 4.040 3.960 -1.018 -0.104 0.202 308 G C -2.514 171.611 174.900 -1.290 0.000 1.185 308 G CA 0.659 45.261 45.100 -0.831 0.000 0.920 308 G HN 0.168 8.312 8.290 -0.243 0.000 0.550 309 Y N -3.565 116.105 120.300 -1.050 0.000 2.597 309 Y HA 0.620 5.058 4.550 -0.494 -0.184 0.340 309 Y C -1.303 174.168 175.900 -0.714 0.000 1.097 309 Y CA -1.300 56.287 58.100 -0.854 0.000 1.037 309 Y CB 4.650 42.396 38.460 -1.191 0.000 1.305 309 Y HN 0.135 7.540 8.280 -1.457 0.000 0.463 310 Q N -0.349 119.401 119.800 -0.084 0.000 2.261 310 Q HA 0.426 5.045 4.340 0.078 -0.232 0.252 310 Q C 1.225 177.407 176.000 0.304 0.000 0.915 310 Q CA -0.813 55.043 55.803 0.089 0.000 0.915 310 Q CB 1.297 30.093 28.738 0.098 0.000 1.204 310 Q HN 0.313 8.582 8.270 -0.000 0.000 0.421 311 L N 3.706 125.137 121.223 0.346 0.000 2.131 311 L HA -0.421 4.137 4.340 0.363 0.000 0.210 311 L C 1.108 178.062 176.870 0.140 0.000 1.092 311 L CA 2.749 57.758 54.840 0.282 0.000 0.759 311 L CB -0.214 41.935 42.059 0.151 0.000 0.903 311 L HN 0.477 8.957 8.230 0.291 -0.075 0.435 312 S N -1.764 114.008 115.700 0.119 0.000 2.345 312 S HA -0.190 4.310 4.470 0.051 0.000 0.220 312 S C 0.684 175.326 174.600 0.070 0.000 1.031 312 S CA 2.443 60.686 58.200 0.073 0.000 0.996 312 S CB -0.012 63.227 63.200 0.066 0.000 0.882 312 S HN -0.181 8.446 8.310 0.131 -0.238 0.445 313 D N -2.192 118.263 120.400 0.092 0.000 2.525 313 D HA -0.008 4.669 4.640 0.062 0.000 0.231 313 D C 0.415 176.775 176.300 0.099 0.000 1.216 313 D CA -0.719 53.328 54.000 0.078 0.000 0.813 313 D CB 0.645 41.481 40.800 0.060 0.000 1.108 313 D HN -0.663 7.773 8.370 0.110 0.000 0.524 314 G N 0.856 109.754 108.800 0.163 0.000 2.184 314 G HA2 -0.339 3.884 3.960 0.307 0.000 0.264 314 G HA3 -0.339 3.706 3.960 0.142 0.000 0.264 314 G C 0.204 175.201 174.900 0.161 0.000 0.975 314 G CA 0.572 45.786 45.100 0.190 0.000 0.642 314 G HN -0.100 8.310 8.290 0.199 0.000 0.536 315 S N -0.169 115.606 115.700 0.126 0.000 2.585 315 S HA -0.081 4.460 4.470 0.118 0.000 0.273 315 S C -0.157 174.505 174.600 0.105 0.000 1.339 315 S CA 0.178 58.443 58.200 0.109 0.000 1.028 315 S CB 1.033 64.273 63.200 0.066 0.000 0.906 315 S HN -0.441 8.174 8.310 0.109 -0.240 0.528 316 R N 0.617 121.161 120.500 0.075 0.000 2.537 316 R HA 0.057 4.404 4.340 -0.218 -0.138 0.280 316 R C 0.275 176.510 176.300 -0.109 0.000 1.058 316 R CA -0.181 55.870 56.100 -0.081 0.000 1.057 316 R CB 0.351 30.617 30.300 -0.057 0.000 0.973 316 R HN 0.184 8.504 8.270 0.083 0.000 0.438 317 V N 4.970 124.762 119.914 -0.204 0.000 2.313 317 V HA 0.193 4.303 4.120 -0.018 0.000 0.278 317 V C -0.895 175.165 176.094 -0.057 0.000 1.017 317 V CA -0.582 61.681 62.300 -0.060 0.000 0.823 317 V CB 1.146 33.010 31.823 0.069 0.000 1.010 317 V HN 0.215 8.068 8.190 -0.377 0.111 0.443 318 G N 4.306 113.091 108.800 -0.025 0.000 2.535 318 G HA2 0.187 4.125 3.960 -0.037 0.000 0.303 318 G HA3 0.187 4.139 3.960 -0.013 0.000 0.303 318 G C 0.594 175.509 174.900 0.025 0.000 1.237 318 G CA -1.029 44.062 45.100 -0.015 0.000 0.986 318 G HN 0.184 8.466 8.290 -0.014 0.000 0.494 319 M N -0.608 119.013 119.600 0.034 0.000 2.279 319 M HA -0.310 4.213 4.480 0.072 0.000 0.264 319 M C 0.808 177.132 176.300 0.039 0.000 1.062 319 M CA 1.470 56.804 55.300 0.056 0.000 1.099 319 M CB -1.114 31.529 32.600 0.072 0.000 1.394 319 M HN 0.411 8.717 8.290 0.027 0.000 0.426 320 D N -5.607 114.806 120.400 0.023 0.000 2.263 320 D HA -0.240 4.401 4.640 0.002 0.000 0.208 320 D C 0.404 176.705 176.300 0.001 0.000 0.971 320 D CA 1.797 55.801 54.000 0.008 0.000 0.867 320 D CB -0.806 39.997 40.800 0.005 0.000 0.929 320 D HN 0.135 8.496 8.370 0.021 0.022 0.492 321 D N 0.721 121.127 120.400 0.010 0.000 2.304 321 D HA 0.045 4.684 4.640 -0.001 0.000 0.250 321 D C 0.730 177.026 176.300 -0.007 0.000 1.107 321 D CA -0.056 53.947 54.000 0.005 0.000 0.885 321 D CB 2.052 42.864 40.800 0.021 0.000 1.192 321 D HN -0.500 7.844 8.370 0.018 0.037 0.436 322 R N 6.328 126.814 120.500 -0.023 0.000 2.170 322 R HA -0.338 3.981 4.340 -0.035 0.000 0.242 322 R C 2.108 178.375 176.300 -0.055 0.000 1.145 322 R CA 2.162 58.241 56.100 -0.036 0.000 0.984 322 R CB -0.196 30.083 30.300 -0.035 0.000 0.869 322 R HN 0.628 8.886 8.270 -0.020 0.000 0.455 323 R N -2.716 117.728 120.500 -0.094 0.000 2.241 323 R HA -0.269 3.884 4.340 -0.312 0.000 0.224 323 R C 0.701 176.868 176.300 -0.221 0.000 1.101 323 R CA 2.357 58.319 56.100 -0.230 0.000 0.995 323 R CB -0.307 29.852 30.300 -0.234 0.000 0.870 323 R HN -0.304 8.230 8.270 -0.069 -0.306 0.463 324 A N -4.128 118.658 122.820 -0.056 0.000 2.168 324 A HA -0.107 4.365 4.320 0.015 -0.143 0.215 324 A C -1.164 176.472 177.584 0.086 0.000 1.152 324 A CA 0.697 52.750 52.037 0.027 0.000 0.716 324 A CB 0.849 19.898 19.000 0.081 0.000 0.794 324 A HN -0.480 7.620 8.150 -0.021 0.038 0.465 325 N N -2.198 116.546 118.700 0.073 0.000 2.682 325 N HA 0.229 5.237 4.740 0.205 -0.145 0.252 325 N C -1.876 173.703 175.510 0.116 0.000 1.081 325 N CA -0.464 52.666 53.050 0.133 0.000 0.844 325 N CB 0.784 39.344 38.487 0.122 0.000 1.167 325 N HN -0.768 7.594 8.380 0.030 0.036 0.523 326 H N 6.258 125.349 119.070 0.036 0.000 2.966 326 H HA 0.258 4.765 4.556 -0.081 0.000 0.347 326 H C -2.404 173.038 175.328 0.190 0.000 1.048 326 H CA -0.404 55.603 56.048 -0.069 0.000 1.295 326 H CB 3.448 32.971 29.762 -0.398 0.000 1.744 326 H HN 0.114 8.559 8.280 0.276 0.000 0.513 327 F N 6.185 125.814 119.950 -0.534 0.000 2.391 327 F HA 0.205 4.739 4.527 0.012 0.000 0.359 327 F C 0.137 175.691 175.800 -0.411 0.000 1.122 327 F CA -2.749 55.103 58.000 -0.247 0.000 1.120 327 F CB -0.365 38.569 39.000 -0.110 0.000 1.142 327 F HN 0.582 8.742 8.300 -0.234 0.000 0.483 328 F N 3.129 123.183 119.950 0.172 0.000 2.234 328 F HA -0.122 4.534 4.527 0.215 0.000 0.299 328 F C 0.990 177.068 175.800 0.463 0.000 1.087 328 F CA 2.419 60.590 58.000 0.284 0.000 1.340 328 F CB 0.863 40.097 39.000 0.390 0.000 1.031 328 F HN -0.220 8.397 8.300 0.529 0.000 0.500 329 W N -2.637 118.925 121.300 0.438 0.000 5.963 329 W HA -0.404 4.570 4.660 0.524 0.000 0.400 329 W C -2.378 174.526 176.519 0.641 0.000 1.530 329 W CA -0.163 57.487 57.345 0.508 0.000 1.004 329 W CB -1.499 28.198 29.460 0.395 0.000 2.706 329 W HN -0.157 8.498 8.180 0.791 0.000 1.495 330 A N -0.745 122.462 122.820 0.644 0.000 2.422 330 A HA 0.222 4.895 4.320 0.589 0.000 0.302 330 A C -1.810 176.108 177.584 0.557 0.000 1.041 330 A CA -1.264 51.129 52.037 0.593 0.000 0.708 330 A CB 2.940 22.252 19.000 0.520 0.000 1.257 330 A HN -0.570 7.958 8.150 0.630 0.000 0.414 331 N N 2.249 121.256 118.700 0.512 0.000 2.317 331 N HA -0.143 4.758 4.740 0.269 0.000 0.245 331 N C 1.388 176.783 175.510 -0.192 0.000 1.294 331 N CA -0.762 52.432 53.050 0.241 0.000 0.924 331 N CB 0.389 39.030 38.487 0.258 0.000 1.186 331 N HN -0.080 8.664 8.380 0.606 0.000 0.495 332 V N -1.131 118.224 119.914 -0.932 0.000 2.392 332 V HA -0.229 2.556 4.120 -2.226 0.000 0.249 332 V C 1.168 176.926 176.094 -0.560 0.000 1.059 332 V CA 2.549 63.892 62.300 -1.595 0.000 1.051 332 V CB -0.337 30.240 31.823 -2.077 0.000 0.658 332 V HN 0.545 8.224 8.190 -0.851 0.000 0.455 333 F N -4.859 115.069 119.950 -0.037 0.000 2.811 333 F HA 0.022 4.696 4.527 0.245 0.000 0.301 333 F C 0.796 176.694 175.800 0.163 0.000 1.151 333 F CA -0.220 57.855 58.000 0.125 0.000 1.412 333 F CB -0.436 38.596 39.000 0.054 0.000 1.113 333 F HN -0.565 7.700 8.300 -0.278 -0.132 0.579 334 D N -2.466 118.109 120.400 0.292 0.000 2.407 334 D HA 0.144 4.948 4.640 0.273 0.000 0.208 334 D C 0.483 176.947 176.300 0.272 0.000 1.083 334 D CA 0.189 54.360 54.000 0.286 0.000 0.844 334 D CB 1.373 42.361 40.800 0.312 0.000 0.967 334 D HN -0.401 8.082 8.370 0.220 0.019 0.506 335 Y N 2.108 122.478 120.300 0.116 0.000 2.145 335 Y HA -0.507 4.144 4.550 0.168 0.000 0.286 335 Y C 0.578 176.560 175.900 0.137 0.000 1.145 335 Y CA 4.365 62.529 58.100 0.106 0.000 1.148 335 Y CB 0.190 38.656 38.460 0.011 0.000 0.981 335 Y HN -0.556 7.888 8.280 0.273 0.000 0.507 336 K N -1.251 119.315 120.400 0.276 0.000 2.063 336 K HA -0.458 4.033 4.320 0.286 0.000 0.208 336 K C 1.752 178.404 176.600 0.087 0.000 1.048 336 K CA 3.745 60.167 56.287 0.225 0.000 0.928 336 K CB -0.472 32.191 32.500 0.271 0.000 0.713 336 K HN 0.322 8.775 8.250 0.339 0.000 0.442 337 E N -0.857 119.414 120.200 0.119 0.000 2.077 337 E HA -0.268 4.313 4.350 0.083 -0.181 0.193 337 E C 2.034 178.696 176.600 0.103 0.000 0.989 337 E CA 2.942 59.404 56.400 0.105 0.000 0.800 337 E CB -0.387 29.391 29.700 0.130 0.000 0.746 337 E HN -0.024 8.433 8.360 0.162 0.000 0.452 338 A N -0.982 121.905 122.820 0.112 0.000 1.902 338 A HA -0.256 4.192 4.320 0.212 0.000 0.217 338 A C 1.967 179.669 177.584 0.198 0.000 1.181 338 A CA 2.883 55.034 52.037 0.189 0.000 0.623 338 A CB -0.648 18.533 19.000 0.301 0.000 0.818 338 A HN -0.416 7.721 8.150 0.107 0.077 0.443 339 A N -2.256 120.578 122.820 0.023 0.000 1.930 339 A HA -0.403 4.150 4.320 0.389 0.000 0.217 339 A C 2.026 179.714 177.584 0.173 0.000 1.175 339 A CA 2.646 54.776 52.037 0.155 0.000 0.627 339 A CB -0.452 18.556 19.000 0.014 0.000 0.815 339 A HN -0.040 8.007 8.150 -0.172 0.000 0.443 340 Q N -1.798 118.058 119.800 0.094 0.000 2.124 340 Q HA -0.386 3.999 4.340 0.075 0.000 0.202 340 Q C 3.286 179.339 176.000 0.088 0.000 0.977 340 Q CA 3.117 58.964 55.803 0.073 0.000 0.850 340 Q CB -0.096 28.660 28.738 0.031 0.000 0.901 340 Q HN -0.169 8.139 8.270 0.062 0.000 0.429 341 E N 0.138 120.396 120.200 0.097 0.000 2.085 341 E HA -0.279 4.116 4.350 0.075 0.000 0.194 341 E C 1.838 178.478 176.600 0.067 0.000 0.994 341 E CA 2.638 59.090 56.400 0.086 0.000 0.801 341 E CB 0.052 29.817 29.700 0.107 0.000 0.743 341 E HN -0.346 8.078 8.360 0.106 0.000 0.453 342 I N -9.975 110.634 120.570 0.064 0.000 3.793 342 I HA 0.236 4.400 4.170 -0.010 0.000 0.315 342 I C -1.185 174.994 176.117 0.102 0.000 1.275 342 I CA -0.921 60.383 61.300 0.007 0.000 1.214 342 I CB 0.562 38.440 38.000 -0.202 0.000 1.018 342 I HN -0.769 7.497 8.210 0.094 0.000 0.439 343 D N 0.247 120.737 120.400 0.150 0.000 2.828 343 D HA -0.381 4.357 4.640 0.164 0.000 0.241 343 D C -2.340 174.126 176.300 0.276 0.000 1.142 343 D CA 1.406 55.512 54.000 0.176 0.000 0.755 343 D CB -1.361 39.511 40.800 0.119 0.000 1.014 343 D HN -0.484 7.791 8.370 0.138 0.177 0.420 344 F N 0.788 120.833 119.950 0.158 0.000 2.596 344 F HA 0.681 5.475 4.527 0.120 -0.195 0.311 344 F C -2.921 173.086 175.800 0.345 0.000 1.116 344 F CA -0.818 57.290 58.000 0.180 0.000 0.957 344 F CB 3.646 42.730 39.000 0.140 0.000 1.250 344 F HN -0.717 7.817 8.300 0.389 0.000 0.444 345 F N 0.492 120.245 119.950 -0.329 0.000 2.664 345 F HA 0.439 5.066 4.527 0.166 0.000 0.317 345 F C -2.314 173.278 175.800 -0.347 0.000 1.108 345 F CA -1.750 56.183 58.000 -0.112 0.000 0.957 345 F CB 2.572 41.601 39.000 0.049 0.000 1.365 345 F HN 0.568 8.414 8.300 -0.756 0.000 0.475 346 D N 0.458 120.977 120.400 0.199 0.000 2.269 346 D HA 0.110 4.775 4.640 0.042 0.000 0.220 346 D C -0.508 176.065 176.300 0.456 0.000 0.962 346 D CA 3.905 58.058 54.000 0.255 0.000 0.884 346 D CB 2.444 43.527 40.800 0.473 0.000 1.023 346 D HN -0.103 8.519 8.370 0.421 0.000 0.484 347 F N -4.285 115.877 119.950 0.353 0.000 2.713 347 F HA 0.363 5.089 4.527 0.332 0.000 0.311 347 F C -2.661 173.324 175.800 0.307 0.000 1.141 347 F CA -1.694 56.495 58.000 0.315 0.000 0.939 347 F CB 1.563 40.710 39.000 0.245 0.000 1.325 347 F HN -0.628 7.993 8.300 0.535 0.000 0.453 348 R N 1.444 122.016 120.500 0.121 0.000 2.294 348 R HA 0.362 4.724 4.340 -0.286 -0.194 0.319 348 R C -0.609 175.629 176.300 -0.103 0.000 0.984 348 R CA -1.874 54.150 56.100 -0.126 0.000 0.861 348 R CB 1.683 31.938 30.300 -0.076 0.000 1.104 348 R HN 0.379 8.788 8.270 0.231 0.000 0.451 349 H N 7.329 126.183 119.070 -0.360 0.000 2.964 349 H HA -0.085 4.659 4.556 0.060 -0.153 0.328 349 H C 0.723 176.030 175.328 -0.035 0.000 1.030 349 H CA 1.548 57.511 56.048 -0.141 0.000 1.445 349 H CB 1.951 31.587 29.762 -0.211 0.000 1.449 349 H HN -0.001 8.087 8.280 -0.320 0.000 0.581 350 A N 8.528 131.143 122.820 -0.342 0.000 2.019 350 A HA -0.203 4.075 4.320 -0.070 0.000 0.219 350 A C 0.474 178.029 177.584 -0.049 0.000 1.164 350 A CA 2.838 54.784 52.037 -0.152 0.000 0.644 350 A CB 0.077 18.979 19.000 -0.164 0.000 0.805 350 A HN 0.460 8.144 8.150 -0.598 0.107 0.449 351 T N -1.979 112.618 114.554 0.071 0.000 3.004 351 T HA 0.130 4.521 4.350 0.068 0.000 0.243 351 T C 1.670 176.393 174.700 0.039 0.000 1.020 351 T CA 2.563 64.741 62.100 0.130 0.000 1.145 351 T CB 0.745 69.732 68.868 0.199 0.000 0.876 351 T HN -0.518 7.772 8.240 0.122 0.023 0.449 352 T N -1.771 112.763 114.554 -0.033 0.000 3.054 352 T HA 0.011 3.743 4.350 -1.030 0.000 0.259 352 T C 1.342 175.803 174.700 -0.398 0.000 1.092 352 T CA 1.205 62.850 62.100 -0.758 0.000 1.121 352 T CB 0.914 68.979 68.868 -1.339 0.000 0.912 352 T HN -0.471 8.001 8.240 0.387 0.000 0.489 353 G N 1.459 110.174 108.800 -0.142 0.000 2.184 353 G HA2 -0.504 3.470 3.960 -0.083 0.000 0.264 353 G HA3 -0.504 3.411 3.960 -0.075 0.000 0.264 353 G C -1.402 173.395 174.900 -0.171 0.000 0.975 353 G CA 0.375 45.410 45.100 -0.109 0.000 0.642 353 G HN -0.124 8.135 8.290 -0.051 0.000 0.536 354 A N 0.754 123.432 122.820 -0.238 0.000 2.440 354 A HA 0.136 4.311 4.320 -0.241 0.000 0.251 354 A C -0.997 176.308 177.584 -0.465 0.000 1.089 354 A CA -0.738 51.114 52.037 -0.308 0.000 0.779 354 A CB 0.951 19.747 19.000 -0.340 0.000 1.022 354 A HN -0.571 7.381 8.150 -0.244 0.052 0.492 355 A N 3.929 126.404 122.820 -0.575 0.000 2.492 355 A HA 0.072 3.907 4.320 -1.010 -0.121 0.254 355 A C -0.869 176.330 177.584 -0.642 0.000 1.091 355 A CA 0.355 51.790 52.037 -1.003 0.000 0.768 355 A CB 0.198 18.165 19.000 -1.722 0.000 1.028 355 A HN 0.363 8.210 8.150 -0.505 0.000 0.498 356 L N 2.677 123.531 121.223 -0.615 0.000 2.371 356 L HA 0.556 4.485 4.340 -0.685 0.000 0.262 356 L C -2.656 174.017 176.870 -0.329 0.000 1.006 356 L CA -3.280 51.129 54.840 -0.718 0.000 0.818 356 L CB 3.420 44.673 42.059 -1.344 0.000 1.354 356 L HN 0.247 8.168 8.230 -0.516 0.000 0.415 357 P HA 0.250 4.914 4.420 0.201 -0.124 0.284 357 P C -1.691 175.612 177.300 0.005 0.000 1.258 357 P CA -1.566 61.521 63.100 -0.021 0.000 0.824 357 P CB 0.913 32.585 31.700 -0.045 0.000 1.038 358 K N 2.118 122.551 120.400 0.055 0.000 2.307 358 K HA 0.165 4.543 4.320 -0.136 -0.139 0.263 358 K C -0.476 175.923 176.600 -0.335 0.000 0.973 358 K CA -1.684 54.494 56.287 -0.182 0.000 0.846 358 K CB 1.478 33.725 32.500 -0.422 0.000 1.100 358 K HN 0.007 8.650 8.250 0.131 -0.314 0.438 359 L N 5.669 126.628 121.223 -0.441 0.000 2.343 359 L HA 0.205 4.338 4.340 -0.631 -0.172 0.275 359 L C 0.253 176.726 176.870 -0.661 0.000 1.056 359 L CA -1.500 52.975 54.840 -0.608 0.000 0.804 359 L CB 0.871 42.531 42.059 -0.665 0.000 1.203 359 L HN 0.129 8.433 8.230 -0.382 -0.303 0.440 360 Q N -1.042 118.314 119.800 -0.739 0.000 2.305 360 Q HA 0.249 4.204 4.340 -0.642 0.000 0.271 360 Q C -1.292 174.120 176.000 -0.979 0.000 1.046 360 Q CA -1.460 53.851 55.803 -0.820 0.000 0.798 360 Q CB 3.953 32.210 28.738 -0.801 0.000 1.286 360 Q HN 0.158 8.185 8.270 -0.765 -0.216 0.435 361 H N -1.508 117.406 119.070 -0.261 0.000 1.828 361 H HA -0.302 4.349 4.556 -0.238 -0.239 0.319 361 H C -1.563 173.577 175.328 -0.313 0.000 0.826 361 H CA -0.751 55.161 56.048 -0.225 0.000 1.059 361 H CB -1.902 27.814 29.762 -0.076 0.000 1.545 361 H HN 0.336 8.360 8.280 -0.427 0.000 0.285 362 P HA 0.255 4.601 4.420 -0.394 -0.162 0.214 362 P C -0.660 176.468 177.300 -0.286 0.000 1.807 362 P CA -0.790 61.973 63.100 -0.563 0.000 0.921 362 P CB -0.691 30.175 31.700 -1.391 0.000 1.835 363 E N 2.411 122.564 120.200 -0.079 0.000 2.077 363 E HA -0.285 4.336 4.350 0.104 -0.209 0.193 363 E C 1.792 178.328 176.600 -0.108 0.000 0.989 363 E CA 3.601 60.004 56.400 0.005 0.000 0.800 363 E CB -0.664 29.062 29.700 0.044 0.000 0.746 363 E HN -0.389 7.915 8.360 0.000 0.056 0.452 364 A N -0.958 121.766 122.820 -0.160 0.000 1.883 364 A HA -0.363 3.847 4.320 -0.184 0.000 0.217 364 A C 1.857 178.931 177.584 -0.850 0.000 1.186 364 A CA 3.791 55.651 52.037 -0.295 0.000 0.624 364 A CB -0.467 18.475 19.000 -0.096 0.000 0.822 364 A HN -0.178 7.916 8.150 -0.095 0.000 0.444 365 E N -5.742 113.926 120.200 -0.887 0.000 2.358 365 E HA -0.233 2.402 4.350 -2.859 0.000 0.195 365 E C 1.380 177.728 176.600 -0.421 0.000 1.010 365 E CA 2.376 58.002 56.400 -1.290 0.000 0.856 365 E CB -0.565 28.795 29.700 -0.567 0.000 0.795 365 E HN 0.437 8.464 8.360 -0.556 0.000 0.504 366 T N 0.724 115.223 114.554 -0.090 0.000 2.894 366 T HA -0.009 4.665 4.350 0.288 -0.150 0.258 366 T C 0.531 175.374 174.700 0.238 0.000 1.043 366 T CA 3.279 65.507 62.100 0.214 0.000 1.141 366 T CB 0.169 69.231 68.868 0.324 0.000 0.873 366 T HN -0.640 7.499 8.240 -0.126 0.026 0.449 367 F N 0.771 120.703 119.950 -0.030 0.000 2.216 367 F HA -0.171 4.435 4.527 0.132 0.000 0.300 367 F C 0.151 176.063 175.800 0.187 0.000 1.085 367 F CA 0.521 58.551 58.000 0.051 0.000 1.326 367 F CB 0.732 39.689 39.000 -0.071 0.000 1.027 367 F HN -0.579 7.801 8.300 0.133 0.000 0.497 368 W N -1.664 119.672 121.300 0.060 0.000 2.343 368 W HA -0.334 4.301 4.660 -0.043 0.000 0.337 368 W C 0.780 177.249 176.519 -0.083 0.000 1.320 368 W CA 1.986 59.315 57.345 -0.027 0.000 1.290 368 W CB -1.704 27.772 29.460 0.027 0.000 1.206 368 W HN -0.812 7.338 8.180 -0.035 0.009 0.565 369 G N 1.933 110.796 108.800 0.105 0.000 2.199 369 G HA2 -0.401 3.562 3.960 0.006 0.000 0.254 369 G HA3 -0.401 3.577 3.960 0.031 0.000 0.254 369 G C -0.769 174.117 174.900 -0.023 0.000 0.982 369 G CA -0.020 45.093 45.100 0.022 0.000 0.632 369 G HN 0.356 9.068 8.290 0.086 -0.371 0.529 370 S N -1.343 114.314 115.700 -0.072 0.000 2.576 370 S HA 0.041 4.493 4.470 -0.030 0.000 0.272 370 S C 1.138 175.673 174.600 -0.109 0.000 1.352 370 S CA -0.559 57.594 58.200 -0.077 0.000 1.021 370 S CB 1.680 64.846 63.200 -0.057 0.000 0.887 370 S HN -0.696 7.477 8.310 -0.106 0.074 0.542 371 V N 2.473 122.323 119.914 -0.108 0.000 2.324 371 V HA -0.457 3.604 4.120 -0.098 0.000 0.250 371 V C 1.765 177.796 176.094 -0.106 0.000 1.060 371 V CA 4.193 66.414 62.300 -0.132 0.000 1.042 371 V CB -0.477 31.235 31.823 -0.185 0.000 0.650 371 V HN 0.524 8.650 8.190 -0.106 0.000 0.450 372 H N -2.647 116.426 119.070 0.006 0.000 2.290 372 H HA -0.416 4.210 4.556 0.117 0.000 0.298 372 H C 1.787 177.098 175.328 -0.029 0.000 1.087 372 H CA 3.884 59.985 56.048 0.089 0.000 1.291 372 H CB -0.187 29.770 29.762 0.324 0.000 1.369 372 H HN -0.447 7.779 8.280 -0.090 0.000 0.492 373 E N -0.512 119.519 120.200 -0.281 0.000 2.077 373 E HA -0.291 4.097 4.350 -0.202 -0.159 0.193 373 E C 2.997 179.541 176.600 -0.093 0.000 0.989 373 E CA 2.706 58.877 56.400 -0.381 0.000 0.800 373 E CB -0.245 28.980 29.700 -0.793 0.000 0.746 373 E HN -0.500 7.580 8.360 -0.467 0.000 0.452 374 R N -2.395 118.053 120.500 -0.087 0.000 2.148 374 R HA -0.153 4.155 4.340 -0.053 0.000 0.227 374 R C 1.881 178.164 176.300 -0.028 0.000 1.103 374 R CA 1.764 57.833 56.100 -0.051 0.000 0.983 374 R CB -0.378 29.892 30.300 -0.049 0.000 0.874 374 R HN -0.030 8.174 8.270 -0.111 0.000 0.451 375 N N -3.282 115.419 118.700 0.002 0.000 2.383 375 N HA 0.019 4.761 4.740 0.003 0.000 0.192 375 N C 0.168 175.707 175.510 0.049 0.000 1.141 375 N CA 0.379 53.443 53.050 0.024 0.000 0.851 375 N CB 0.424 38.934 38.487 0.039 0.000 0.976 375 N HN -0.628 7.645 8.380 0.011 0.114 0.465 376 G N -1.206 107.627 108.800 0.054 0.000 2.143 376 G HA2 -0.469 3.521 3.960 0.049 0.000 0.249 376 G HA3 -0.469 3.519 3.960 0.046 0.000 0.249 376 G C -0.414 174.573 174.900 0.145 0.000 0.981 376 G CA 0.400 45.542 45.100 0.070 0.000 0.665 376 G HN -0.404 7.739 8.290 0.040 0.171 0.528 377 V N 0.116 120.162 119.914 0.220 0.000 2.775 377 V HA 0.033 4.414 4.120 0.204 -0.138 0.299 377 V C -0.937 175.407 176.094 0.417 0.000 1.062 377 V CA -0.046 62.426 62.300 0.286 0.000 1.063 377 V CB 0.078 32.107 31.823 0.343 0.000 0.994 377 V HN -0.622 7.664 8.190 0.221 0.037 0.483 378 A N 2.656 125.638 122.820 0.271 0.000 2.485 378 A HA 0.680 5.399 4.320 0.375 -0.173 0.292 378 A C 1.029 178.606 177.584 -0.012 0.000 1.147 378 A CA -2.038 50.132 52.037 0.221 0.000 0.750 378 A CB 3.032 22.150 19.000 0.197 0.000 1.331 378 A HN 0.067 8.629 8.150 0.179 -0.304 0.419 379 C N -0.481 118.745 119.300 -0.124 0.000 2.385 379 C HA -0.399 3.906 4.460 -0.258 0.000 0.275 379 C C 2.095 177.065 174.990 -0.034 0.000 1.207 379 C CA 3.844 62.768 59.018 -0.157 0.000 1.760 379 C CB -1.825 25.824 27.740 -0.151 0.000 2.051 379 C HN 0.328 8.706 8.230 -0.084 -0.198 0.467 380 A N -0.801 122.009 122.820 -0.017 0.000 2.024 380 A HA -0.365 4.009 4.320 -0.006 -0.058 0.220 380 A C 2.198 179.767 177.584 -0.026 0.000 1.164 380 A CA 3.003 55.031 52.037 -0.014 0.000 0.643 380 A CB -0.825 18.164 19.000 -0.017 0.000 0.806 380 A HN 0.020 8.165 8.150 -0.009 0.000 0.451 381 D N -1.857 118.529 120.400 -0.023 0.000 2.218 381 D HA -0.232 4.398 4.640 -0.017 0.000 0.204 381 D C 0.380 176.634 176.300 -0.076 0.000 0.976 381 D CA 3.381 57.365 54.000 -0.026 0.000 0.853 381 D CB -0.087 40.717 40.800 0.007 0.000 0.939 381 D HN -0.210 8.132 8.370 -0.010 0.022 0.481 382 C N -4.403 114.804 119.300 -0.154 0.000 2.700 382 C HA -0.015 4.315 4.460 -0.215 0.000 0.297 382 C C -0.164 174.601 174.990 -0.375 0.000 1.293 382 C CA 1.554 60.392 59.018 -0.300 0.000 1.756 382 C CB 0.787 28.259 27.740 -0.447 0.000 2.210 382 C HN -0.635 7.488 8.230 -0.154 0.015 0.553 383 H N -4.957 114.062 119.070 -0.086 0.000 2.874 383 H HA 0.440 5.082 4.556 -0.093 -0.142 0.264 383 H C -0.544 174.733 175.328 -0.086 0.000 1.007 383 H CA 0.059 56.050 56.048 -0.096 0.000 1.207 383 H CB 2.151 31.839 29.762 -0.123 0.000 1.487 383 H HN -0.260 7.978 8.280 -0.069 0.000 0.505 384 M N -0.843 118.766 119.600 0.014 0.000 3.568 384 M HA 0.514 5.058 4.480 -0.019 -0.076 0.386 384 M C -3.031 173.244 176.300 -0.041 0.000 1.765 384 M CA -1.930 53.353 55.300 -0.029 0.000 0.568 384 M CB 1.451 33.999 32.600 -0.086 0.000 1.428 384 M HN -0.522 7.649 8.290 -0.002 0.118 0.493 385 P HA 0.065 4.462 4.420 -0.039 0.000 0.274 385 P C -0.704 176.557 177.300 -0.065 0.000 1.246 385 P CA -0.975 62.097 63.100 -0.047 0.000 0.795 385 P CB 0.579 32.248 31.700 -0.050 0.000 1.006 386 K N -1.185 119.176 120.400 -0.064 0.000 2.436 386 K HA -0.170 4.208 4.320 -0.123 -0.132 0.275 386 K C 0.288 176.796 176.600 -0.154 0.000 0.999 386 K CA 0.510 56.735 56.287 -0.103 0.000 0.980 386 K CB -0.030 32.432 32.500 -0.063 0.000 0.919 386 K HN 0.059 8.281 8.250 -0.046 0.000 0.484 387 V N 3.392 123.133 119.914 -0.289 0.000 2.811 387 V HA -0.157 4.006 4.120 -0.203 -0.164 0.302 387 V C -0.093 175.905 176.094 -0.159 0.000 1.063 387 V CA 0.497 62.626 62.300 -0.285 0.000 1.088 387 V CB 0.366 31.859 31.823 -0.550 0.000 0.982 387 V HN -0.152 7.797 8.190 -0.401 0.000 0.485 388 Q N 4.589 124.333 119.800 -0.094 0.000 2.325 388 Q HA 0.229 4.542 4.340 -0.045 0.000 0.262 388 Q C -1.253 174.730 176.000 -0.029 0.000 0.968 388 Q CA -0.872 54.902 55.803 -0.048 0.000 0.877 388 Q CB 1.492 30.212 28.738 -0.030 0.000 1.253 388 Q HN -0.058 8.339 8.270 -0.087 -0.179 0.448 389 L N 3.834 125.050 121.223 -0.011 0.000 2.386 389 L HA 0.216 4.564 4.340 0.013 0.000 0.271 389 L C 0.439 177.318 176.870 0.014 0.000 0.993 389 L CA -0.858 53.989 54.840 0.011 0.000 0.819 389 L CB 1.707 43.785 42.059 0.032 0.000 1.294 389 L HN 0.279 8.503 8.230 -0.011 0.000 0.414 390 E N 1.174 121.384 120.200 0.017 0.000 2.085 390 E HA -0.187 4.171 4.350 0.013 0.000 0.194 390 E C -0.103 176.509 176.600 0.019 0.000 0.994 390 E CA 1.631 58.040 56.400 0.016 0.000 0.801 390 E CB 0.417 30.127 29.700 0.016 0.000 0.743 390 E HN 0.294 8.665 8.360 0.018 0.000 0.453 391 N N -1.551 117.165 118.700 0.025 0.000 2.549 391 N HA 0.120 4.875 4.740 0.026 0.000 0.290 391 N C -1.475 174.058 175.510 0.038 0.000 1.122 391 N CA 0.167 53.234 53.050 0.028 0.000 0.885 391 N CB 0.758 39.260 38.487 0.024 0.000 1.455 391 N HN -0.278 8.118 8.380 0.028 0.000 0.521 392 G N 0.626 109.452 108.800 0.043 0.000 2.321 392 G HA2 -0.146 3.847 3.960 0.056 0.000 0.298 392 G HA3 -0.146 3.857 3.960 0.073 0.000 0.298 392 G C -2.236 172.705 174.900 0.068 0.000 1.385 392 G CA -0.126 45.010 45.100 0.060 0.000 0.856 392 G HN -0.095 8.218 8.290 0.038 0.000 0.584 393 K N 0.678 121.132 120.400 0.090 0.000 2.316 393 K HA 0.121 4.489 4.320 0.080 0.000 0.289 393 K C -0.648 176.049 176.600 0.160 0.000 1.070 393 K CA -0.461 55.889 56.287 0.104 0.000 0.928 393 K CB 0.380 32.937 32.500 0.096 0.000 1.039 393 K HN -0.042 8.264 8.250 0.094 0.000 0.480 394 V N 5.558 125.538 119.914 0.109 0.000 2.740 394 V HA -0.036 4.106 4.120 0.037 0.000 0.303 394 V C -0.939 175.258 176.094 0.171 0.000 1.054 394 V CA 0.476 62.822 62.300 0.077 0.000 1.106 394 V CB 0.452 32.286 31.823 0.018 0.000 0.957 394 V HN 0.317 8.555 8.190 0.080 0.000 0.486 395 Y N 3.063 123.391 120.300 0.048 0.000 2.655 395 Y HA 0.336 4.920 4.550 0.057 0.000 0.336 395 Y C -2.137 173.812 175.900 0.082 0.000 1.154 395 Y CA -2.800 55.337 58.100 0.062 0.000 1.055 395 Y CB 1.316 39.814 38.460 0.063 0.000 1.295 395 Y HN -0.535 7.590 8.280 -0.258 0.000 0.465 396 T N 2.655 117.334 114.554 0.207 0.000 2.771 396 T HA -0.004 4.340 4.350 -0.010 0.000 0.291 396 T C -0.733 174.138 174.700 0.285 0.000 0.954 396 T CA 0.044 62.223 62.100 0.133 0.000 1.045 396 T CB -0.089 68.883 68.868 0.173 0.000 0.917 396 T HN -0.048 8.408 8.240 0.361 0.000 0.484 397 S N 6.317 122.060 115.700 0.071 0.000 2.537 397 S HA -0.120 4.541 4.470 0.318 0.000 0.286 397 S C 0.035 174.770 174.600 0.226 0.000 1.299 397 S CA 0.764 59.074 58.200 0.182 0.000 1.067 397 S CB 0.385 63.608 63.200 0.040 0.000 0.864 397 S HN 0.038 8.316 8.310 -0.053 0.000 0.494 398 H N 6.780 125.954 119.070 0.174 0.000 2.505 398 H HA 0.215 4.872 4.556 0.169 0.000 0.286 398 H C -0.152 175.279 175.328 0.171 0.000 1.072 398 H CA -1.013 55.147 56.048 0.187 0.000 1.141 398 H CB -0.021 29.876 29.762 0.225 0.000 1.550 398 H HN 0.061 8.642 8.280 0.502 0.000 0.547 399 S N 2.189 117.983 115.700 0.157 0.000 2.681 399 S HA 0.251 4.769 4.470 -0.006 -0.052 0.313 399 S C -0.734 173.865 174.600 -0.002 0.000 1.137 399 S CA -0.176 58.042 58.200 0.030 0.000 1.045 399 S CB -1.526 61.664 63.200 -0.018 0.000 1.208 399 S HN -0.724 7.620 8.310 0.150 0.057 0.523 400 Q N 5.927 125.721 119.800 -0.010 0.000 2.307 400 Q HA 0.103 4.678 4.340 -0.015 -0.244 0.261 400 Q C -0.422 175.472 176.000 -0.177 0.000 1.051 400 Q CA 0.371 56.131 55.803 -0.072 0.000 0.911 400 Q CB 0.225 28.928 28.738 -0.057 0.000 1.227 400 Q HN -0.192 8.097 8.270 0.032 0.000 0.418 401 R N -0.819 119.642 120.500 -0.065 0.000 2.747 401 R HA 0.346 4.608 4.340 -0.131 0.000 0.272 401 R C -1.268 175.092 176.300 0.100 0.000 1.032 401 R CA -1.695 54.368 56.100 -0.061 0.000 0.896 401 R CB 1.795 32.043 30.300 -0.088 0.000 1.253 401 R HN -0.643 7.640 8.270 0.022 0.000 0.461 402 T N 0.186 114.758 114.554 0.030 0.000 2.934 402 T HA 0.106 4.540 4.350 0.140 0.000 0.306 402 T C 0.762 175.439 174.700 -0.039 0.000 1.042 402 T CA -1.442 60.680 62.100 0.036 0.000 1.145 402 T CB 0.348 69.189 68.868 -0.045 0.000 0.982 402 T HN 0.596 8.815 8.240 -0.034 0.000 0.544 403 P HA -0.035 4.304 4.420 -0.135 0.000 0.228 403 P C 1.791 179.020 177.300 -0.118 0.000 1.151 403 P CA 1.649 64.654 63.100 -0.159 0.000 0.770 403 P CB 0.139 31.692 31.700 -0.245 0.000 0.786 404 R N -1.424 119.007 120.500 -0.116 0.000 2.159 404 R HA -0.238 4.042 4.340 -0.101 0.000 0.237 404 R C 1.505 177.762 176.300 -0.071 0.000 1.131 404 R CA 2.882 58.924 56.100 -0.097 0.000 0.982 404 R CB -0.438 29.804 30.300 -0.096 0.000 0.868 404 R HN -0.571 7.589 8.270 -0.122 0.037 0.453 405 D N -2.866 117.495 120.400 -0.066 0.000 2.355 405 D HA -0.004 4.607 4.640 -0.048 0.000 0.218 405 D C 0.373 176.648 176.300 -0.043 0.000 1.004 405 D CA 1.740 55.709 54.000 -0.052 0.000 0.880 405 D CB 0.822 41.590 40.800 -0.053 0.000 0.911 405 D HN -0.621 7.678 8.370 -0.070 0.029 0.528 406 M N -5.459 114.113 119.600 -0.048 0.000 4.389 406 M HA 0.374 4.836 4.480 -0.031 0.000 0.505 406 M C -0.808 175.470 176.300 -0.036 0.000 2.125 406 M CA -0.129 55.148 55.300 -0.039 0.000 0.468 406 M CB 0.666 33.242 32.600 -0.040 0.000 1.449 406 M HN -0.433 7.665 8.290 -0.057 0.157 0.568 407 M N 1.069 120.651 119.600 -0.031 0.000 2.213 407 M HA -0.179 4.284 4.480 -0.028 0.000 0.263 407 M C 2.093 178.399 176.300 0.010 0.000 1.062 407 M CA 3.444 58.733 55.300 -0.018 0.000 1.105 407 M CB -0.438 32.150 32.600 -0.021 0.000 1.385 407 M HN 0.195 8.465 8.290 -0.032 0.000 0.417 408 G N -3.057 105.748 108.800 0.007 0.000 2.422 408 G HA2 -0.329 3.651 3.960 0.034 0.000 0.218 408 G HA3 -0.329 3.638 3.960 0.012 0.000 0.218 408 G C 0.182 175.090 174.900 0.012 0.000 1.146 408 G CA 1.397 46.508 45.100 0.018 0.000 0.769 408 G HN 0.283 8.573 8.290 -0.001 0.000 0.547 409 Q N -1.701 118.095 119.800 -0.006 0.000 2.269 409 Q HA -0.121 4.389 4.340 -0.014 -0.179 0.201 409 Q C 0.076 176.068 176.000 -0.013 0.000 0.946 409 Q CA 1.460 57.253 55.803 -0.017 0.000 0.877 409 Q CB 0.762 29.478 28.738 -0.037 0.000 0.963 409 Q HN -0.668 7.594 8.270 -0.013 0.000 0.472 410 A N -2.818 119.995 122.820 -0.011 0.000 3.334 410 A HA 0.240 4.688 4.320 -0.023 -0.141 0.201 410 A C 1.412 179.024 177.584 0.047 0.000 2.125 410 A CA 0.141 52.169 52.037 -0.015 0.000 1.573 410 A CB 0.707 19.666 19.000 -0.068 0.000 1.197 410 A HN -0.490 7.653 8.150 -0.012 0.000 0.371 411 C N -0.328 119.017 119.300 0.074 0.000 2.398 411 C HA -0.313 4.314 4.460 0.277 0.000 0.276 411 C C 2.496 177.655 174.990 0.282 0.000 1.222 411 C CA 3.611 62.758 59.018 0.215 0.000 1.746 411 C CB -1.623 26.229 27.740 0.187 0.000 2.039 411 C HN 0.290 8.538 8.230 0.030 0.000 0.470 412 L N -3.183 118.153 121.223 0.188 0.000 2.395 412 L HA -0.203 4.304 4.340 0.279 0.000 0.218 412 L C 1.554 178.502 176.870 0.130 0.000 1.130 412 L CA 1.679 56.635 54.840 0.194 0.000 0.826 412 L CB -0.909 41.233 42.059 0.139 0.000 0.941 412 L HN 0.093 8.401 8.230 0.130 0.000 0.451 413 N N -1.829 116.925 118.700 0.090 0.000 2.309 413 N HA -0.188 4.576 4.740 0.040 0.000 0.182 413 N C 0.640 176.168 175.510 0.031 0.000 1.018 413 N CA 2.529 55.608 53.050 0.048 0.000 0.876 413 N CB 0.116 38.619 38.487 0.027 0.000 0.972 413 N HN -0.495 7.907 8.380 0.087 0.030 0.434 414 C N -3.154 116.169 119.300 0.037 0.000 2.609 414 C HA 0.108 4.523 4.460 -0.074 0.000 0.305 414 C C 0.374 175.259 174.990 -0.175 0.000 1.319 414 C CA 0.176 59.148 59.018 -0.076 0.000 1.793 414 C CB 0.859 28.531 27.740 -0.114 0.000 2.260 414 C HN -0.673 7.593 8.230 0.091 0.019 0.535 415 H N 1.269 120.377 119.070 0.064 0.000 2.556 415 H HA 0.226 4.840 4.556 -0.087 -0.110 0.240 415 H C -0.486 174.864 175.328 0.036 0.000 1.543 415 H CA -0.819 55.233 56.048 0.007 0.000 1.287 415 H CB -1.843 27.980 29.762 0.101 0.000 1.529 415 H HN -0.198 8.223 8.280 0.234 0.000 0.553 416 A N 3.630 126.482 122.820 0.053 0.000 2.070 416 A HA -0.192 4.176 4.320 0.080 0.000 0.220 416 A C 0.563 178.182 177.584 0.058 0.000 1.159 416 A CA 2.378 54.447 52.037 0.053 0.000 0.656 416 A CB 0.135 19.141 19.000 0.009 0.000 0.800 416 A HN -0.084 8.060 8.150 -0.010 0.000 0.453 417 E N -4.886 115.319 120.200 0.008 0.000 2.481 417 E HA -0.153 4.204 4.350 0.012 0.000 0.195 417 E C -0.247 176.426 176.600 0.121 0.000 1.047 417 E CA 0.123 56.515 56.400 -0.013 0.000 0.867 417 E CB -0.146 29.461 29.700 -0.155 0.000 0.858 417 E HN 0.122 8.414 8.360 -0.038 0.045 0.513 418 W N -0.695 120.647 121.300 0.068 0.000 2.689 418 W HA 0.277 5.144 4.660 0.029 -0.190 0.340 418 W C 0.343 176.881 176.519 0.031 0.000 1.060 418 W CA -2.428 54.944 57.345 0.045 0.000 1.218 418 W CB 1.731 31.219 29.460 0.047 0.000 1.410 418 W HN -0.785 7.519 8.180 0.305 0.058 0.528 419 T N -0.699 113.987 114.554 0.221 0.000 2.816 419 T HA 0.277 4.687 4.350 0.100 0.000 0.282 419 T C 0.717 175.438 174.700 0.034 0.000 0.993 419 T CA -1.288 60.868 62.100 0.093 0.000 0.994 419 T CB 1.957 70.843 68.868 0.029 0.000 1.025 419 T HN 0.108 8.765 8.240 0.202 -0.296 0.529 420 E N 0.739 120.945 120.200 0.009 0.000 2.058 420 E HA -0.406 3.933 4.350 -0.019 0.000 0.194 420 E C 1.822 178.367 176.600 -0.090 0.000 0.997 420 E CA 4.159 60.541 56.400 -0.029 0.000 0.801 420 E CB -0.123 29.566 29.700 -0.019 0.000 0.746 420 E HN 0.569 8.940 8.360 0.018 0.000 0.450 421 D N -2.567 117.781 120.400 -0.088 0.000 2.144 421 D HA -0.230 4.356 4.640 -0.090 0.000 0.199 421 D C 2.694 178.882 176.300 -0.186 0.000 0.984 421 D CA 3.193 57.127 54.000 -0.111 0.000 0.834 421 D CB -0.684 40.059 40.800 -0.096 0.000 0.955 421 D HN 0.148 8.479 8.370 -0.065 0.000 0.465 422 Q N -0.364 119.278 119.800 -0.264 0.000 2.079 422 Q HA -0.290 3.809 4.340 -0.401 0.000 0.200 422 Q C 2.326 177.817 176.000 -0.848 0.000 0.974 422 Q CA 2.949 58.459 55.803 -0.489 0.000 0.840 422 Q CB -0.017 28.431 28.738 -0.482 0.000 0.898 422 Q HN -0.588 7.561 8.270 -0.201 0.000 0.430 423 A N 0.058 122.399 122.820 -0.798 0.000 1.898 423 A HA -0.233 3.131 4.320 -1.595 0.000 0.216 423 A C 2.115 179.427 177.584 -0.453 0.000 1.181 423 A CA 3.050 54.582 52.037 -0.841 0.000 0.620 423 A CB -0.737 18.093 19.000 -0.283 0.000 0.819 423 A HN -0.395 7.449 8.150 -0.509 0.000 0.442 424 L N -2.334 118.732 121.223 -0.262 0.000 2.046 424 L HA -0.438 3.801 4.340 -0.168 0.000 0.208 424 L C 2.037 178.858 176.870 -0.083 0.000 1.077 424 L CA 3.156 57.904 54.840 -0.153 0.000 0.747 424 L CB -0.388 41.614 42.059 -0.094 0.000 0.896 424 L HN -0.266 7.823 8.230 -0.235 0.000 0.432 425 Y N -0.218 119.944 120.300 -0.231 0.000 2.181 425 Y HA -0.499 4.002 4.550 -0.081 0.000 0.288 425 Y C 1.179 177.021 175.900 -0.097 0.000 1.146 425 Y CA 3.659 61.673 58.100 -0.143 0.000 1.164 425 Y CB -0.153 38.213 38.460 -0.157 0.000 0.982 425 Y HN -0.358 7.904 8.280 -0.029 0.000 0.515 426 A N -0.699 122.059 122.820 -0.103 0.000 1.902 426 A HA -0.363 3.945 4.320 -0.020 0.000 0.217 426 A C 2.039 179.670 177.584 0.078 0.000 1.181 426 A CA 3.085 55.081 52.037 -0.068 0.000 0.623 426 A CB -1.012 17.862 19.000 -0.210 0.000 0.818 426 A HN -0.410 7.588 8.150 -0.254 0.000 0.443 427 I N -1.867 118.709 120.570 0.011 0.000 2.163 427 I HA -0.637 3.684 4.170 0.251 0.000 0.243 427 I C 1.706 177.869 176.117 0.077 0.000 1.085 427 I CA 4.343 65.668 61.300 0.041 0.000 1.347 427 I CB -0.377 37.478 38.000 -0.240 0.000 1.044 427 I HN -0.459 7.692 8.210 -0.098 0.000 0.408 428 D N -1.012 119.384 120.400 -0.006 0.000 2.178 428 D HA -0.272 4.363 4.640 -0.009 0.000 0.202 428 D C 2.494 178.792 176.300 -0.003 0.000 0.974 428 D CA 3.325 57.312 54.000 -0.022 0.000 0.841 428 D CB -0.353 40.409 40.800 -0.064 0.000 0.953 428 D HN -0.338 8.008 8.370 -0.041 0.000 0.478 429 Y N 1.440 121.650 120.300 -0.150 0.000 2.097 429 Y HA -0.446 4.011 4.550 -0.155 0.000 0.282 429 Y C 1.795 177.707 175.900 0.020 0.000 1.152 429 Y CA 4.126 62.151 58.100 -0.126 0.000 1.136 429 Y CB -0.013 38.340 38.460 -0.179 0.000 0.975 429 Y HN -0.279 8.028 8.280 0.046 0.000 0.498 430 I N -1.790 118.983 120.570 0.339 0.000 2.179 430 I HA -0.656 3.720 4.170 0.344 0.000 0.242 430 I C 1.989 178.248 176.117 0.237 0.000 1.088 430 I CA 4.300 65.786 61.300 0.309 0.000 1.357 430 I CB -0.185 38.002 38.000 0.312 0.000 1.051 430 I HN -0.711 7.697 8.210 0.330 0.000 0.409 431 K N 0.007 120.518 120.400 0.184 0.000 2.097 431 K HA -0.178 4.469 4.320 0.154 -0.235 0.205 431 K C 2.851 179.515 176.600 0.107 0.000 1.050 431 K CA 3.189 59.556 56.287 0.133 0.000 0.938 431 K CB -0.255 32.289 32.500 0.074 0.000 0.718 431 K HN -0.205 8.152 8.250 0.179 0.000 0.442 432 N N -0.012 118.726 118.700 0.062 0.000 2.120 432 N HA -0.271 4.504 4.740 0.059 0.000 0.188 432 N C 1.970 177.518 175.510 0.063 0.000 1.024 432 N CA 2.907 55.980 53.050 0.038 0.000 0.852 432 N CB -0.377 38.080 38.487 -0.050 0.000 1.003 432 N HN 0.010 8.415 8.380 0.042 0.000 0.424 433 Y N 1.167 121.426 120.300 -0.070 0.000 2.145 433 Y HA -0.336 4.159 4.550 -0.091 0.000 0.286 433 Y C 1.760 177.657 175.900 -0.005 0.000 1.145 433 Y CA 4.168 62.228 58.100 -0.067 0.000 1.148 433 Y CB 0.118 38.533 38.460 -0.076 0.000 0.981 433 Y HN -0.280 8.086 8.280 0.143 0.000 0.507 434 T N 1.980 116.535 114.554 0.001 0.000 2.737 434 T HA -0.388 3.831 4.350 -0.219 0.000 0.265 434 T C 1.462 176.142 174.700 -0.034 0.000 1.038 434 T CA 5.373 67.429 62.100 -0.074 0.000 1.144 434 T CB -0.508 68.386 68.868 0.045 0.000 0.866 434 T HN -0.101 8.225 8.240 0.144 0.000 0.434 435 H N 2.966 122.018 119.070 -0.031 0.000 2.387 435 H HA -0.354 4.228 4.556 0.043 0.000 0.299 435 H C 1.696 177.011 175.328 -0.022 0.000 1.090 435 H CA 3.862 59.913 56.048 0.005 0.000 1.332 435 H CB -0.256 29.516 29.762 0.016 0.000 1.386 435 H HN 0.133 8.525 8.280 0.186 0.000 0.516 436 G N -1.714 107.020 108.800 -0.110 0.000 2.440 436 G HA2 -0.396 3.466 3.960 -0.164 0.000 0.218 436 G HA3 -0.396 3.475 3.960 -0.149 0.000 0.218 436 G C 1.313 176.096 174.900 -0.195 0.000 1.154 436 G CA 2.090 47.088 45.100 -0.169 0.000 0.767 436 G HN -0.085 8.179 8.290 -0.042 0.000 0.552 437 K N 1.716 121.966 120.400 -0.250 0.000 2.155 437 K HA -0.147 4.091 4.320 -0.137 0.000 0.203 437 K C 2.492 179.074 176.600 -0.030 0.000 1.052 437 K CA 1.441 57.622 56.287 -0.178 0.000 0.948 437 K CB -0.562 31.762 32.500 -0.294 0.000 0.728 437 K HN -0.711 7.265 8.250 -0.321 0.082 0.448 438 I N 0.737 121.301 120.570 -0.009 0.000 2.163 438 I HA -0.495 3.865 4.170 0.318 0.000 0.243 438 I C 1.678 177.854 176.117 0.098 0.000 1.085 438 I CA 4.472 65.866 61.300 0.157 0.000 1.347 438 I CB -0.157 37.943 38.000 0.167 0.000 1.044 438 I HN -0.088 8.086 8.210 -0.060 0.000 0.408 439 V N -0.294 119.560 119.914 -0.102 0.000 2.343 439 V HA -0.541 3.551 4.120 -0.048 0.000 0.247 439 V C 2.030 178.129 176.094 0.009 0.000 1.051 439 V CA 4.922 67.168 62.300 -0.090 0.000 1.036 439 V CB -1.049 30.652 31.823 -0.203 0.000 0.654 439 V HN -0.078 7.975 8.190 -0.228 0.000 0.451 440 K N -1.398 119.020 120.400 0.030 0.000 2.097 440 K HA -0.391 4.011 4.320 0.136 0.000 0.205 440 K C 2.381 179.149 176.600 0.280 0.000 1.050 440 K CA 3.726 60.102 56.287 0.148 0.000 0.938 440 K CB -0.369 32.211 32.500 0.133 0.000 0.718 440 K HN -0.207 8.035 8.250 -0.013 0.000 0.442 441 S N 0.727 116.545 115.700 0.197 0.000 2.382 441 S HA -0.260 4.365 4.470 0.259 0.000 0.228 441 S C 2.134 176.737 174.600 0.005 0.000 1.027 441 S CA 3.980 62.295 58.200 0.192 0.000 0.991 441 S CB -0.657 62.703 63.200 0.267 0.000 0.823 441 S HN -0.020 8.384 8.310 0.157 0.000 0.469 442 E N 1.767 121.893 120.200 -0.124 0.000 2.106 442 E HA -0.405 3.593 4.350 -0.586 0.000 0.192 442 E C 1.936 178.434 176.600 -0.170 0.000 0.984 442 E CA 2.894 59.105 56.400 -0.315 0.000 0.806 442 E CB -0.071 29.493 29.700 -0.227 0.000 0.750 442 E HN -0.266 8.072 8.360 -0.036 0.000 0.458 443 Y N 2.181 122.380 120.300 -0.167 0.000 2.081 443 Y HA -0.358 4.046 4.550 -0.243 0.000 0.280 443 Y C 1.735 177.445 175.900 -0.317 0.000 1.163 443 Y CA 3.381 61.324 58.100 -0.262 0.000 1.135 443 Y CB -0.005 38.261 38.460 -0.323 0.000 0.970 443 Y HN -0.257 8.086 8.280 0.105 0.000 0.498 444 W N -3.211 118.010 121.300 -0.132 0.000 2.418 444 W HA -0.334 4.152 4.660 -0.290 0.000 0.292 444 W C 2.231 178.615 176.519 -0.226 0.000 1.213 444 W CA 3.894 61.133 57.345 -0.177 0.000 1.283 444 W CB 0.155 29.616 29.460 0.001 0.000 1.119 444 W HN -0.468 7.837 8.180 0.208 0.000 0.542 445 L N -0.895 120.306 121.223 -0.036 0.000 2.042 445 L HA -0.432 3.835 4.340 -0.121 0.000 0.210 445 L C 2.252 178.975 176.870 -0.245 0.000 1.076 445 L CA 3.198 57.938 54.840 -0.168 0.000 0.749 445 L CB -0.195 41.690 42.059 -0.290 0.000 0.893 445 L HN 0.008 8.222 8.230 -0.026 0.000 0.432 446 A N -1.904 120.744 122.820 -0.287 0.000 1.933 446 A HA -0.373 3.815 4.320 -0.220 0.000 0.218 446 A C 1.416 178.832 177.584 -0.280 0.000 1.175 446 A CA 3.279 55.155 52.037 -0.268 0.000 0.628 446 A CB -0.922 17.920 19.000 -0.263 0.000 0.814 446 A HN 0.109 8.077 8.150 -0.304 0.000 0.444 447 K N -0.888 119.272 120.400 -0.400 0.000 2.057 447 K HA -0.329 3.779 4.320 -0.354 0.000 0.207 447 K C 1.980 178.483 176.600 -0.162 0.000 1.049 447 K CA 3.043 59.110 56.287 -0.367 0.000 0.931 447 K CB -0.088 32.061 32.500 -0.585 0.000 0.714 447 K HN -0.514 7.435 8.250 -0.502 0.000 0.440 448 M N -0.501 119.038 119.600 -0.101 0.000 2.086 448 M HA -0.354 4.124 4.480 -0.002 0.000 0.261 448 M C 2.440 178.758 176.300 0.029 0.000 1.067 448 M CA 3.718 59.003 55.300 -0.024 0.000 1.116 448 M CB 0.032 32.619 32.600 -0.021 0.000 1.348 448 M HN -0.571 7.656 8.290 -0.106 0.000 0.407 449 I N -0.546 119.968 120.570 -0.093 0.000 2.208 449 I HA -0.565 3.552 4.170 -0.089 0.000 0.245 449 I C 1.789 177.939 176.117 0.054 0.000 1.097 449 I CA 3.909 65.157 61.300 -0.086 0.000 1.363 449 I CB -0.347 37.522 38.000 -0.219 0.000 1.051 449 I HN 0.006 8.110 8.210 -0.176 0.000 0.413 450 D N -0.758 119.634 120.400 -0.012 0.000 2.310 450 D HA -0.162 4.488 4.640 0.016 0.000 0.212 450 D C 2.013 178.325 176.300 0.020 0.000 0.965 450 D CA 2.964 56.961 54.000 -0.004 0.000 0.879 450 D CB -0.558 40.206 40.800 -0.059 0.000 0.921 450 D HN -0.226 8.105 8.370 -0.066 0.000 0.510 451 L N -1.505 119.731 121.223 0.022 0.000 2.313 451 L HA -0.234 4.087 4.340 -0.033 0.000 0.214 451 L C 1.221 178.077 176.870 -0.024 0.000 1.119 451 L CA 1.503 56.328 54.840 -0.026 0.000 0.809 451 L CB -0.185 41.822 42.059 -0.086 0.000 0.933 451 L HN -0.622 7.484 8.230 0.025 0.139 0.449 452 F N -0.073 119.847 119.950 -0.051 0.000 2.102 452 F HA -0.253 4.256 4.527 -0.030 0.000 0.298 452 F C -1.088 174.703 175.800 -0.015 0.000 1.105 452 F CA 6.579 64.560 58.000 -0.031 0.000 1.239 452 F CB -3.207 35.778 39.000 -0.026 0.000 0.991 452 F HN -0.474 7.899 8.300 0.346 0.135 0.474 453 P HA -0.271 4.206 4.420 0.095 0.000 0.217 453 P C 0.812 178.135 177.300 0.038 0.000 1.150 453 P CA 3.103 66.255 63.100 0.087 0.000 0.832 453 P CB -0.515 31.225 31.700 0.067 0.000 0.787 454 V N -2.404 117.520 119.914 0.016 0.000 2.295 454 V HA -0.432 3.685 4.120 -0.004 0.000 0.246 454 V C 1.950 178.029 176.094 -0.026 0.000 1.049 454 V CA 4.308 66.602 62.300 -0.009 0.000 1.024 454 V CB -1.053 30.757 31.823 -0.022 0.000 0.648 454 V HN -0.560 7.643 8.190 0.021 0.000 0.447 455 A N -1.395 121.392 122.820 -0.054 0.000 1.902 455 A HA -0.449 3.825 4.320 -0.076 0.000 0.217 455 A C 1.710 179.268 177.584 -0.043 0.000 1.181 455 A CA 3.753 55.740 52.037 -0.082 0.000 0.623 455 A CB -0.691 18.200 19.000 -0.181 0.000 0.818 455 A HN 0.277 8.388 8.150 -0.065 0.000 0.443 456 K N -1.693 118.702 120.400 -0.008 0.000 2.032 456 K HA -0.262 4.064 4.320 0.011 0.000 0.209 456 K C 3.657 180.262 176.600 0.007 0.000 1.048 456 K CA 2.799 59.095 56.287 0.016 0.000 0.927 456 K CB -0.611 31.919 32.500 0.050 0.000 0.712 456 K HN -0.222 8.031 8.250 0.007 0.000 0.441 457 R N -1.204 119.300 120.500 0.007 0.000 2.152 457 R HA -0.224 4.119 4.340 0.006 0.000 0.232 457 R C 2.006 178.304 176.300 -0.005 0.000 1.117 457 R CA 2.437 58.539 56.100 0.003 0.000 0.981 457 R CB -0.224 30.078 30.300 0.003 0.000 0.870 457 R HN -0.093 8.183 8.270 0.009 0.000 0.451 458 A N -3.681 119.131 122.820 -0.012 0.000 2.169 458 A HA 0.092 4.404 4.320 -0.013 0.000 0.212 458 A C -0.132 177.443 177.584 -0.016 0.000 1.153 458 A CA 0.089 52.116 52.037 -0.017 0.000 0.756 458 A CB 0.146 19.131 19.000 -0.025 0.000 0.813 458 A HN -0.330 7.685 8.150 -0.016 0.126 0.471 459 G N -2.343 106.448 108.800 -0.014 0.000 2.137 459 G HA2 -0.368 3.587 3.960 -0.008 0.000 0.237 459 G HA3 -0.368 3.586 3.960 -0.011 0.000 0.237 459 G C -0.380 174.508 174.900 -0.019 0.000 1.002 459 G CA -0.048 45.045 45.100 -0.012 0.000 0.702 459 G HN -0.668 7.459 8.290 -0.012 0.156 0.515 460 V N -0.182 119.714 119.914 -0.031 0.000 2.788 460 V HA -0.128 3.969 4.120 -0.039 0.000 0.307 460 V C 0.194 176.268 176.094 -0.032 0.000 1.069 460 V CA 0.838 63.113 62.300 -0.043 0.000 1.173 460 V CB 0.491 32.269 31.823 -0.075 0.000 0.925 460 V HN -0.542 7.628 8.190 -0.034 0.000 0.492 461 S N 4.580 120.262 115.700 -0.029 0.000 2.579 461 S HA -0.017 4.446 4.470 -0.012 0.000 0.275 461 S C 1.286 175.878 174.600 -0.014 0.000 1.345 461 S CA -0.339 57.850 58.200 -0.018 0.000 1.031 461 S CB 1.141 64.331 63.200 -0.016 0.000 0.892 461 S HN -0.198 8.093 8.310 -0.033 0.000 0.529 462 E N 2.469 122.668 120.200 -0.001 0.000 2.153 462 E HA -0.374 3.987 4.350 0.019 0.000 0.194 462 E C 1.519 178.124 176.600 0.008 0.000 0.988 462 E CA 3.595 60.001 56.400 0.011 0.000 0.811 462 E CB -0.427 29.281 29.700 0.013 0.000 0.746 462 E HN 0.714 9.074 8.360 0.000 0.000 0.466 463 D N -2.130 118.270 120.400 -0.000 0.000 2.097 463 D HA -0.229 4.413 4.640 0.003 0.000 0.195 463 D C 2.516 178.813 176.300 -0.005 0.000 0.989 463 D CA 3.142 57.142 54.000 -0.001 0.000 0.827 463 D CB -0.556 40.241 40.800 -0.004 0.000 0.966 463 D HN 0.128 8.482 8.370 -0.003 0.014 0.456 464 V N 0.381 120.283 119.914 -0.020 0.000 2.358 464 V HA -0.345 3.756 4.120 -0.031 0.000 0.246 464 V C 1.948 178.013 176.094 -0.048 0.000 1.047 464 V CA 4.187 66.463 62.300 -0.039 0.000 1.035 464 V CB -0.484 31.303 31.823 -0.060 0.000 0.658 464 V HN -0.542 7.635 8.190 -0.022 0.000 0.452 465 L N -1.461 119.739 121.223 -0.039 0.000 2.042 465 L HA -0.526 3.747 4.340 -0.112 0.000 0.210 465 L C 2.104 179.044 176.870 0.117 0.000 1.076 465 L CA 3.387 58.230 54.840 0.005 0.000 0.749 465 L CB -0.942 41.159 42.059 0.070 0.000 0.893 465 L HN -0.184 8.027 8.230 -0.032 0.000 0.432 466 N N -1.793 116.949 118.700 0.069 0.000 2.188 466 N HA -0.307 4.482 4.740 0.082 0.000 0.184 466 N C 2.513 178.058 175.510 0.058 0.000 1.018 466 N CA 2.861 55.949 53.050 0.062 0.000 0.858 466 N CB -0.409 38.093 38.487 0.026 0.000 0.989 466 N HN 0.009 8.414 8.380 0.043 0.000 0.426 467 Q N 0.385 120.208 119.800 0.039 0.000 2.050 467 Q HA -0.313 4.047 4.340 0.033 0.000 0.202 467 Q C 2.155 178.197 176.000 0.069 0.000 0.980 467 Q CA 3.226 59.051 55.803 0.036 0.000 0.840 467 Q CB -0.085 28.661 28.738 0.012 0.000 0.898 467 Q HN -0.287 7.998 8.270 0.024 0.000 0.424 468 A N -0.667 122.201 122.820 0.079 0.000 1.933 468 A HA -0.377 4.007 4.320 0.108 0.000 0.218 468 A C 1.858 179.630 177.584 0.313 0.000 1.175 468 A CA 3.061 55.187 52.037 0.148 0.000 0.628 468 A CB -0.641 18.355 19.000 -0.006 0.000 0.814 468 A HN -0.074 8.103 8.150 0.045 0.000 0.444 469 R N -2.254 118.437 120.500 0.319 0.000 2.096 469 R HA -0.340 4.149 4.340 0.249 0.000 0.235 469 R C 2.607 178.986 176.300 0.132 0.000 1.127 469 R CA 3.653 59.880 56.100 0.212 0.000 0.968 469 R CB -0.176 30.184 30.300 0.100 0.000 0.861 469 R HN -0.027 8.415 8.270 0.287 0.000 0.440 470 E N -0.829 119.431 120.200 0.099 0.000 2.106 470 E HA -0.261 4.115 4.350 0.043 0.000 0.192 470 E C 2.259 178.945 176.600 0.144 0.000 0.984 470 E CA 2.482 58.928 56.400 0.075 0.000 0.806 470 E CB -0.319 29.403 29.700 0.036 0.000 0.750 470 E HN -0.563 7.853 8.360 0.093 0.000 0.458 471 L N -1.330 119.988 121.223 0.159 0.000 2.083 471 L HA -0.361 4.087 4.340 0.178 0.000 0.209 471 L C 1.605 178.625 176.870 0.251 0.000 1.083 471 L CA 3.077 58.027 54.840 0.183 0.000 0.752 471 L CB -0.363 41.782 42.059 0.142 0.000 0.899 471 L HN -0.553 7.764 8.230 0.144 0.000 0.433 472 H N 0.478 119.619 119.070 0.117 0.000 2.352 472 H HA -0.439 4.162 4.556 0.076 0.000 0.299 472 H C 2.081 177.459 175.328 0.084 0.000 1.097 472 H CA 2.990 59.077 56.048 0.065 0.000 1.311 472 H CB 0.520 30.251 29.762 -0.052 0.000 1.377 472 H HN -0.128 8.261 8.280 0.315 0.080 0.504 473 Y N -0.072 120.235 120.300 0.012 0.000 2.081 473 Y HA -0.516 3.923 4.550 -0.185 0.000 0.280 473 Y C 1.545 177.470 175.900 0.041 0.000 1.163 473 Y CA 4.200 62.258 58.100 -0.071 0.000 1.135 473 Y CB -0.296 38.107 38.460 -0.094 0.000 0.970 473 Y HN -0.438 7.983 8.280 0.236 0.000 0.498 474 D N -2.168 118.435 120.400 0.339 0.000 2.097 474 D HA -0.346 4.366 4.640 0.121 0.000 0.197 474 D C 2.171 178.631 176.300 0.267 0.000 0.984 474 D CA 3.354 57.517 54.000 0.271 0.000 0.826 474 D CB -0.841 40.207 40.800 0.413 0.000 0.973 474 D HN -0.506 8.083 8.370 0.364 0.000 0.460 475 A N -0.310 122.699 122.820 0.314 0.000 1.908 475 A HA -0.376 4.154 4.320 0.351 0.000 0.218 475 A C 1.590 179.386 177.584 0.353 0.000 1.181 475 A CA 3.059 55.291 52.037 0.325 0.000 0.627 475 A CB -0.563 18.591 19.000 0.257 0.000 0.818 475 A HN -0.028 8.304 8.150 0.304 0.000 0.445 476 H N -0.189 119.025 119.070 0.241 0.000 2.299 476 H HA -0.314 4.555 4.556 0.522 0.000 0.302 476 H C 2.061 177.474 175.328 0.141 0.000 1.078 476 H CA 4.091 60.307 56.048 0.280 0.000 1.323 476 H CB 0.523 30.312 29.762 0.046 0.000 1.381 476 H HN -0.211 8.303 8.280 0.394 0.003 0.498 477 L N -0.251 120.953 121.223 -0.031 0.000 2.013 477 L HA -0.389 3.820 4.340 -0.218 0.000 0.212 477 L C 1.390 178.121 176.870 -0.231 0.000 1.073 477 L CA 3.152 57.824 54.840 -0.281 0.000 0.753 477 L CB -0.406 41.316 42.059 -0.563 0.000 0.890 477 L HN -0.246 7.941 8.230 -0.071 0.000 0.432 478 Y N -5.701 114.687 120.300 0.147 0.000 2.561 478 Y HA -0.038 4.590 4.550 0.131 0.000 0.291 478 Y C 1.731 177.851 175.900 0.368 0.000 1.141 478 Y CA 1.371 59.594 58.100 0.206 0.000 1.303 478 Y CB -0.781 37.815 38.460 0.226 0.000 1.015 478 Y HN -0.260 7.979 8.280 -0.067 0.000 0.547 479 W N 0.611 122.054 121.300 0.239 0.000 2.633 479 W HA -0.132 4.732 4.660 0.339 0.000 0.295 479 W C 0.942 177.548 176.519 0.146 0.000 1.133 479 W CA 2.125 59.602 57.345 0.221 0.000 1.490 479 W CB 1.005 30.524 29.460 0.098 0.000 1.127 479 W HN -0.587 7.821 8.180 0.434 0.032 0.538 480 E N 2.417 122.139 120.200 -0.797 0.000 2.204 480 E HA -0.330 2.698 4.350 -2.205 0.000 0.194 480 E C 1.931 178.066 176.600 -0.776 0.000 0.989 480 E CA 2.646 58.218 56.400 -1.381 0.000 0.824 480 E CB -0.003 28.970 29.700 -1.211 0.000 0.756 480 E HN 0.169 8.270 8.360 -0.433 0.000 0.477 481 W N -0.309 120.509 121.300 -0.804 0.000 2.305 481 W HA -0.390 3.755 4.660 -0.858 0.000 0.308 481 W C 1.841 177.715 176.519 -1.075 0.000 1.226 481 W CA 3.615 60.360 57.345 -1.000 0.000 1.253 481 W CB -0.042 28.693 29.460 -1.208 0.000 1.146 481 W HN -0.603 7.384 8.180 -0.302 0.012 0.507 482 W N -6.308 114.937 121.300 -0.092 0.000 2.812 482 W HA -0.227 4.446 4.660 0.022 0.000 0.263 482 W C 0.948 177.384 176.519 -0.138 0.000 1.284 482 W CA 2.077 59.392 57.345 -0.051 0.000 1.430 482 W CB 0.179 29.657 29.460 0.030 0.000 1.088 482 W HN -0.340 7.591 8.180 -0.372 0.025 0.623 483 T N -4.476 109.958 114.554 -0.200 0.000 2.942 483 T HA -0.076 4.254 4.350 -0.033 0.000 0.265 483 T C 1.079 175.658 174.700 -0.201 0.000 1.062 483 T CA 1.768 63.764 62.100 -0.174 0.000 1.139 483 T CB -0.155 68.564 68.868 -0.247 0.000 0.883 483 T HN -0.815 7.171 8.240 -0.424 0.000 0.468 484 A N 2.404 125.024 122.820 -0.333 0.000 1.897 484 A HA -0.143 4.081 4.320 -0.160 0.000 0.215 484 A C 0.658 178.102 177.584 -0.232 0.000 1.181 484 A CA 1.311 53.168 52.037 -0.301 0.000 0.620 484 A CB 0.278 18.963 19.000 -0.525 0.000 0.821 484 A HN -0.277 7.599 8.150 -0.457 0.000 0.443 485 E N -1.828 118.191 120.200 -0.301 0.000 2.338 485 E HA -0.047 4.363 4.350 -0.165 -0.158 0.272 485 E C 0.611 177.206 176.600 -0.009 0.000 1.029 485 E CA -0.291 56.002 56.400 -0.179 0.000 0.872 485 E CB 0.621 30.161 29.700 -0.267 0.000 1.015 485 E HN -0.595 7.539 8.360 -0.378 0.000 0.417 486 N N 6.195 124.916 118.700 0.036 0.000 2.412 486 N HA -0.007 4.740 4.740 0.011 0.000 0.184 486 N C 0.576 176.073 175.510 -0.022 0.000 1.101 486 N CA 1.954 55.017 53.050 0.022 0.000 0.881 486 N CB 0.642 39.156 38.487 0.044 0.000 0.969 486 N HN 0.293 8.981 8.380 0.070 -0.266 0.459 487 S N -1.542 114.112 115.700 -0.077 0.000 2.593 487 S HA 0.125 4.489 4.470 -0.177 0.000 0.217 487 S C 0.638 175.255 174.600 0.028 0.000 0.966 487 S CA 0.271 58.360 58.200 -0.184 0.000 0.914 487 S CB 0.607 63.371 63.200 -0.727 0.000 0.776 487 S HN -0.351 8.216 8.310 -0.037 -0.279 0.523 488 V N 0.645 120.623 119.914 0.108 0.000 5.691 488 V HA -0.434 3.815 4.120 0.214 0.000 0.288 488 V C 0.382 176.593 176.094 0.196 0.000 0.615 488 V CA 0.367 62.768 62.300 0.168 0.000 0.619 488 V CB -3.073 28.819 31.823 0.116 0.000 0.296 488 V HN -0.383 7.822 8.190 0.110 0.051 0.834 489 G N -1.411 107.542 108.800 0.255 0.000 2.253 489 G HA2 -0.506 3.580 3.960 0.210 0.000 0.251 489 G HA3 -0.506 3.531 3.960 0.128 0.000 0.251 489 G C 0.682 175.709 174.900 0.212 0.000 0.998 489 G CA 0.862 46.083 45.100 0.201 0.000 0.621 489 G HN -0.035 8.455 8.290 0.333 0.000 0.524 490 F N 2.299 122.306 119.950 0.096 0.000 2.161 490 F HA -0.419 4.202 4.527 0.156 0.000 0.300 490 F C 0.739 176.705 175.800 0.276 0.000 1.089 490 F CA 3.422 61.500 58.000 0.129 0.000 1.282 490 F CB 0.260 39.293 39.000 0.056 0.000 1.010 490 F HN -0.703 7.617 8.300 0.297 0.159 0.485 491 H N -5.111 114.153 119.070 0.323 0.000 2.456 491 H HA -0.280 4.514 4.556 0.397 0.000 0.296 491 H C -0.535 174.960 175.328 0.278 0.000 1.079 491 H CA 2.176 58.438 56.048 0.355 0.000 1.322 491 H CB 0.888 30.893 29.762 0.404 0.000 1.388 491 H HN -0.507 7.910 8.280 0.244 0.010 0.538 492 N N -4.253 114.641 118.700 0.323 0.000 2.824 492 N HA 0.292 5.115 4.740 0.138 0.000 0.224 492 N C -2.564 173.008 175.510 0.103 0.000 1.418 492 N CA -1.818 51.358 53.050 0.211 0.000 0.743 492 N CB -0.071 38.596 38.487 0.300 0.000 1.395 492 N HN -0.756 7.800 8.380 0.322 0.017 0.548 493 P HA 0.006 4.520 4.420 0.008 -0.089 0.217 493 P C 0.903 178.195 177.300 -0.013 0.000 1.150 493 P CA 2.335 65.438 63.100 0.006 0.000 0.832 493 P CB 0.604 32.309 31.700 0.009 0.000 0.787 494 D N -1.589 118.811 120.400 -0.000 0.000 2.144 494 D HA -0.233 4.412 4.640 0.007 0.000 0.200 494 D C 2.074 178.382 176.300 0.013 0.000 0.978 494 D CA 3.468 57.472 54.000 0.006 0.000 0.833 494 D CB -0.700 40.105 40.800 0.009 0.000 0.961 494 D HN 0.144 8.516 8.370 0.004 0.000 0.470 495 Q N 1.014 120.836 119.800 0.037 0.000 2.083 495 Q HA -0.317 4.148 4.340 0.207 0.000 0.198 495 Q C 1.999 177.894 176.000 -0.175 0.000 0.969 495 Q CA 2.960 58.822 55.803 0.100 0.000 0.838 495 Q CB 0.041 28.914 28.738 0.225 0.000 0.900 495 Q HN -0.705 7.799 8.270 0.053 -0.202 0.436 496 A N -0.176 122.279 122.820 -0.608 0.000 1.883 496 A HA -0.441 2.214 4.320 -2.776 0.000 0.217 496 A C 1.486 178.651 177.584 -0.699 0.000 1.186 496 A CA 3.513 54.678 52.037 -1.453 0.000 0.624 496 A CB -0.865 17.446 19.000 -1.150 0.000 0.822 496 A HN -0.269 7.631 8.150 -0.416 0.000 0.444 497 R N -1.573 118.759 120.500 -0.279 0.000 2.073 497 R HA -0.370 3.914 4.340 -0.093 0.000 0.234 497 R C 1.803 178.074 176.300 -0.047 0.000 1.134 497 R CA 3.530 59.585 56.100 -0.076 0.000 0.952 497 R CB -0.125 30.237 30.300 0.102 0.000 0.850 497 R HN -0.402 7.745 8.270 -0.205 0.000 0.433 498 E N -1.504 118.698 120.200 0.003 0.000 2.077 498 E HA -0.323 4.040 4.350 0.022 0.000 0.193 498 E C 2.258 178.940 176.600 0.137 0.000 0.989 498 E CA 3.221 59.663 56.400 0.069 0.000 0.800 498 E CB -0.092 29.678 29.700 0.116 0.000 0.746 498 E HN -0.499 7.865 8.360 0.006 0.000 0.452 499 S N 0.740 116.550 115.700 0.183 0.000 2.356 499 S HA -0.172 4.460 4.470 0.271 0.000 0.223 499 S C 2.223 176.917 174.600 0.156 0.000 1.032 499 S CA 3.645 61.970 58.200 0.209 0.000 1.005 499 S CB -0.360 63.013 63.200 0.288 0.000 0.867 499 S HN -0.300 8.072 8.310 0.102 0.000 0.449 500 L N 1.379 122.600 121.223 -0.003 0.000 2.093 500 L HA -0.272 4.186 4.340 0.197 0.000 0.208 500 L C 2.553 179.462 176.870 0.064 0.000 1.085 500 L CA 2.997 57.873 54.840 0.060 0.000 0.755 500 L CB -0.060 41.957 42.059 -0.071 0.000 0.904 500 L HN 0.032 8.161 8.230 -0.167 0.000 0.435 501 M N -2.174 117.434 119.600 0.013 0.000 2.213 501 M HA -0.466 4.011 4.480 -0.004 0.000 0.263 501 M C 2.296 178.600 176.300 0.006 0.000 1.062 501 M CA 4.539 59.841 55.300 0.002 0.000 1.105 501 M CB -0.358 32.236 32.600 -0.010 0.000 1.385 501 M HN -0.139 8.146 8.290 -0.008 0.000 0.417 502 T N 2.265 116.831 114.554 0.019 0.000 2.746 502 T HA -0.343 3.992 4.350 -0.026 0.000 0.267 502 T C 1.755 176.525 174.700 0.116 0.000 1.039 502 T CA 5.137 67.237 62.100 -0.001 0.000 1.142 502 T CB -0.750 68.021 68.868 -0.162 0.000 0.866 502 T HN -0.316 7.856 8.240 0.026 0.084 0.444 503 S N 3.147 118.984 115.700 0.227 0.000 2.353 503 S HA -0.331 4.360 4.470 0.369 0.000 0.222 503 S C 1.844 176.544 174.600 0.168 0.000 1.035 503 S CA 3.974 62.352 58.200 0.298 0.000 1.025 503 S CB -0.660 62.767 63.200 0.379 0.000 0.902 503 S HN -0.300 8.153 8.310 0.238 0.000 0.440 504 I N 0.349 120.975 120.570 0.094 0.000 2.226 504 I HA -0.577 3.600 4.170 0.012 0.000 0.245 504 I C 1.398 177.423 176.117 -0.154 0.000 1.100 504 I CA 4.494 65.770 61.300 -0.039 0.000 1.374 504 I CB -0.190 37.758 38.000 -0.086 0.000 1.057 504 I HN -0.258 8.013 8.210 0.101 0.000 0.413 505 S N 0.650 116.296 115.700 -0.091 0.000 2.368 505 S HA -0.311 4.056 4.470 -0.171 0.000 0.225 505 S C 2.270 176.839 174.600 -0.053 0.000 1.030 505 S CA 3.881 62.019 58.200 -0.103 0.000 0.999 505 S CB -0.748 62.415 63.200 -0.061 0.000 0.844 505 S HN -0.250 8.033 8.310 -0.046 0.000 0.459 506 K N 1.459 121.879 120.400 0.033 0.000 2.057 506 K HA -0.139 4.222 4.320 0.069 0.000 0.206 506 K C 2.542 179.181 176.600 0.066 0.000 1.050 506 K CA 2.534 58.872 56.287 0.084 0.000 0.935 506 K CB -0.530 32.081 32.500 0.185 0.000 0.715 506 K HN -0.170 8.120 8.250 0.067 0.000 0.439 507 S N 0.951 116.690 115.700 0.065 0.000 2.368 507 S HA -0.209 4.313 4.470 0.085 0.000 0.225 507 S C 2.202 176.827 174.600 0.041 0.000 1.030 507 S CA 3.787 62.035 58.200 0.080 0.000 0.999 507 S CB -0.584 62.708 63.200 0.153 0.000 0.844 507 S HN -0.081 8.274 8.310 0.074 0.000 0.459 508 K N 1.059 121.385 120.400 -0.124 0.000 2.057 508 K HA -0.374 3.834 4.320 -0.187 0.000 0.207 508 K C 1.784 178.332 176.600 -0.086 0.000 1.049 508 K CA 3.689 59.835 56.287 -0.234 0.000 0.931 508 K CB -0.200 31.998 32.500 -0.504 0.000 0.714 508 K HN -0.071 8.062 8.250 -0.194 0.000 0.440 509 E N -0.544 119.620 120.200 -0.059 0.000 2.077 509 E HA -0.336 3.994 4.350 -0.034 0.000 0.193 509 E C 2.062 178.661 176.600 -0.002 0.000 0.989 509 E CA 3.012 59.397 56.400 -0.024 0.000 0.800 509 E CB -0.064 29.632 29.700 -0.006 0.000 0.746 509 E HN -0.520 7.803 8.360 -0.063 0.000 0.452 510 A N -0.588 122.243 122.820 0.020 0.000 1.930 510 A HA -0.348 3.977 4.320 0.008 0.000 0.217 510 A C 1.661 179.243 177.584 -0.004 0.000 1.175 510 A CA 3.291 55.340 52.037 0.019 0.000 0.627 510 A CB -0.365 18.672 19.000 0.062 0.000 0.815 510 A HN -0.372 7.796 8.150 0.030 0.000 0.443 511 V N -1.011 118.923 119.914 0.033 0.000 2.287 511 V HA -0.540 3.590 4.120 0.017 0.000 0.248 511 V C 1.788 177.893 176.094 0.020 0.000 1.053 511 V CA 5.033 67.362 62.300 0.049 0.000 1.027 511 V CB -0.932 30.996 31.823 0.174 0.000 0.646 511 V HN 0.136 8.359 8.190 0.055 0.000 0.447 512 S N 0.459 116.169 115.700 0.017 0.000 2.368 512 S HA -0.286 4.191 4.470 0.012 0.000 0.225 512 S C 1.824 176.412 174.600 -0.020 0.000 1.030 512 S CA 3.491 61.692 58.200 0.002 0.000 0.999 512 S CB -0.418 62.778 63.200 -0.007 0.000 0.844 512 S HN -0.407 7.913 8.310 0.016 0.000 0.459 513 L N 2.136 123.341 121.223 -0.030 0.000 2.012 513 L HA -0.329 3.989 4.340 -0.037 0.000 0.210 513 L C 1.375 178.201 176.870 -0.073 0.000 1.073 513 L CA 3.266 58.079 54.840 -0.045 0.000 0.748 513 L CB -0.049 41.983 42.059 -0.044 0.000 0.891 513 L HN -0.409 7.807 8.230 -0.024 0.000 0.431 514 L N -2.197 118.964 121.223 -0.103 0.000 2.072 514 L HA -0.484 3.754 4.340 -0.169 0.000 0.205 514 L C 2.176 178.987 176.870 -0.099 0.000 1.079 514 L CA 3.399 58.149 54.840 -0.150 0.000 0.752 514 L CB -0.740 41.177 42.059 -0.236 0.000 0.906 514 L HN -0.051 8.122 8.230 -0.096 0.000 0.436 515 N N -0.572 118.090 118.700 -0.062 0.000 2.120 515 N HA -0.320 4.393 4.740 -0.044 0.000 0.188 515 N C 2.248 177.737 175.510 -0.035 0.000 1.024 515 N CA 3.340 56.366 53.050 -0.039 0.000 0.852 515 N CB -0.529 37.951 38.487 -0.012 0.000 1.003 515 N HN -0.004 8.345 8.380 -0.051 0.000 0.424 516 D N -0.182 120.199 120.400 -0.033 0.000 2.144 516 D HA -0.201 4.427 4.640 -0.021 0.000 0.199 516 D C 1.840 178.119 176.300 -0.034 0.000 0.984 516 D CA 3.297 57.281 54.000 -0.027 0.000 0.834 516 D CB -0.502 40.284 40.800 -0.024 0.000 0.955 516 D HN -0.253 8.097 8.370 -0.033 0.000 0.465 517 A N -0.319 122.472 122.820 -0.048 0.000 1.898 517 A HA -0.190 4.105 4.320 -0.042 0.000 0.216 517 A C 2.186 179.741 177.584 -0.049 0.000 1.181 517 A CA 2.983 54.989 52.037 -0.052 0.000 0.620 517 A CB -0.485 18.473 19.000 -0.070 0.000 0.819 517 A HN -0.503 7.613 8.150 -0.057 0.000 0.442 518 I N -1.292 119.245 120.570 -0.055 0.000 2.179 518 I HA -0.616 3.527 4.170 -0.046 0.000 0.242 518 I C 1.500 177.598 176.117 -0.032 0.000 1.088 518 I CA 4.615 65.887 61.300 -0.046 0.000 1.357 518 I CB -0.251 37.719 38.000 -0.050 0.000 1.051 518 I HN -0.039 8.133 8.210 -0.064 0.000 0.409 519 D N -0.521 119.862 120.400 -0.028 0.000 2.144 519 D HA -0.307 4.322 4.640 -0.018 0.000 0.199 519 D C 2.314 178.603 176.300 -0.018 0.000 0.984 519 D CA 3.472 57.460 54.000 -0.020 0.000 0.834 519 D CB -0.731 40.059 40.800 -0.016 0.000 0.955 519 D HN -0.192 8.160 8.370 -0.030 0.000 0.465 520 A N -0.911 121.897 122.820 -0.021 0.000 1.933 520 A HA -0.215 4.096 4.320 -0.015 0.000 0.218 520 A C 2.159 179.733 177.584 -0.017 0.000 1.175 520 A CA 2.826 54.852 52.037 -0.018 0.000 0.628 520 A CB -0.604 18.384 19.000 -0.020 0.000 0.814 520 A HN -0.340 7.796 8.150 -0.024 0.000 0.444 521 Q N -2.665 117.123 119.800 -0.020 0.000 2.079 521 Q HA -0.213 4.117 4.340 -0.016 0.000 0.200 521 Q C 2.121 178.112 176.000 -0.014 0.000 0.974 521 Q CA 1.853 57.645 55.803 -0.018 0.000 0.840 521 Q CB 0.027 28.753 28.738 -0.021 0.000 0.898 521 Q HN -0.431 7.824 8.270 -0.024 0.000 0.430 522 V N -3.046 116.859 119.914 -0.015 0.000 2.343 522 V HA -0.201 3.913 4.120 -0.011 0.000 0.247 522 V C -0.186 175.902 176.094 -0.010 0.000 1.051 522 V CA 1.881 64.174 62.300 -0.012 0.000 1.036 522 V CB 0.379 32.194 31.823 -0.012 0.000 0.654 522 V HN -0.387 7.793 8.190 -0.017 0.000 0.451 523 A N 0.000 122.814 122.820 -0.010 0.000 2.254 523 A HA 0.000 nan 4.320 nan 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 8.143 8.150 -0.011 0.000 0.486