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 2x2n_1_A DATA FIRST_RESID 30 DATA SEQUENCE TDPPVYPVTV PILGHIIQFG KSPLGFMQEC KRQLKSGIFT INIVGKRVTI DATA SEQUENCE VGDPHEHSRF FLPRNEVLSP REVYSFMVPV FGEGVAYAAP YPRMREQLNF DATA SEQUENCE LAEELTIAKF QNFVPAIQHE VRKFMAANWD KDEGEINLLE DCSTMIINTA DATA SEQUENCE CQCLFGEDLR KRLDARRFAQ LLAKMESSLI PAAVFLPILL KLPLPQSARC DATA SEQUENCE HEARTELQKI LSEIIIARKA AAVNKXSSTS DLLSGLLSAV YRDGTPMSLH DATA SEQUENCE EVCGMIVAAM FAGQHTSSIT TTWSMLHLMH PANVKHLEAL RKEIEEFPAQ DATA SEQUENCE LNYNNVMDEM PFAERCARES IRRDPPLLML MRKVMADVKV GSYVVPKGDI DATA SEQUENCE IACSPLLSHH DEEAFPEPRR WDPERDEKVE GAFIGFGAGV HKCIGQKFGL DATA SEQUENCE LQVKTILATA FRSYDFQLLR DEVPDPDYHT MVVGPTASQC RVKYIRRKA 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 30 T HA 0.000 4.350 4.350 -0.000 0.000 0.228 30 T C 0.000 174.836 174.700 0.227 0.000 1.109 30 T CA 0.000 62.185 62.100 0.142 0.000 1.349 30 T CB 0.000 68.915 68.868 0.078 0.000 0.612 31 D N 3.821 124.319 120.400 0.163 0.000 2.389 31 D HA 0.359 4.998 4.640 -0.002 0.000 0.247 31 D C -2.381 173.957 176.300 0.064 0.000 1.128 31 D CA -0.995 53.067 54.000 0.104 0.000 0.884 31 D CB 1.501 42.335 40.800 0.056 0.000 1.194 31 D HN 0.152 8.522 8.370 -0.000 0.000 0.441 32 P HA 0.150 4.570 4.420 -0.000 0.000 0.272 32 P C -2.459 174.706 177.300 -0.225 0.000 1.223 32 P CA -1.079 61.678 63.100 -0.571 0.000 0.784 32 P CB -0.165 31.212 31.700 -0.539 0.000 0.923 33 P HA -0.020 4.400 4.420 -0.000 0.000 0.266 33 P C -0.614 176.715 177.300 0.048 0.000 1.215 33 P CA 0.302 63.392 63.100 -0.017 0.000 0.763 33 P CB 0.078 31.787 31.700 0.015 0.000 0.806 34 V N 5.472 125.426 119.914 0.067 0.000 2.427 34 V HA 0.022 4.141 4.120 -0.002 0.000 0.268 34 V C 0.697 176.893 176.094 0.171 0.000 1.046 34 V CA -0.687 61.692 62.300 0.132 0.000 0.970 34 V CB -0.879 31.009 31.823 0.108 0.000 1.001 34 V HN 0.429 8.619 8.190 -0.000 0.000 0.476 35 Y N 8.148 128.505 120.300 0.095 0.000 2.810 35 Y HA 0.141 4.690 4.550 -0.002 0.000 0.332 35 Y C -1.853 174.165 175.900 0.196 0.000 1.243 35 Y CA -1.505 56.629 58.100 0.057 0.000 1.537 35 Y CB 0.452 38.853 38.460 -0.098 0.000 1.265 35 Y HN 0.523 8.803 8.280 -0.000 0.000 0.572 36 P HA 0.009 4.429 4.420 -0.000 0.000 0.264 36 P C -1.047 176.353 177.300 0.167 0.000 1.193 36 P CA 0.032 63.099 63.100 -0.056 0.000 0.763 36 P CB 0.509 32.092 31.700 -0.196 0.000 0.810 37 V N 3.424 123.396 119.914 0.097 0.000 2.461 37 V HA 0.114 4.233 4.120 -0.002 0.000 0.275 37 V C 1.688 177.780 176.094 -0.005 0.000 1.047 37 V CA 0.681 62.972 62.300 -0.014 0.000 0.955 37 V CB 0.683 32.437 31.823 -0.115 0.000 0.988 37 V HN 0.771 8.961 8.190 -0.000 0.000 0.471 38 T N 1.663 116.223 114.554 0.010 0.000 3.042 38 T HA 0.062 4.410 4.350 -0.002 0.000 0.245 38 T C 0.592 175.279 174.700 -0.021 0.000 1.029 38 T CA 0.745 62.849 62.100 0.008 0.000 1.120 38 T CB 0.527 69.420 68.868 0.042 0.000 0.917 38 T HN 0.641 8.881 8.240 -0.000 0.000 0.467 39 V N 1.464 121.349 119.914 -0.047 0.000 2.350 39 V HA 0.530 4.649 4.120 -0.002 0.000 0.276 39 V C -1.624 174.427 176.094 -0.072 0.000 1.028 39 V CA -2.025 60.243 62.300 -0.053 0.000 0.860 39 V CB 1.211 33.003 31.823 -0.052 0.000 0.990 39 V HN -0.040 8.150 8.190 -0.000 0.000 0.453 40 P HA -0.222 4.198 4.420 -0.000 0.000 0.207 40 P C 1.489 178.757 177.300 -0.054 0.000 1.115 40 P CA 2.237 65.309 63.100 -0.047 0.000 0.956 40 P CB 0.226 31.907 31.700 -0.032 0.000 0.774 41 I N -2.450 118.091 120.570 -0.047 0.000 2.400 41 I HA -0.098 4.071 4.170 -0.002 0.000 0.248 41 I C 2.423 178.503 176.117 -0.061 0.000 1.109 41 I CA 0.826 62.100 61.300 -0.044 0.000 1.425 41 I CB -0.554 37.428 38.000 -0.030 0.000 1.094 41 I HN -0.148 8.062 8.210 -0.000 0.000 0.425 42 L N 0.471 121.652 121.223 -0.069 0.000 2.156 42 L HA 0.066 4.405 4.340 -0.002 0.000 0.208 42 L C 1.682 178.475 176.870 -0.128 0.000 1.095 42 L CA 0.868 55.657 54.840 -0.085 0.000 0.770 42 L CB -1.046 40.970 42.059 -0.072 0.000 0.914 42 L HN 0.545 8.775 8.230 -0.000 0.000 0.439 43 G N -0.024 108.679 108.800 -0.162 0.000 2.514 43 G HA2 -0.374 3.585 3.960 -0.002 0.000 0.265 43 G HA3 -0.374 3.585 3.960 -0.002 0.000 0.265 43 G C 0.239 174.953 174.900 -0.309 0.000 1.150 43 G CA 0.536 45.466 45.100 -0.284 0.000 0.959 43 G HN 0.474 8.764 8.290 -0.000 0.000 0.556 44 H N 0.142 119.158 119.070 -0.091 0.000 2.529 44 H HA 0.472 5.027 4.556 -0.002 0.000 0.277 44 H C 2.267 177.434 175.328 -0.268 0.000 1.004 44 H CA 0.283 56.224 56.048 -0.177 0.000 1.167 44 H CB 0.367 30.079 29.762 -0.083 0.000 1.445 44 H HN 0.379 8.659 8.280 -0.000 0.000 0.554 45 I N 0.614 121.106 120.570 -0.131 0.000 2.226 45 I HA -0.267 3.902 4.170 -0.002 0.000 0.245 45 I C 1.679 177.745 176.117 -0.086 0.000 1.100 45 I CA 1.291 62.504 61.300 -0.146 0.000 1.374 45 I CB 0.054 37.947 38.000 -0.178 0.000 1.057 45 I HN 0.305 8.515 8.210 -0.000 0.000 0.413 46 I N 0.595 121.108 120.570 -0.095 0.000 2.099 46 I HA -0.367 3.802 4.170 -0.002 0.000 0.239 46 I C 2.533 178.568 176.117 -0.136 0.000 1.066 46 I CA 1.665 62.914 61.300 -0.084 0.000 1.324 46 I CB -0.615 37.343 38.000 -0.069 0.000 1.037 46 I HN 0.338 8.548 8.210 -0.000 0.000 0.401 47 Q N -0.122 119.535 119.800 -0.238 0.000 2.181 47 Q HA -0.255 4.083 4.340 -0.002 0.000 0.205 47 Q C 2.140 177.827 176.000 -0.521 0.000 0.980 47 Q CA 1.899 57.452 55.803 -0.417 0.000 0.862 47 Q CB -0.339 28.004 28.738 -0.659 0.000 0.905 47 Q HN 0.494 8.764 8.270 -0.000 0.000 0.429 48 F N 0.869 120.439 119.950 -0.634 0.000 2.149 48 F HA 0.042 4.568 4.527 -0.002 0.000 0.294 48 F C 2.201 177.896 175.800 -0.174 0.000 1.095 48 F CA 1.465 59.253 58.000 -0.353 0.000 1.276 48 F CB -0.479 38.386 39.000 -0.224 0.000 1.023 48 F HN 0.017 8.317 8.300 -0.000 0.000 0.480 49 G N 0.527 109.350 108.800 0.037 0.000 2.440 49 G HA2 -0.262 3.697 3.960 -0.002 0.000 0.218 49 G HA3 -0.262 3.697 3.960 -0.002 0.000 0.218 49 G C 1.762 176.619 174.900 -0.072 0.000 1.154 49 G CA 0.851 45.953 45.100 0.003 0.000 0.767 49 G HN 0.281 8.571 8.290 -0.000 0.000 0.552 50 K N 0.225 120.575 120.400 -0.083 0.000 2.001 50 K HA -0.073 4.246 4.320 -0.002 0.000 0.214 50 K C 0.915 177.464 176.600 -0.085 0.000 1.050 50 K CA 1.471 57.720 56.287 -0.064 0.000 0.934 50 K CB -0.183 32.279 32.500 -0.064 0.000 0.718 50 K HN 0.444 8.694 8.250 -0.000 0.000 0.443 51 S N -0.494 115.112 115.700 -0.158 0.000 2.571 51 S HA 0.263 4.732 4.470 -0.002 0.000 0.238 51 S C -2.553 171.829 174.600 -0.363 0.000 1.153 51 S CA -1.379 56.696 58.200 -0.209 0.000 1.141 51 S CB 1.857 64.992 63.200 -0.108 0.000 1.133 51 S HN -0.191 8.119 8.310 -0.000 0.000 0.464 52 P HA -0.108 4.312 4.420 -0.000 0.000 0.213 52 P C 1.748 178.706 177.300 -0.570 0.000 1.170 52 P CA 0.539 63.062 63.100 -0.962 0.000 0.898 52 P CB 0.042 31.076 31.700 -1.110 0.000 0.787 53 L N 0.044 120.955 121.223 -0.520 0.000 2.012 53 L HA -0.035 4.304 4.340 -0.002 0.000 0.210 53 L C 2.352 179.080 176.870 -0.236 0.000 1.073 53 L CA 2.604 57.237 54.840 -0.346 0.000 0.748 53 L CB -1.776 40.060 42.059 -0.372 0.000 0.891 53 L HN -0.009 8.221 8.230 -0.000 0.000 0.431 54 G N -1.460 107.221 108.800 -0.199 0.000 2.408 54 G HA2 -0.328 3.630 3.960 -0.002 0.000 0.217 54 G HA3 -0.328 3.630 3.960 -0.002 0.000 0.217 54 G C 1.530 176.378 174.900 -0.086 0.000 1.150 54 G CA 0.758 45.786 45.100 -0.119 0.000 0.776 54 G HN 0.473 8.763 8.290 -0.000 0.000 0.542 55 F N 1.018 120.828 119.950 -0.234 0.000 2.186 55 F HA 0.138 4.664 4.527 -0.002 0.000 0.299 55 F C 2.591 178.236 175.800 -0.259 0.000 1.090 55 F CA 1.163 59.022 58.000 -0.236 0.000 1.307 55 F CB -0.118 38.759 39.000 -0.205 0.000 1.019 55 F HN 0.066 8.366 8.300 -0.000 0.000 0.489 56 M N -0.280 119.113 119.600 -0.344 0.000 2.123 56 M HA -0.203 4.276 4.480 -0.002 0.000 0.263 56 M C 2.233 178.303 176.300 -0.384 0.000 1.069 56 M CA 1.694 56.790 55.300 -0.340 0.000 1.133 56 M CB -0.483 32.100 32.600 -0.028 0.000 1.356 56 M HN 0.157 8.447 8.290 -0.000 0.000 0.415 57 Q N -0.171 119.478 119.800 -0.252 0.000 2.124 57 Q HA -0.172 4.167 4.340 -0.002 0.000 0.202 57 Q C 1.989 177.831 176.000 -0.263 0.000 0.977 57 Q CA 0.959 56.643 55.803 -0.198 0.000 0.850 57 Q CB -0.134 28.536 28.738 -0.113 0.000 0.901 57 Q HN 0.386 8.656 8.270 -0.000 0.000 0.429 58 E N 0.430 120.455 120.200 -0.292 0.000 2.033 58 E HA -0.218 4.131 4.350 -0.002 0.000 0.199 58 E C 2.152 178.499 176.600 -0.422 0.000 1.011 58 E CA 1.269 57.502 56.400 -0.279 0.000 0.815 58 E CB -0.465 29.103 29.700 -0.219 0.000 0.755 58 E HN 0.397 8.757 8.360 -0.000 0.000 0.451 59 C N 0.856 119.656 119.300 -0.833 0.000 2.398 59 C HA -0.152 4.307 4.460 -0.002 0.000 0.276 59 C C 2.744 177.201 174.990 -0.888 0.000 1.222 59 C CA 1.046 59.425 59.018 -1.065 0.000 1.746 59 C CB -0.823 25.879 27.740 -1.729 0.000 2.039 59 C HN 0.478 8.708 8.230 -0.000 0.000 0.470 60 K N 1.038 120.916 120.400 -0.869 0.000 2.009 60 K HA -0.251 4.068 4.320 -0.002 0.000 0.210 60 K C 2.309 178.765 176.600 -0.239 0.000 1.049 60 K CA 2.152 58.151 56.287 -0.480 0.000 0.929 60 K CB -0.192 32.182 32.500 -0.210 0.000 0.714 60 K HN 0.532 8.782 8.250 -0.000 0.000 0.440 61 R N 0.634 121.016 120.500 -0.196 0.000 2.066 61 R HA -0.079 4.260 4.340 -0.002 0.000 0.232 61 R C 2.100 178.353 176.300 -0.079 0.000 1.131 61 R CA 1.750 57.789 56.100 -0.101 0.000 0.955 61 R CB -0.631 29.623 30.300 -0.076 0.000 0.851 61 R HN 0.274 8.544 8.270 -0.000 0.000 0.432 62 Q N 0.212 119.961 119.800 -0.085 0.000 2.079 62 Q HA -0.014 4.325 4.340 -0.002 0.000 0.200 62 Q C 2.056 178.038 176.000 -0.029 0.000 0.974 62 Q CA 1.632 57.419 55.803 -0.028 0.000 0.840 62 Q CB -0.006 28.762 28.738 0.051 0.000 0.898 62 Q HN 0.409 8.679 8.270 -0.000 0.000 0.430 63 L N 0.161 121.351 121.223 -0.054 0.000 2.554 63 L HA 0.029 4.368 4.340 -0.002 0.000 0.226 63 L C 0.990 177.858 176.870 -0.002 0.000 1.137 63 L CA 0.650 55.474 54.840 -0.027 0.000 0.863 63 L CB -0.280 41.759 42.059 -0.034 0.000 0.985 63 L HN 0.146 8.376 8.230 -0.000 0.000 0.451 64 K N 0.509 120.899 120.400 -0.017 0.000 3.162 64 K HA -0.141 4.178 4.320 -0.002 0.000 0.268 64 K C 0.099 176.730 176.600 0.051 0.000 1.062 64 K CA 0.805 57.099 56.287 0.012 0.000 0.769 64 K CB -2.480 30.032 32.500 0.020 0.000 1.274 64 K HN 0.368 8.618 8.250 -0.000 0.000 0.478 65 S N -2.148 113.583 115.700 0.051 0.000 2.560 65 S HA 0.687 5.156 4.470 -0.002 0.000 0.283 65 S C 1.329 176.022 174.600 0.155 0.000 1.141 65 S CA 0.756 59.034 58.200 0.129 0.000 0.902 65 S CB 1.351 64.652 63.200 0.168 0.000 1.104 65 S HN 1.438 9.748 8.310 -0.000 0.000 0.454 66 G N 2.598 111.510 108.800 0.188 0.000 2.421 66 G HA2 0.172 4.131 3.960 -0.002 0.000 0.217 66 G HA3 0.172 4.131 3.960 -0.002 0.000 0.217 66 G C 0.224 175.287 174.900 0.271 0.000 1.143 66 G CA 0.576 45.801 45.100 0.208 0.000 0.784 66 G HN 0.613 8.903 8.290 -0.000 0.000 0.541 67 I N 1.015 121.713 120.570 0.213 0.000 2.362 67 I HA 0.546 4.715 4.170 -0.002 0.000 0.289 67 I C -0.694 175.422 176.117 -0.002 0.000 0.994 67 I CA -0.953 60.368 61.300 0.036 0.000 1.158 67 I CB 1.469 39.499 38.000 0.050 0.000 1.315 67 I HN 0.192 8.402 8.210 -0.000 0.000 0.451 68 F N 2.022 121.871 119.950 -0.169 0.000 2.741 68 F HA 0.784 5.310 4.527 -0.002 0.000 0.313 68 F C -1.112 174.615 175.800 -0.121 0.000 1.153 68 F CA -0.824 57.074 58.000 -0.170 0.000 0.931 68 F CB 1.405 40.329 39.000 -0.127 0.000 1.335 68 F HN 0.124 8.424 8.300 -0.000 0.000 0.460 69 T N 3.162 117.766 114.554 0.083 0.000 2.841 69 T HA 0.676 5.025 4.350 -0.002 0.000 0.285 69 T C -0.315 174.491 174.700 0.178 0.000 0.991 69 T CA -0.543 61.567 62.100 0.018 0.000 0.966 69 T CB 1.295 70.167 68.868 0.006 0.000 0.962 69 T HN 0.802 9.042 8.240 -0.000 0.000 0.438 70 I N 0.597 121.254 120.570 0.145 0.000 2.947 70 I HA 0.724 4.893 4.170 -0.002 0.000 0.314 70 I C -0.350 175.929 176.117 0.270 0.000 1.028 70 I CA -1.066 60.416 61.300 0.303 0.000 1.077 70 I CB 1.638 39.802 38.000 0.272 0.000 1.274 70 I HN 0.384 8.594 8.210 -0.000 0.000 0.485 71 N N 3.499 122.445 118.700 0.409 0.000 2.372 71 N HA 0.526 5.265 4.740 -0.002 0.000 0.291 71 N C -1.599 173.885 175.510 -0.043 0.000 1.024 71 N CA -0.504 52.592 53.050 0.076 0.000 0.873 71 N CB 1.708 40.169 38.487 -0.044 0.000 1.206 71 N HN 0.734 9.114 8.380 -0.000 0.000 0.486 72 I N 3.439 123.920 120.570 -0.147 0.000 2.468 72 I HA 0.139 4.308 4.170 -0.002 0.000 0.284 72 I C 0.482 176.465 176.117 -0.223 0.000 1.038 72 I CA -0.960 60.141 61.300 -0.331 0.000 1.083 72 I CB 1.887 39.421 38.000 -0.776 0.000 1.223 72 I HN 0.282 8.492 8.210 -0.000 0.000 0.443 73 V N 6.060 125.873 119.914 -0.168 0.000 5.176 73 V HA -0.331 3.788 4.120 -0.002 0.000 0.252 73 V C 1.472 177.548 176.094 -0.030 0.000 0.665 73 V CA 1.549 63.803 62.300 -0.075 0.000 0.654 73 V CB -2.068 29.738 31.823 -0.029 0.000 0.440 73 V HN 1.300 9.490 8.190 -0.000 0.000 0.806 74 G N -0.830 107.943 108.800 -0.045 0.000 2.213 74 G HA2 -0.260 3.699 3.960 -0.002 0.000 0.236 74 G HA3 -0.260 3.699 3.960 -0.002 0.000 0.236 74 G C 0.037 174.940 174.900 0.005 0.000 0.991 74 G CA 0.253 45.342 45.100 -0.018 0.000 0.629 74 G HN 0.693 8.983 8.290 -0.000 0.000 0.517 75 K N 1.184 121.597 120.400 0.021 0.000 2.234 75 K HA 0.507 4.826 4.320 -0.002 0.000 0.277 75 K C 0.557 177.180 176.600 0.039 0.000 1.038 75 K CA -0.676 55.646 56.287 0.057 0.000 0.888 75 K CB 0.867 33.454 32.500 0.144 0.000 1.091 75 K HN 0.225 8.475 8.250 -0.000 0.000 0.467 76 R N 1.733 122.254 120.500 0.035 0.000 2.458 76 R HA 0.078 4.417 4.340 -0.002 0.000 0.303 76 R C -0.562 175.753 176.300 0.025 0.000 1.013 76 R CA -0.016 56.101 56.100 0.029 0.000 1.026 76 R CB 0.324 30.637 30.300 0.022 0.000 0.948 76 R HN 0.232 8.502 8.270 -0.000 0.000 0.417 77 V N 3.589 123.507 119.914 0.006 0.000 2.407 77 V HA 0.199 4.318 4.120 -0.002 0.000 0.291 77 V C -0.134 175.906 176.094 -0.091 0.000 1.018 77 V CA -0.633 61.653 62.300 -0.024 0.000 0.842 77 V CB 2.049 33.851 31.823 -0.036 0.000 0.996 77 V HN 0.756 8.946 8.190 -0.000 0.000 0.426 78 T N 6.602 121.083 114.554 -0.120 0.000 2.767 78 T HA 0.607 4.956 4.350 -0.002 0.000 0.284 78 T C -0.147 174.370 174.700 -0.305 0.000 0.973 78 T CA -0.138 61.838 62.100 -0.207 0.000 0.996 78 T CB 0.856 69.643 68.868 -0.134 0.000 0.927 78 T HN 0.361 8.601 8.240 -0.000 0.000 0.456 79 I N 3.174 123.409 120.570 -0.558 0.000 2.354 79 I HA 0.263 4.432 4.170 -0.002 0.000 0.292 79 I C 0.000 175.831 176.117 -0.477 0.000 0.989 79 I CA -0.996 59.954 61.300 -0.583 0.000 1.188 79 I CB 1.827 39.329 38.000 -0.831 0.000 1.342 79 I HN 0.319 8.529 8.210 -0.000 0.000 0.457 80 V N 6.607 126.341 119.914 -0.299 0.000 2.223 80 V HA 0.106 4.225 4.120 -0.002 0.000 0.249 80 V C 1.367 177.426 176.094 -0.059 0.000 1.233 80 V CA 0.087 62.301 62.300 -0.142 0.000 1.131 80 V CB 0.169 31.935 31.823 -0.094 0.000 1.298 80 V HN 1.049 9.239 8.190 -0.000 0.000 0.498 81 G N 1.918 110.701 108.800 -0.030 0.000 2.880 81 G HA2 -0.051 3.908 3.960 -0.002 0.000 0.209 81 G HA3 -0.051 3.908 3.960 -0.002 0.000 0.209 81 G C 0.463 175.428 174.900 0.109 0.000 1.157 81 G CA -0.064 45.089 45.100 0.087 0.000 0.779 81 G HN 0.590 8.880 8.290 -0.000 0.000 0.539 82 D N 0.375 120.827 120.400 0.087 0.000 2.347 82 D HA 0.280 4.919 4.640 -0.002 0.000 0.235 82 D C -1.504 174.748 176.300 -0.079 0.000 1.149 82 D CA -2.301 51.739 54.000 0.067 0.000 0.850 82 D CB 2.023 42.897 40.800 0.123 0.000 1.061 82 D HN -0.065 8.305 8.370 -0.000 0.000 0.487 83 P HA -0.151 4.269 4.420 -0.000 0.000 0.219 83 P C 1.104 178.052 177.300 -0.586 0.000 1.146 83 P CA 1.012 63.650 63.100 -0.771 0.000 0.808 83 P CB 0.122 31.527 31.700 -0.491 0.000 0.779 84 H N -0.475 118.492 119.070 -0.171 0.000 2.457 84 H HA -0.054 4.501 4.556 -0.002 0.000 0.297 84 H C 0.967 176.289 175.328 -0.009 0.000 1.092 84 H CA 1.076 57.085 56.048 -0.066 0.000 1.309 84 H CB -0.088 29.657 29.762 -0.028 0.000 1.382 84 H HN 0.252 8.532 8.280 -0.000 0.000 0.535 85 E N -0.045 120.214 120.200 0.098 0.000 2.451 85 E HA 0.024 4.372 4.350 -0.002 0.000 0.194 85 E C 1.254 177.987 176.600 0.222 0.000 1.027 85 E CA -0.109 56.378 56.400 0.145 0.000 0.914 85 E CB -0.173 29.609 29.700 0.137 0.000 1.054 85 E HN 0.661 9.021 8.360 -0.000 0.000 0.461 86 H N 0.931 120.115 119.070 0.189 0.000 2.321 86 H HA -0.147 4.408 4.556 -0.002 0.000 0.295 86 H C 2.250 177.812 175.328 0.389 0.000 1.102 86 H CA 1.768 57.996 56.048 0.301 0.000 1.266 86 H CB 0.339 30.319 29.762 0.363 0.000 1.363 86 H HN 0.167 8.447 8.280 -0.000 0.000 0.492 87 S N 0.724 116.685 115.700 0.434 0.000 2.507 87 S HA -0.068 4.401 4.470 -0.002 0.000 0.235 87 S C 1.813 176.552 174.600 0.233 0.000 0.988 87 S CA 0.453 58.859 58.200 0.343 0.000 0.944 87 S CB 0.010 63.347 63.200 0.229 0.000 0.762 87 S HN 0.310 8.620 8.310 -0.000 0.000 0.526 88 R N -0.141 120.481 120.500 0.203 0.000 2.235 88 R HA 0.173 4.512 4.340 -0.002 0.000 0.213 88 R C 1.609 177.974 176.300 0.108 0.000 1.059 88 R CA 0.731 56.910 56.100 0.132 0.000 0.997 88 R CB -0.701 29.673 30.300 0.122 0.000 0.884 88 R HN 0.655 8.925 8.270 -0.000 0.000 0.462 89 F N -0.344 119.570 119.950 -0.059 0.000 2.383 89 F HA 0.090 4.615 4.527 -0.002 0.000 0.287 89 F C 1.456 177.084 175.800 -0.286 0.000 1.069 89 F CA 0.581 58.436 58.000 -0.242 0.000 1.402 89 F CB -0.011 38.729 39.000 -0.433 0.000 1.116 89 F HN -0.238 8.062 8.300 -0.000 0.000 0.549 90 F N 0.454 120.438 119.950 0.057 0.000 2.416 90 F HA 0.087 4.613 4.527 -0.002 0.000 0.296 90 F C 1.791 177.550 175.800 -0.069 0.000 1.099 90 F CA 0.937 58.917 58.000 -0.034 0.000 1.427 90 F CB -0.452 38.621 39.000 0.122 0.000 1.079 90 F HN -0.068 8.232 8.300 -0.000 0.000 0.536 91 L N -1.212 120.078 121.223 0.111 0.000 2.463 91 L HA 0.159 4.498 4.340 -0.002 0.000 0.219 91 L C -1.582 175.275 176.870 -0.020 0.000 1.088 91 L CA -0.479 54.393 54.840 0.053 0.000 0.849 91 L CB -1.372 40.732 42.059 0.074 0.000 1.012 91 L HN -0.082 8.148 8.230 -0.000 0.000 0.468 92 P HA 0.038 4.458 4.420 -0.000 0.000 0.269 92 P C -0.360 176.871 177.300 -0.115 0.000 1.217 92 P CA -0.029 63.021 63.100 -0.083 0.000 0.783 92 P CB 0.433 32.071 31.700 -0.103 0.000 0.898 93 R N 1.731 122.161 120.500 -0.117 0.000 2.583 93 R HA 0.207 4.546 4.340 -0.002 0.000 0.268 93 R C 1.369 177.538 176.300 -0.217 0.000 1.101 93 R CA -0.537 55.471 56.100 -0.154 0.000 1.180 93 R CB -0.706 29.513 30.300 -0.135 0.000 1.128 93 R HN 0.398 8.668 8.270 -0.000 0.000 0.568 94 N N 1.469 119.979 118.700 -0.316 0.000 2.184 94 N HA -0.197 4.542 4.740 -0.002 0.000 0.190 94 N C 1.043 176.221 175.510 -0.554 0.000 1.011 94 N CA 1.465 54.182 53.050 -0.555 0.000 0.867 94 N CB 0.084 37.922 38.487 -1.082 0.000 0.993 94 N HN 0.488 8.868 8.380 -0.000 0.000 0.433 95 E N -0.221 119.758 120.200 -0.368 0.000 2.285 95 E HA 0.007 4.356 4.350 -0.002 0.000 0.194 95 E C 1.900 178.448 176.600 -0.087 0.000 0.997 95 E CA 0.205 56.515 56.400 -0.151 0.000 0.845 95 E CB 0.210 29.878 29.700 -0.052 0.000 0.782 95 E HN 0.109 8.469 8.360 -0.000 0.000 0.491 96 V N -0.200 119.645 119.914 -0.115 0.000 2.521 96 V HA 0.054 4.173 4.120 -0.002 0.000 0.239 96 V C 0.149 176.180 176.094 -0.104 0.000 1.053 96 V CA 0.553 62.802 62.300 -0.085 0.000 1.073 96 V CB 0.199 31.976 31.823 -0.077 0.000 0.746 96 V HN 0.099 8.289 8.190 -0.000 0.000 0.476 97 L N 0.454 121.584 121.223 -0.155 0.000 2.342 97 L HA 0.541 4.880 4.340 -0.002 0.000 0.276 97 L C -0.300 176.436 176.870 -0.223 0.000 0.997 97 L CA 0.346 55.072 54.840 -0.190 0.000 0.838 97 L CB 1.255 43.157 42.059 -0.261 0.000 1.224 97 L HN 0.065 8.295 8.230 -0.000 0.000 0.416 98 S N 4.937 120.522 115.700 -0.192 0.000 2.454 98 S HA 0.662 5.131 4.470 -0.002 0.000 0.306 98 S C -1.841 172.604 174.600 -0.258 0.000 1.100 98 S CA -1.282 56.814 58.200 -0.174 0.000 1.087 98 S CB 1.444 64.635 63.200 -0.014 0.000 1.019 98 S HN 0.464 8.774 8.310 -0.000 0.000 0.480 99 P HA 0.083 4.503 4.420 -0.000 0.000 0.239 99 P C 1.322 178.397 177.300 -0.373 0.000 1.188 99 P CA 0.004 62.712 63.100 -0.654 0.000 0.794 99 P CB 0.206 31.324 31.700 -0.969 0.000 0.937 100 R N 1.057 121.529 120.500 -0.046 0.000 2.122 100 R HA -0.210 4.129 4.340 -0.002 0.000 0.236 100 R C 2.002 178.310 176.300 0.014 0.000 1.129 100 R CA 2.308 58.443 56.100 0.058 0.000 0.925 100 R CB -0.381 29.985 30.300 0.109 0.000 0.850 100 R HN 0.101 8.371 8.270 -0.000 0.000 0.431 101 E N -0.255 119.937 120.200 -0.013 0.000 2.051 101 E HA -0.163 4.186 4.350 -0.002 0.000 0.192 101 E C 1.947 178.549 176.600 0.004 0.000 0.991 101 E CA 1.573 57.972 56.400 -0.002 0.000 0.799 101 E CB -0.302 29.390 29.700 -0.014 0.000 0.748 101 E HN 0.432 8.792 8.360 -0.000 0.000 0.449 102 V N -1.481 118.389 119.914 -0.074 0.000 2.515 102 V HA -0.160 3.958 4.120 -0.002 0.000 0.250 102 V C 1.393 177.660 176.094 0.289 0.000 1.058 102 V CA 1.366 63.646 62.300 -0.033 0.000 1.064 102 V CB -0.610 31.094 31.823 -0.199 0.000 0.675 102 V HN 0.175 8.365 8.190 -0.000 0.000 0.461 103 Y N 0.505 120.820 120.300 0.026 0.000 2.458 103 Y HA 0.377 4.926 4.550 -0.002 0.000 0.256 103 Y C 2.773 178.652 175.900 -0.034 0.000 1.159 103 Y CA -0.248 57.843 58.100 -0.015 0.000 1.261 103 Y CB -0.482 37.856 38.460 -0.204 0.000 1.119 103 Y HN 0.348 8.628 8.280 -0.000 0.000 0.524 104 S N 1.358 117.187 115.700 0.215 0.000 2.422 104 S HA -0.315 4.154 4.470 -0.002 0.000 0.241 104 S C 1.906 176.590 174.600 0.141 0.000 1.076 104 S CA 2.283 60.583 58.200 0.166 0.000 1.066 104 S CB -0.786 62.502 63.200 0.146 0.000 0.890 104 S HN 0.541 8.851 8.310 -0.000 0.000 0.465 105 F N 0.046 120.056 119.950 0.100 0.000 2.722 105 F HA 0.250 4.776 4.527 -0.002 0.000 0.298 105 F C 1.632 177.450 175.800 0.029 0.000 1.175 105 F CA 0.345 58.373 58.000 0.047 0.000 1.462 105 F CB -0.434 38.572 39.000 0.009 0.000 1.111 105 F HN 0.163 8.463 8.300 -0.000 0.000 0.592 106 M N 0.905 120.176 119.600 -0.549 0.000 2.561 106 M HA 0.033 4.512 4.480 -0.002 0.000 0.238 106 M C 1.939 178.148 176.300 -0.152 0.000 1.131 106 M CA 0.315 55.328 55.300 -0.477 0.000 1.046 106 M CB -0.632 31.776 32.600 -0.321 0.000 1.532 106 M HN 0.257 8.547 8.290 -0.000 0.000 0.497 107 V N 0.365 120.292 119.914 0.022 0.000 2.370 107 V HA -0.199 3.920 4.120 -0.002 0.000 0.252 107 V C -0.500 175.593 176.094 -0.002 0.000 1.068 107 V CA 1.654 64.011 62.300 0.094 0.000 1.061 107 V CB -2.672 29.220 31.823 0.115 0.000 0.656 107 V HN 0.268 8.458 8.190 -0.000 0.000 0.455 108 P HA -0.069 4.351 4.420 -0.000 0.000 0.218 108 P C 1.908 179.078 177.300 -0.216 0.000 1.148 108 P CA 1.108 64.114 63.100 -0.157 0.000 0.822 108 P CB -0.042 31.548 31.700 -0.183 0.000 0.784 109 V N -1.436 118.258 119.914 -0.368 0.000 2.249 109 V HA -0.173 3.946 4.120 -0.002 0.000 0.239 109 V C 2.166 178.077 176.094 -0.306 0.000 1.038 109 V CA 1.680 63.688 62.300 -0.487 0.000 1.005 109 V CB -1.307 29.954 31.823 -0.936 0.000 0.646 109 V HN -0.079 8.111 8.190 -0.000 0.000 0.455 110 F N 0.992 120.866 119.950 -0.127 0.000 2.102 110 F HA 0.309 4.834 4.527 -0.002 0.000 0.298 110 F C 1.473 177.211 175.800 -0.104 0.000 1.105 110 F CA 1.300 59.240 58.000 -0.100 0.000 1.239 110 F CB -1.051 37.895 39.000 -0.090 0.000 0.991 110 F HN 0.385 8.685 8.300 -0.000 0.000 0.474 111 G N -0.701 108.203 108.800 0.173 0.000 2.570 111 G HA2 -0.161 3.798 3.960 -0.002 0.000 0.686 111 G HA3 -0.161 3.798 3.960 -0.002 0.000 0.686 111 G C 0.348 175.410 174.900 0.271 0.000 1.257 111 G CA -0.135 45.083 45.100 0.197 0.000 0.846 111 G HN 0.183 8.473 8.290 -0.000 0.000 0.627 112 E N -0.291 120.144 120.200 0.391 0.000 2.065 112 E HA -0.131 4.218 4.350 -0.002 0.000 0.201 112 E C 2.069 178.777 176.600 0.179 0.000 1.016 112 E CA 1.948 58.489 56.400 0.235 0.000 0.818 112 E CB -0.282 29.500 29.700 0.136 0.000 0.749 112 E HN 1.024 9.384 8.360 -0.000 0.000 0.453 113 G N 0.192 109.118 108.800 0.211 0.000 4.222 113 G HA2 0.365 4.324 3.960 -0.002 0.000 0.301 113 G HA3 0.365 4.324 3.960 -0.002 0.000 0.301 113 G C -0.666 174.258 174.900 0.041 0.000 1.171 113 G CA -0.328 44.829 45.100 0.094 0.000 0.937 113 G HN 0.017 8.307 8.290 -0.000 0.000 0.557 114 V N -0.056 119.866 119.914 0.013 0.000 2.815 114 V HA 0.796 4.915 4.120 -0.002 0.000 0.314 114 V C 1.175 177.100 176.094 -0.282 0.000 1.064 114 V CA 0.189 62.442 62.300 -0.079 0.000 0.952 114 V CB 1.042 32.827 31.823 -0.063 0.000 1.020 114 V HN 0.896 9.086 8.190 -0.000 0.000 0.439 115 A N 2.924 125.535 122.820 -0.348 0.000 5.236 115 A HA -0.321 3.998 4.320 -0.002 0.000 0.326 115 A C 1.067 178.371 177.584 -0.467 0.000 1.825 115 A CA 2.156 53.820 52.037 -0.622 0.000 0.710 115 A CB -2.012 16.139 19.000 -1.415 0.000 1.383 115 A HN 1.087 9.237 8.150 -0.000 0.000 0.386 116 Y N 0.168 120.209 120.300 -0.432 0.000 2.483 116 Y HA 0.154 4.703 4.550 -0.001 0.000 0.291 116 Y C 2.841 178.682 175.900 -0.099 0.000 1.143 116 Y CA 1.456 59.462 58.100 -0.156 0.000 1.289 116 Y CB -0.835 37.582 38.460 -0.072 0.000 0.983 116 Y HN 0.748 9.028 8.280 -0.000 0.000 0.556 117 A N -0.150 122.652 122.820 -0.031 0.000 2.072 117 A HA 0.377 4.696 4.320 -0.002 0.000 0.216 117 A C 1.708 179.262 177.584 -0.050 0.000 1.156 117 A CA 0.497 52.529 52.037 -0.008 0.000 0.701 117 A CB -0.735 18.276 19.000 0.018 0.000 0.816 117 A HN 0.238 8.388 8.150 -0.000 0.000 0.458 118 A N 0.442 123.219 122.820 -0.072 0.000 2.280 118 A HA 0.547 4.866 4.320 -0.002 0.000 0.268 118 A C -2.335 175.165 177.584 -0.140 0.000 1.111 118 A CA -1.326 50.658 52.037 -0.090 0.000 0.814 118 A CB -0.541 18.408 19.000 -0.086 0.000 1.093 118 A HN 0.207 8.357 8.150 -0.000 0.000 0.498 119 P HA 0.005 4.425 4.420 -0.000 0.000 0.265 119 P C -0.091 177.152 177.300 -0.096 0.000 1.187 119 P CA 0.385 63.361 63.100 -0.206 0.000 0.766 119 P CB 0.053 31.672 31.700 -0.136 0.000 0.820 120 Y N 3.419 123.714 120.300 -0.008 0.000 2.165 120 Y HA -0.162 4.386 4.550 -0.002 0.000 0.286 120 Y C -0.395 175.500 175.900 -0.008 0.000 1.155 120 Y CA 1.917 60.023 58.100 0.009 0.000 1.164 120 Y CB -2.812 35.656 38.460 0.014 0.000 0.978 120 Y HN 0.477 8.757 8.280 -0.000 0.000 0.513 121 P HA -0.164 4.256 4.420 -0.000 0.000 0.215 121 P C 1.662 178.967 177.300 0.009 0.000 1.157 121 P CA 1.830 64.960 63.100 0.050 0.000 0.868 121 P CB 0.047 31.761 31.700 0.023 0.000 0.788 122 R N 0.037 120.514 120.500 -0.039 0.000 2.081 122 R HA -0.095 4.244 4.340 -0.002 0.000 0.235 122 R C 2.318 178.592 176.300 -0.043 0.000 1.131 122 R CA 1.719 57.752 56.100 -0.111 0.000 0.960 122 R CB -1.733 28.448 30.300 -0.199 0.000 0.856 122 R HN 0.125 8.395 8.270 -0.000 0.000 0.436 123 M N -0.182 119.414 119.600 -0.007 0.000 2.073 123 M HA -0.276 4.203 4.480 -0.002 0.000 0.258 123 M C 2.163 178.483 176.300 0.032 0.000 1.070 123 M CA 2.382 57.689 55.300 0.012 0.000 1.103 123 M CB -0.277 32.378 32.600 0.092 0.000 1.321 123 M HN 0.128 8.418 8.290 -0.000 0.000 0.405 124 R N 0.422 120.953 120.500 0.051 0.000 2.105 124 R HA -0.140 4.199 4.340 -0.002 0.000 0.239 124 R C 1.826 178.115 176.300 -0.018 0.000 1.135 124 R CA 2.281 58.394 56.100 0.021 0.000 0.967 124 R CB -0.383 29.923 30.300 0.009 0.000 0.861 124 R HN 0.609 8.879 8.270 -0.000 0.000 0.442 125 E N -0.190 120.009 120.200 -0.003 0.000 2.077 125 E HA -0.239 4.110 4.350 -0.002 0.000 0.193 125 E C 2.130 178.768 176.600 0.064 0.000 0.989 125 E CA 1.396 57.775 56.400 -0.034 0.000 0.800 125 E CB -0.080 29.726 29.700 0.176 0.000 0.746 125 E HN 0.517 8.877 8.360 -0.000 0.000 0.452 126 Q N 0.582 120.523 119.800 0.235 0.000 2.030 126 Q HA -0.156 4.183 4.340 -0.002 0.000 0.204 126 Q C 2.417 178.517 176.000 0.166 0.000 0.986 126 Q CA 1.189 57.172 55.803 0.301 0.000 0.843 126 Q CB -0.149 28.691 28.738 0.170 0.000 0.904 126 Q HN 0.297 8.567 8.270 -0.000 0.000 0.420 127 L N 0.763 122.021 121.223 0.059 0.000 2.083 127 L HA -0.211 4.128 4.340 -0.002 0.000 0.209 127 L C 1.932 178.819 176.870 0.028 0.000 1.083 127 L CA 0.743 55.610 54.840 0.044 0.000 0.752 127 L CB -0.493 41.586 42.059 0.034 0.000 0.899 127 L HN 0.273 8.503 8.230 -0.000 0.000 0.433 128 N N -0.116 118.552 118.700 -0.054 0.000 2.120 128 N HA -0.177 4.562 4.740 -0.002 0.000 0.188 128 N C 1.657 177.100 175.510 -0.112 0.000 1.024 128 N CA 1.365 54.334 53.050 -0.135 0.000 0.852 128 N CB -0.374 37.951 38.487 -0.270 0.000 1.003 128 N HN 0.146 8.526 8.380 -0.000 0.000 0.424 129 F N 0.600 120.571 119.950 0.034 0.000 2.102 129 F HA -0.040 4.486 4.527 -0.002 0.000 0.298 129 F C 2.133 177.941 175.800 0.013 0.000 1.105 129 F CA 0.357 58.364 58.000 0.011 0.000 1.239 129 F CB -0.894 38.101 39.000 -0.008 0.000 0.991 129 F HN 0.005 8.305 8.300 -0.000 0.000 0.474 130 L N 0.433 121.782 121.223 0.209 0.000 2.012 130 L HA -0.158 4.181 4.340 -0.002 0.000 0.210 130 L C 2.437 179.363 176.870 0.093 0.000 1.073 130 L CA 2.006 56.924 54.840 0.130 0.000 0.748 130 L CB -1.264 40.867 42.059 0.120 0.000 0.891 130 L HN 0.078 8.308 8.230 -0.000 0.000 0.431 131 A N -0.973 121.892 122.820 0.075 0.000 1.883 131 A HA -0.281 4.038 4.320 -0.002 0.000 0.217 131 A C 2.239 179.848 177.584 0.042 0.000 1.186 131 A CA 1.891 53.961 52.037 0.055 0.000 0.624 131 A CB -0.748 18.272 19.000 0.033 0.000 0.822 131 A HN 0.538 8.688 8.150 -0.000 0.000 0.444 132 E N -1.017 119.208 120.200 0.042 0.000 2.516 132 E HA -0.062 4.287 4.350 -0.002 0.000 0.199 132 E C 1.285 177.909 176.600 0.040 0.000 1.069 132 E CA 0.638 57.056 56.400 0.030 0.000 0.876 132 E CB 0.062 29.787 29.700 0.041 0.000 0.843 132 E HN 0.611 8.971 8.360 -0.000 0.000 0.530 133 E N -1.010 119.225 120.200 0.060 0.000 2.498 133 E HA 0.171 4.520 4.350 -0.002 0.000 0.203 133 E C 0.385 177.033 176.600 0.080 0.000 1.013 133 E CA 0.142 56.580 56.400 0.064 0.000 0.927 133 E CB 0.459 30.200 29.700 0.068 0.000 1.012 133 E HN 0.207 8.567 8.360 -0.000 0.000 0.482 134 L N 0.143 121.412 121.223 0.077 0.000 3.298 134 L HA 0.267 4.606 4.340 -0.002 0.000 0.296 134 L C 0.477 177.427 176.870 0.133 0.000 1.237 134 L CA -0.156 54.778 54.840 0.156 0.000 1.038 134 L CB 0.398 42.511 42.059 0.090 0.000 1.423 134 L HN 0.011 8.241 8.230 -0.000 0.000 0.605 135 T N -1.701 112.825 114.554 -0.045 0.000 2.748 135 T HA 0.123 4.472 4.350 -0.002 0.000 0.304 135 T C 1.640 175.934 174.700 -0.678 0.000 1.041 135 T CA -0.340 61.621 62.100 -0.231 0.000 1.033 135 T CB 1.032 69.802 68.868 -0.164 0.000 0.995 135 T HN 0.286 8.526 8.240 -0.000 0.000 0.536 136 I N -1.296 118.814 120.570 -0.767 0.000 2.700 136 I HA 0.064 4.233 4.170 -0.002 0.000 0.261 136 I C 2.241 178.025 176.117 -0.555 0.000 1.219 136 I CA 1.168 61.879 61.300 -0.981 0.000 1.463 136 I CB -0.781 36.991 38.000 -0.380 0.000 1.092 136 I HN 0.659 8.869 8.210 -0.000 0.000 0.452 137 A N 1.315 123.911 122.820 -0.373 0.000 2.209 137 A HA 0.020 4.339 4.320 -0.002 0.000 0.212 137 A C 2.017 179.446 177.584 -0.259 0.000 1.158 137 A CA 0.659 52.536 52.037 -0.266 0.000 0.742 137 A CB -0.283 18.610 19.000 -0.178 0.000 0.790 137 A HN 0.401 8.551 8.150 -0.000 0.000 0.472 138 K N -1.170 119.057 120.400 -0.290 0.000 2.353 138 K HA 0.246 4.564 4.320 -0.002 0.000 0.195 138 K C 0.688 176.950 176.600 -0.563 0.000 1.031 138 K CA 0.077 56.158 56.287 -0.343 0.000 1.079 138 K CB -0.067 32.278 32.500 -0.259 0.000 0.857 138 K HN 0.667 8.917 8.250 -0.000 0.000 0.535 139 F N 1.325 120.947 119.950 -0.548 0.000 2.710 139 F HA -0.053 4.472 4.527 -0.003 0.000 0.298 139 F C 1.969 177.657 175.800 -0.187 0.000 1.137 139 F CA -0.038 57.742 58.000 -0.367 0.000 1.444 139 F CB 0.348 39.428 39.000 0.133 0.000 1.111 139 F HN 0.019 8.319 8.300 -0.000 0.000 0.580 140 Q N 0.721 120.448 119.800 -0.121 0.000 2.135 140 Q HA -0.206 4.132 4.340 -0.002 0.000 0.204 140 Q C 1.403 177.405 176.000 0.003 0.000 0.981 140 Q CA 1.740 57.491 55.803 -0.088 0.000 0.856 140 Q CB -0.366 28.264 28.738 -0.180 0.000 0.902 140 Q HN 0.438 8.708 8.270 -0.000 0.000 0.425 141 N N -1.176 117.499 118.700 -0.043 0.000 2.409 141 N HA -0.045 4.694 4.740 -0.002 0.000 0.179 141 N C 0.796 176.450 175.510 0.239 0.000 1.032 141 N CA 0.326 53.415 53.050 0.064 0.000 0.898 141 N CB 0.096 38.613 38.487 0.051 0.000 0.971 141 N HN 0.091 8.471 8.380 -0.000 0.000 0.441 142 F N 0.642 120.633 119.950 0.068 0.000 2.163 142 F HA -0.012 4.513 4.527 -0.004 0.000 0.297 142 F C 2.229 178.024 175.800 -0.008 0.000 1.094 142 F CA 0.312 58.327 58.000 0.025 0.000 1.290 142 F CB -0.998 37.987 39.000 -0.024 0.000 1.017 142 F HN -0.168 8.132 8.300 -0.000 0.000 0.483 143 V N 1.489 121.525 119.914 0.204 0.000 2.233 143 V HA -0.237 3.882 4.120 -0.002 0.000 0.247 143 V C -0.291 175.852 176.094 0.081 0.000 1.050 143 V CA 2.299 64.661 62.300 0.104 0.000 1.010 143 V CB -2.043 29.843 31.823 0.105 0.000 0.637 143 V HN 0.142 8.332 8.190 -0.000 0.000 0.444 144 P HA -0.029 4.391 4.420 -0.000 0.000 0.223 144 P C 1.489 178.844 177.300 0.091 0.000 1.151 144 P CA 1.607 64.755 63.100 0.080 0.000 0.787 144 P CB -0.105 31.633 31.700 0.065 0.000 0.788 145 A N -0.037 122.839 122.820 0.093 0.000 1.877 145 A HA -0.153 4.166 4.320 -0.002 0.000 0.216 145 A C 2.211 179.824 177.584 0.048 0.000 1.186 145 A CA 1.362 53.445 52.037 0.076 0.000 0.620 145 A CB -1.544 17.511 19.000 0.091 0.000 0.822 145 A HN 0.108 8.258 8.150 -0.000 0.000 0.443 146 I N -0.944 119.631 120.570 0.008 0.000 2.179 146 I HA -0.285 3.884 4.170 -0.002 0.000 0.242 146 I C 2.842 178.946 176.117 -0.023 0.000 1.088 146 I CA 1.683 62.950 61.300 -0.056 0.000 1.357 146 I CB -0.398 37.532 38.000 -0.116 0.000 1.051 146 I HN 0.467 8.677 8.210 -0.000 0.000 0.409 147 Q N -0.012 119.799 119.800 0.017 0.000 2.119 147 Q HA -0.283 4.056 4.340 -0.002 0.000 0.201 147 Q C 2.208 178.231 176.000 0.039 0.000 0.972 147 Q CA 1.794 57.611 55.803 0.024 0.000 0.847 147 Q CB -0.084 28.680 28.738 0.043 0.000 0.903 147 Q HN 0.553 8.823 8.270 -0.000 0.000 0.433 148 H N 0.203 119.266 119.070 -0.011 0.000 2.321 148 H HA -0.098 4.459 4.556 0.001 0.000 0.300 148 H C 1.760 177.075 175.328 -0.021 0.000 1.087 148 H CA 1.797 57.840 56.048 -0.009 0.000 1.319 148 H CB 0.314 30.076 29.762 -0.000 0.000 1.379 148 H HN 0.155 8.435 8.280 -0.000 0.000 0.501 149 E N -0.030 120.186 120.200 0.027 0.000 2.204 149 E HA -0.084 4.265 4.350 -0.002 0.000 0.194 149 E C 2.482 179.025 176.600 -0.095 0.000 0.989 149 E CA 0.730 57.106 56.400 -0.041 0.000 0.824 149 E CB -0.079 29.615 29.700 -0.010 0.000 0.756 149 E HN 0.386 8.746 8.360 -0.000 0.000 0.477 150 V N 1.284 121.135 119.914 -0.105 0.000 2.379 150 V HA -0.189 3.930 4.120 -0.002 0.000 0.245 150 V C 2.408 178.423 176.094 -0.131 0.000 1.044 150 V CA 1.380 63.597 62.300 -0.138 0.000 1.036 150 V CB -0.317 31.434 31.823 -0.119 0.000 0.664 150 V HN 0.177 8.367 8.190 -0.000 0.000 0.453 151 R N 0.129 120.558 120.500 -0.117 0.000 2.081 151 R HA -0.184 4.155 4.340 -0.002 0.000 0.235 151 R C 2.399 178.604 176.300 -0.158 0.000 1.131 151 R CA 1.590 57.622 56.100 -0.113 0.000 0.960 151 R CB -0.386 29.854 30.300 -0.100 0.000 0.856 151 R HN 0.463 8.733 8.270 -0.000 0.000 0.436 152 K N 0.265 120.532 120.400 -0.221 0.000 2.032 152 K HA -0.189 4.130 4.320 -0.002 0.000 0.209 152 K C 1.997 178.493 176.600 -0.174 0.000 1.048 152 K CA 1.471 57.629 56.287 -0.214 0.000 0.927 152 K CB -0.265 32.090 32.500 -0.242 0.000 0.712 152 K HN 0.004 8.254 8.250 -0.000 0.000 0.441 153 F N 1.497 121.278 119.950 -0.282 0.000 2.046 153 F HA -0.239 4.286 4.527 -0.003 0.000 0.297 153 F C 2.146 177.665 175.800 -0.469 0.000 1.123 153 F CA 1.967 59.761 58.000 -0.343 0.000 1.199 153 F CB -0.196 38.569 39.000 -0.392 0.000 0.972 153 F HN 0.007 8.307 8.300 -0.000 0.000 0.474 154 M N -0.132 119.274 119.600 -0.323 0.000 2.267 154 M HA -0.225 4.254 4.480 -0.002 0.000 0.263 154 M C 2.214 178.350 176.300 -0.274 0.000 1.063 154 M CA 1.649 56.634 55.300 -0.525 0.000 1.090 154 M CB -0.674 31.723 32.600 -0.338 0.000 1.392 154 M HN 0.381 8.671 8.290 -0.000 0.000 0.422 155 A N -0.413 122.290 122.820 -0.195 0.000 2.021 155 A HA 0.251 4.570 4.320 -0.002 0.000 0.216 155 A C 2.247 179.755 177.584 -0.126 0.000 1.163 155 A CA 1.242 53.218 52.037 -0.101 0.000 0.676 155 A CB -0.410 18.541 19.000 -0.082 0.000 0.818 155 A HN 0.452 8.602 8.150 -0.000 0.000 0.453 156 A N -0.306 122.380 122.820 -0.224 0.000 1.943 156 A HA 0.030 4.349 4.320 -0.002 0.000 0.213 156 A C 1.833 179.276 177.584 -0.235 0.000 1.181 156 A CA 1.212 53.123 52.037 -0.211 0.000 0.653 156 A CB -0.157 18.697 19.000 -0.244 0.000 0.833 156 A HN 0.459 8.609 8.150 -0.000 0.000 0.451 157 N N -1.698 116.757 118.700 -0.409 0.000 2.463 157 N HA 0.001 4.740 4.740 -0.002 0.000 0.183 157 N C -0.239 175.265 175.510 -0.010 0.000 1.064 157 N CA 0.411 53.270 53.050 -0.319 0.000 0.879 157 N CB 0.132 38.190 38.487 -0.716 0.000 1.148 157 N HN 0.597 8.977 8.380 -0.000 0.000 0.451 158 W N 2.929 123.968 121.300 -0.434 0.000 2.564 158 W HA 0.259 4.919 4.660 0.000 0.000 0.414 158 W C 0.521 176.865 176.519 -0.291 0.000 0.700 158 W CA -1.258 55.605 57.345 -0.805 0.000 2.430 158 W CB -0.831 27.886 29.460 -1.238 0.000 1.529 158 W HN 0.113 8.293 8.180 -0.000 0.000 0.795 159 D N 0.042 120.517 120.400 0.125 0.000 2.194 159 D HA -0.098 4.541 4.640 -0.002 0.000 0.204 159 D C 0.678 177.113 176.300 0.225 0.000 0.964 159 D CA 1.042 55.129 54.000 0.145 0.000 0.846 159 D CB 0.111 40.951 40.800 0.067 0.000 0.962 159 D HN 0.079 8.449 8.370 -0.000 0.000 0.490 160 K N 0.594 121.195 120.400 0.335 0.000 2.273 160 K HA 0.073 4.392 4.320 -0.002 0.000 0.240 160 K C 1.138 177.902 176.600 0.273 0.000 1.056 160 K CA 0.145 56.578 56.287 0.244 0.000 0.910 160 K CB 0.456 33.058 32.500 0.170 0.000 1.196 160 K HN 0.021 8.271 8.250 -0.000 0.000 0.509 161 D N 0.094 120.567 120.400 0.120 0.000 2.162 161 D HA -0.108 4.531 4.640 -0.002 0.000 0.203 161 D C 0.043 176.346 176.300 0.005 0.000 0.967 161 D CA 1.254 55.298 54.000 0.073 0.000 0.840 161 D CB 0.190 40.999 40.800 0.015 0.000 0.972 161 D HN 0.421 8.791 8.370 -0.000 0.000 0.482 162 E N -0.987 119.133 120.200 -0.134 0.000 2.340 162 E HA 0.601 4.950 4.350 -0.002 0.000 0.273 162 E C -1.050 175.172 176.600 -0.630 0.000 0.891 162 E CA -0.827 55.360 56.400 -0.355 0.000 0.757 162 E CB 2.512 32.089 29.700 -0.205 0.000 1.231 162 E HN 0.225 8.585 8.360 -0.000 0.000 0.439 163 G N 1.675 109.790 108.800 -1.140 0.000 2.547 163 G HA2 0.286 4.245 3.960 -0.002 0.000 0.291 163 G HA3 0.286 4.245 3.960 -0.002 0.000 0.291 163 G C -1.706 172.827 174.900 -0.611 0.000 1.471 163 G CA -0.630 43.944 45.100 -0.877 0.000 0.798 163 G HN 0.425 8.715 8.290 -0.000 0.000 0.504 164 E N -0.596 119.484 120.200 -0.200 0.000 2.183 164 E HA 0.695 5.044 4.350 -0.002 0.000 0.271 164 E C -0.667 175.943 176.600 0.016 0.000 0.919 164 E CA -0.751 55.594 56.400 -0.091 0.000 0.781 164 E CB 1.708 31.366 29.700 -0.071 0.000 1.140 164 E HN 0.657 9.017 8.360 -0.000 0.000 0.402 165 I N 0.157 120.735 120.570 0.012 0.000 3.263 165 I HA 0.449 4.618 4.170 -0.002 0.000 0.314 165 I C -1.206 174.917 176.117 0.010 0.000 1.269 165 I CA -0.996 60.337 61.300 0.054 0.000 0.942 165 I CB 1.743 39.810 38.000 0.111 0.000 1.305 165 I HN 0.359 8.569 8.210 -0.000 0.000 0.474 166 N N 1.171 119.893 118.700 0.037 0.000 2.426 166 N HA 0.411 5.149 4.740 -0.002 0.000 0.257 166 N C 0.432 175.934 175.510 -0.013 0.000 1.002 166 N CA -0.621 52.425 53.050 -0.008 0.000 0.942 166 N CB 1.072 39.556 38.487 -0.004 0.000 1.112 166 N HN 0.777 9.157 8.380 -0.000 0.000 0.499 167 L N 4.446 125.616 121.223 -0.090 0.000 2.056 167 L HA 0.012 4.351 4.340 -0.002 0.000 0.207 167 L C 1.663 178.460 176.870 -0.123 0.000 1.078 167 L CA 1.406 56.171 54.840 -0.124 0.000 0.749 167 L CB -0.677 41.242 42.059 -0.234 0.000 0.901 167 L HN 0.699 8.929 8.230 -0.000 0.000 0.433 168 L N -0.528 120.603 121.223 -0.153 0.000 2.046 168 L HA -0.207 4.132 4.340 -0.002 0.000 0.208 168 L C 2.382 179.186 176.870 -0.111 0.000 1.077 168 L CA 1.760 56.502 54.840 -0.163 0.000 0.747 168 L CB -0.548 41.400 42.059 -0.185 0.000 0.896 168 L HN 0.373 8.603 8.230 -0.000 0.000 0.432 169 E N -0.848 119.314 120.200 -0.064 0.000 2.072 169 E HA -0.201 4.148 4.350 -0.002 0.000 0.191 169 E C 1.758 178.334 176.600 -0.040 0.000 0.985 169 E CA 1.238 57.619 56.400 -0.032 0.000 0.801 169 E CB -0.129 29.579 29.700 0.013 0.000 0.750 169 E HN 0.496 8.856 8.360 -0.000 0.000 0.452 170 D N 0.189 120.596 120.400 0.011 0.000 2.144 170 D HA -0.116 4.523 4.640 -0.002 0.000 0.199 170 D C 1.890 177.971 176.300 -0.364 0.000 0.984 170 D CA 0.696 54.671 54.000 -0.041 0.000 0.834 170 D CB -0.338 40.682 40.800 0.366 0.000 0.955 170 D HN 0.189 8.559 8.370 -0.000 0.000 0.465 171 C N 0.232 119.399 119.300 -0.222 0.000 2.446 171 C HA -0.050 4.409 4.460 -0.002 0.000 0.277 171 C C 2.926 177.753 174.990 -0.271 0.000 1.275 171 C CA 0.605 59.466 59.018 -0.263 0.000 1.727 171 C CB -0.820 26.807 27.740 -0.187 0.000 2.010 171 C HN 0.292 8.522 8.230 -0.000 0.000 0.486 172 S N 0.660 116.232 115.700 -0.214 0.000 2.353 172 S HA -0.195 4.273 4.470 -0.002 0.000 0.222 172 S C 1.884 176.355 174.600 -0.214 0.000 1.035 172 S CA 2.194 60.277 58.200 -0.195 0.000 1.025 172 S CB -0.702 62.412 63.200 -0.143 0.000 0.902 172 S HN 0.711 9.021 8.310 -0.000 0.000 0.440 173 T N 2.485 116.898 114.554 -0.235 0.000 2.720 173 T HA -0.029 4.320 4.350 -0.002 0.000 0.268 173 T C 1.828 176.325 174.700 -0.339 0.000 1.037 173 T CA 1.213 63.184 62.100 -0.214 0.000 1.144 173 T CB -0.322 68.490 68.868 -0.092 0.000 0.864 173 T HN 0.298 8.538 8.240 -0.000 0.000 0.444 174 M N 0.220 119.475 119.600 -0.575 0.000 2.117 174 M HA -0.057 4.421 4.480 -0.002 0.000 0.262 174 M C 2.120 178.240 176.300 -0.300 0.000 1.065 174 M CA 1.375 56.370 55.300 -0.509 0.000 1.114 174 M CB -0.365 31.866 32.600 -0.615 0.000 1.361 174 M HN 0.177 8.467 8.290 -0.000 0.000 0.408 175 I N -0.127 120.284 120.570 -0.264 0.000 2.252 175 I HA -0.232 3.937 4.170 -0.002 0.000 0.245 175 I C 2.412 178.422 176.117 -0.178 0.000 1.102 175 I CA 1.378 62.548 61.300 -0.215 0.000 1.385 175 I CB -0.999 36.882 38.000 -0.199 0.000 1.064 175 I HN 0.263 8.473 8.210 -0.000 0.000 0.414 176 I N 1.512 121.991 120.570 -0.150 0.000 2.493 176 I HA -0.238 3.931 4.170 -0.002 0.000 0.254 176 I C 2.014 178.070 176.117 -0.102 0.000 1.160 176 I CA 1.370 62.614 61.300 -0.093 0.000 1.445 176 I CB -0.484 37.500 38.000 -0.026 0.000 1.086 176 I HN 0.169 8.379 8.210 -0.000 0.000 0.433 177 N N -0.014 118.618 118.700 -0.114 0.000 2.135 177 N HA -0.136 4.603 4.740 -0.002 0.000 0.186 177 N C 1.941 177.380 175.510 -0.119 0.000 1.027 177 N CA 2.138 55.134 53.050 -0.089 0.000 0.849 177 N CB -0.906 37.539 38.487 -0.070 0.000 1.002 177 N HN 0.526 8.906 8.380 -0.000 0.000 0.425 178 T N -1.045 113.418 114.554 -0.152 0.000 2.708 178 T HA -0.017 4.332 4.350 -0.002 0.000 0.266 178 T C 2.030 176.612 174.700 -0.197 0.000 1.037 178 T CA 1.446 63.446 62.100 -0.166 0.000 1.146 178 T CB -0.690 68.056 68.868 -0.203 0.000 0.865 178 T HN 0.167 8.407 8.240 -0.000 0.000 0.435 179 A N 0.898 123.600 122.820 -0.197 0.000 1.883 179 A HA -0.082 4.237 4.320 -0.002 0.000 0.217 179 A C 2.771 180.105 177.584 -0.418 0.000 1.186 179 A CA 1.724 53.648 52.037 -0.189 0.000 0.624 179 A CB -1.490 17.437 19.000 -0.122 0.000 0.822 179 A HN 0.746 8.896 8.150 -0.000 0.000 0.444 180 C N -1.433 117.573 119.300 -0.489 0.000 2.435 180 C HA -0.024 4.435 4.460 -0.002 0.000 0.279 180 C C 2.744 177.507 174.990 -0.378 0.000 1.321 180 C CA 1.173 59.737 59.018 -0.758 0.000 1.752 180 C CB -1.137 26.304 27.740 -0.499 0.000 1.959 180 C HN 0.744 8.974 8.230 -0.000 0.000 0.500 181 Q N 0.060 119.730 119.800 -0.218 0.000 2.224 181 Q HA -0.101 4.238 4.340 -0.002 0.000 0.203 181 Q C 2.069 177.999 176.000 -0.117 0.000 0.970 181 Q CA 1.756 57.495 55.803 -0.105 0.000 0.865 181 Q CB -0.439 28.269 28.738 -0.051 0.000 0.922 181 Q HN 0.701 8.971 8.270 -0.000 0.000 0.445 182 C N -1.107 118.043 119.300 -0.250 0.000 2.544 182 C HA 0.094 4.553 4.460 -0.002 0.000 0.280 182 C C 2.220 177.031 174.990 -0.298 0.000 1.295 182 C CA 0.351 59.116 59.018 -0.421 0.000 1.702 182 C CB -0.758 26.420 27.740 -0.936 0.000 2.090 182 C HN 0.503 8.733 8.230 -0.000 0.000 0.493 183 L N -1.159 119.846 121.223 -0.362 0.000 2.477 183 L HA 0.204 4.543 4.340 -0.002 0.000 0.220 183 L C -0.211 176.709 176.870 0.083 0.000 1.106 183 L CA 0.538 55.253 54.840 -0.208 0.000 0.851 183 L CB -0.190 41.644 42.059 -0.376 0.000 0.994 183 L HN 0.190 8.420 8.230 -0.000 0.000 0.462 184 F N 0.371 120.257 119.950 -0.107 0.000 2.469 184 F HA 0.587 5.112 4.527 -0.004 0.000 0.332 184 F C 0.922 176.692 175.800 -0.050 0.000 1.103 184 F CA -1.841 56.102 58.000 -0.095 0.000 0.979 184 F CB 0.907 39.825 39.000 -0.137 0.000 1.137 184 F HN -0.233 8.067 8.300 -0.000 0.000 0.463 185 G N 1.104 109.992 108.800 0.147 0.000 2.599 185 G HA2 0.141 4.099 3.960 -0.002 0.000 0.264 185 G HA3 0.141 4.099 3.960 -0.002 0.000 0.264 185 G C 0.762 175.696 174.900 0.058 0.000 1.200 185 G CA -0.289 44.857 45.100 0.077 0.000 0.896 185 G HN 0.729 9.019 8.290 -0.000 0.000 0.536 186 E N -0.210 120.012 120.200 0.037 0.000 2.085 186 E HA -0.202 4.147 4.350 -0.002 0.000 0.194 186 E C 2.139 178.750 176.600 0.018 0.000 0.994 186 E CA 1.658 58.075 56.400 0.028 0.000 0.801 186 E CB 0.070 29.780 29.700 0.016 0.000 0.743 186 E HN 0.684 9.044 8.360 -0.000 0.000 0.453 187 D N 0.807 121.212 120.400 0.007 0.000 2.144 187 D HA -0.206 4.433 4.640 -0.002 0.000 0.199 187 D C 2.147 178.438 176.300 -0.015 0.000 0.984 187 D CA 0.735 54.733 54.000 -0.004 0.000 0.834 187 D CB -0.530 40.263 40.800 -0.011 0.000 0.955 187 D HN 0.236 8.606 8.370 -0.000 0.000 0.465 188 L N 0.476 121.682 121.223 -0.029 0.000 2.072 188 L HA 0.059 4.398 4.340 -0.002 0.000 0.205 188 L C 2.449 179.294 176.870 -0.042 0.000 1.079 188 L CA 1.371 56.163 54.840 -0.081 0.000 0.752 188 L CB -0.505 41.441 42.059 -0.188 0.000 0.906 188 L HN -0.201 8.029 8.230 -0.000 0.000 0.436 189 R N -0.399 120.115 120.500 0.023 0.000 2.193 189 R HA -0.108 4.231 4.340 -0.002 0.000 0.229 189 R C 2.101 178.427 176.300 0.043 0.000 1.110 189 R CA 1.143 57.283 56.100 0.066 0.000 0.988 189 R CB -0.184 30.172 30.300 0.095 0.000 0.871 189 R HN 0.378 8.648 8.270 -0.000 0.000 0.458 190 K N -0.273 120.141 120.400 0.023 0.000 2.217 190 K HA -0.028 4.291 4.320 -0.002 0.000 0.202 190 K C 1.897 178.508 176.600 0.018 0.000 1.051 190 K CA 0.842 57.141 56.287 0.020 0.000 0.952 190 K CB 0.207 32.715 32.500 0.012 0.000 0.736 190 K HN 0.018 8.268 8.250 -0.000 0.000 0.453 191 R N -0.094 120.412 120.500 0.010 0.000 2.128 191 R HA 0.121 4.460 4.340 -0.002 0.000 0.211 191 R C 0.380 176.697 176.300 0.028 0.000 1.067 191 R CA 0.478 56.585 56.100 0.011 0.000 1.010 191 R CB -0.077 30.220 30.300 -0.006 0.000 0.922 191 R HN 0.038 8.308 8.270 -0.000 0.000 0.457 192 L N 3.171 124.413 121.223 0.032 0.000 2.445 192 L HA 0.165 4.504 4.340 -0.002 0.000 0.252 192 L C -0.695 176.247 176.870 0.121 0.000 1.105 192 L CA -0.606 54.279 54.840 0.075 0.000 0.943 192 L CB 0.725 42.810 42.059 0.043 0.000 1.277 192 L HN 0.061 8.291 8.230 -0.000 0.000 0.465 193 D N 1.483 121.951 120.400 0.113 0.000 2.384 193 D HA 0.141 4.780 4.640 -0.002 0.000 0.244 193 D C 1.237 177.642 176.300 0.174 0.000 1.251 193 D CA 0.210 54.284 54.000 0.124 0.000 0.961 193 D CB 1.110 41.961 40.800 0.085 0.000 1.116 193 D HN 0.294 8.664 8.370 -0.000 0.000 0.484 194 A N 0.917 123.825 122.820 0.147 0.000 1.940 194 A HA -0.234 4.085 4.320 -0.002 0.000 0.219 194 A C 2.253 179.934 177.584 0.163 0.000 1.176 194 A CA 1.577 53.709 52.037 0.159 0.000 0.631 194 A CB -0.558 18.487 19.000 0.074 0.000 0.814 194 A HN 0.640 8.790 8.150 -0.000 0.000 0.446 195 R N -1.254 119.315 120.500 0.114 0.000 2.073 195 R HA -0.151 4.188 4.340 -0.002 0.000 0.234 195 R C 2.464 178.821 176.300 0.094 0.000 1.134 195 R CA 1.676 57.829 56.100 0.088 0.000 0.952 195 R CB -0.282 30.058 30.300 0.066 0.000 0.850 195 R HN 0.466 8.736 8.270 -0.000 0.000 0.433 196 R N 0.632 121.201 120.500 0.115 0.000 2.075 196 R HA -0.072 4.267 4.340 -0.002 0.000 0.226 196 R C 1.852 178.231 176.300 0.132 0.000 1.114 196 R CA 1.238 57.400 56.100 0.103 0.000 0.972 196 R CB -0.807 29.552 30.300 0.098 0.000 0.869 196 R HN 0.161 8.431 8.270 -0.000 0.000 0.437 197 F N 0.926 120.921 119.950 0.075 0.000 2.134 197 F HA -0.032 4.495 4.527 -0.000 0.000 0.299 197 F C 1.955 177.801 175.800 0.075 0.000 1.097 197 F CA 1.525 59.585 58.000 0.099 0.000 1.264 197 F CB -0.635 38.480 39.000 0.191 0.000 1.001 197 F HN 0.149 8.449 8.300 -0.000 0.000 0.479 198 A N 0.092 122.973 122.820 0.103 0.000 1.873 198 A HA -0.312 4.006 4.320 -0.002 0.000 0.218 198 A C 2.200 179.733 177.584 -0.085 0.000 1.193 198 A CA 2.143 54.178 52.037 -0.005 0.000 0.629 198 A CB -1.130 17.895 19.000 0.042 0.000 0.826 198 A HN 0.585 8.735 8.150 -0.000 0.000 0.447 199 Q N -0.798 118.976 119.800 -0.044 0.000 2.077 199 Q HA -0.169 4.170 4.340 -0.002 0.000 0.206 199 Q C 2.159 178.106 176.000 -0.089 0.000 0.989 199 Q CA 1.752 57.529 55.803 -0.043 0.000 0.853 199 Q CB -0.305 28.426 28.738 -0.011 0.000 0.907 199 Q HN 0.722 8.992 8.270 -0.000 0.000 0.418 200 L N 0.231 121.367 121.223 -0.145 0.000 2.141 200 L HA -0.162 4.177 4.340 -0.002 0.000 0.209 200 L C 2.380 179.094 176.870 -0.260 0.000 1.094 200 L CA 0.495 55.227 54.840 -0.180 0.000 0.763 200 L CB -0.336 41.616 42.059 -0.179 0.000 0.908 200 L HN 0.330 8.560 8.230 -0.000 0.000 0.437 201 L N -0.097 120.883 121.223 -0.405 0.000 2.027 201 L HA -0.195 4.144 4.340 -0.002 0.000 0.206 201 L C 2.763 179.568 176.870 -0.108 0.000 1.074 201 L CA 1.565 56.213 54.840 -0.320 0.000 0.745 201 L CB -0.354 41.489 42.059 -0.361 0.000 0.898 201 L HN 0.265 8.495 8.230 -0.000 0.000 0.433 202 A N -0.306 122.473 122.820 -0.069 0.000 1.940 202 A HA -0.261 4.057 4.320 -0.002 0.000 0.219 202 A C 2.349 179.917 177.584 -0.027 0.000 1.176 202 A CA 1.792 53.826 52.037 -0.005 0.000 0.631 202 A CB -0.478 18.524 19.000 0.003 0.000 0.814 202 A HN 0.360 8.510 8.150 -0.000 0.000 0.446 203 K N -1.007 119.359 120.400 -0.057 0.000 2.026 203 K HA -0.124 4.195 4.320 -0.002 0.000 0.208 203 K C 2.153 178.709 176.600 -0.074 0.000 1.048 203 K CA 1.799 58.054 56.287 -0.055 0.000 0.929 203 K CB -0.288 32.179 32.500 -0.056 0.000 0.713 203 K HN 0.560 8.810 8.250 -0.000 0.000 0.439 204 M N 0.503 120.042 119.600 -0.101 0.000 2.065 204 M HA -0.209 4.270 4.480 -0.002 0.000 0.259 204 M C 1.849 178.069 176.300 -0.134 0.000 1.069 204 M CA 1.769 56.989 55.300 -0.133 0.000 1.110 204 M CB -0.306 32.201 32.600 -0.154 0.000 1.328 204 M HN 0.140 8.430 8.290 -0.000 0.000 0.405 205 E N 0.028 120.173 120.200 -0.091 0.000 2.209 205 E HA -0.173 4.176 4.350 -0.002 0.000 0.196 205 E C 1.952 178.532 176.600 -0.032 0.000 0.993 205 E CA 1.532 57.900 56.400 -0.055 0.000 0.819 205 E CB -0.234 29.518 29.700 0.087 0.000 0.745 205 E HN 0.562 8.922 8.360 -0.000 0.000 0.477 206 S N 0.390 116.073 115.700 -0.029 0.000 2.507 206 S HA -0.090 4.379 4.470 -0.002 0.000 0.235 206 S C 1.794 176.381 174.600 -0.023 0.000 0.988 206 S CA 1.062 59.254 58.200 -0.015 0.000 0.944 206 S CB -0.042 63.150 63.200 -0.013 0.000 0.762 206 S HN 0.190 8.500 8.310 -0.000 0.000 0.526 207 S N 0.052 115.722 115.700 -0.050 0.000 2.578 207 S HA 0.406 4.875 4.470 -0.002 0.000 0.231 207 S C 0.208 174.793 174.600 -0.026 0.000 0.994 207 S CA -0.771 57.399 58.200 -0.049 0.000 0.956 207 S CB -0.491 62.648 63.200 -0.102 0.000 0.870 207 S HN 0.450 8.760 8.310 -0.000 0.000 0.494 208 L N 2.207 123.423 121.223 -0.013 0.000 2.416 208 L HA 0.411 4.750 4.340 -0.002 0.000 0.272 208 L C -0.349 176.571 176.870 0.083 0.000 1.161 208 L CA -0.067 54.805 54.840 0.053 0.000 0.845 208 L CB 0.728 42.824 42.059 0.062 0.000 1.119 208 L HN 0.348 8.578 8.230 -0.000 0.000 0.464 209 I N 4.322 124.965 120.570 0.122 0.000 2.537 209 I HA 0.217 4.386 4.170 -0.002 0.000 0.276 209 I C -1.782 174.290 176.117 -0.075 0.000 1.063 209 I CA -1.527 59.800 61.300 0.044 0.000 1.144 209 I CB 1.225 39.246 38.000 0.035 0.000 1.252 209 I HN 0.397 8.607 8.210 -0.000 0.000 0.480 210 P HA -0.193 4.227 4.420 -0.000 0.000 0.219 210 P C 1.701 178.723 177.300 -0.464 0.000 1.146 210 P CA 1.033 63.693 63.100 -0.734 0.000 0.808 210 P CB 0.326 31.775 31.700 -0.419 0.000 0.779 211 A N 0.443 123.169 122.820 -0.157 0.000 2.042 211 A HA -0.212 4.107 4.320 -0.002 0.000 0.222 211 A C 2.293 179.834 177.584 -0.073 0.000 1.167 211 A CA 2.048 54.078 52.037 -0.011 0.000 0.649 211 A CB -1.577 17.445 19.000 0.036 0.000 0.809 211 A HN 0.236 8.386 8.150 -0.000 0.000 0.457 212 A N -0.519 122.213 122.820 -0.147 0.000 2.076 212 A HA 0.012 4.331 4.320 -0.002 0.000 0.220 212 A C 2.097 179.567 177.584 -0.190 0.000 1.160 212 A CA 1.575 53.556 52.037 -0.093 0.000 0.653 212 A CB -0.873 18.133 19.000 0.010 0.000 0.801 212 A HN 0.465 8.615 8.150 -0.000 0.000 0.455 213 V N -1.537 118.106 119.914 -0.451 0.000 2.370 213 V HA -0.292 3.827 4.120 -0.002 0.000 0.252 213 V C 1.890 177.492 176.094 -0.820 0.000 1.068 213 V CA 2.297 64.178 62.300 -0.698 0.000 1.061 213 V CB -0.934 30.240 31.823 -1.082 0.000 0.656 213 V HN 0.660 8.850 8.190 -0.000 0.000 0.455 214 F N -1.776 118.139 119.950 -0.059 0.000 2.682 214 F HA 0.461 4.987 4.527 -0.002 0.000 0.308 214 F C 0.667 176.449 175.800 -0.030 0.000 1.093 214 F CA -0.056 57.916 58.000 -0.047 0.000 1.244 214 F CB 0.208 39.168 39.000 -0.068 0.000 1.052 214 F HN -0.048 8.252 8.300 -0.000 0.000 0.573 215 L N 1.489 122.756 121.223 0.073 0.000 2.502 215 L HA 0.330 4.669 4.340 -0.002 0.000 0.249 215 L C -1.836 175.049 176.870 0.024 0.000 1.446 215 L CA -1.374 53.498 54.840 0.053 0.000 0.887 215 L CB 1.301 43.394 42.059 0.057 0.000 1.126 215 L HN -0.216 8.014 8.230 -0.000 0.000 0.509 216 P HA -0.220 4.200 4.420 -0.000 0.000 0.217 216 P C 1.742 179.061 177.300 0.031 0.000 1.148 216 P CA 0.974 64.088 63.100 0.022 0.000 0.834 216 P CB 0.387 32.099 31.700 0.020 0.000 0.783 217 I N -0.729 119.858 120.570 0.029 0.000 2.300 217 I HA -0.236 3.933 4.170 -0.002 0.000 0.252 217 I C 1.872 178.009 176.117 0.033 0.000 1.119 217 I CA 1.430 62.747 61.300 0.029 0.000 1.384 217 I CB -0.881 37.134 38.000 0.025 0.000 1.062 217 I HN -0.115 8.095 8.210 -0.000 0.000 0.426 218 L N -0.897 120.347 121.223 0.035 0.000 2.291 218 L HA -0.139 4.200 4.340 -0.002 0.000 0.214 218 L C 2.172 179.071 176.870 0.048 0.000 1.120 218 L CA 0.672 55.534 54.840 0.037 0.000 0.799 218 L CB -0.517 41.562 42.059 0.033 0.000 0.925 218 L HN 0.254 8.484 8.230 -0.000 0.000 0.446 219 L N -0.413 120.844 121.223 0.057 0.000 2.478 219 L HA -0.088 4.251 4.340 -0.002 0.000 0.223 219 L C 1.898 178.806 176.870 0.064 0.000 1.140 219 L CA 0.827 55.710 54.840 0.072 0.000 0.842 219 L CB -0.198 41.912 42.059 0.086 0.000 0.953 219 L HN 0.256 8.486 8.230 -0.000 0.000 0.452 220 K N -0.717 119.713 120.400 0.050 0.000 2.355 220 K HA 0.229 4.548 4.320 -0.002 0.000 0.198 220 K C -0.291 176.332 176.600 0.038 0.000 1.039 220 K CA -0.223 56.089 56.287 0.042 0.000 1.075 220 K CB 0.915 33.434 32.500 0.033 0.000 0.870 220 K HN 0.008 8.258 8.250 -0.000 0.000 0.540 221 L N 2.468 123.715 121.223 0.039 0.000 2.307 221 L HA 0.352 4.691 4.340 -0.002 0.000 0.284 221 L C -2.523 174.371 176.870 0.040 0.000 1.023 221 L CA -2.555 52.305 54.840 0.034 0.000 0.810 221 L CB 1.074 43.150 42.059 0.029 0.000 1.231 221 L HN -0.143 8.087 8.230 -0.000 0.000 0.423 222 P HA 0.104 4.524 4.420 -0.000 0.000 0.258 222 P C -0.846 176.474 177.300 0.034 0.000 1.172 222 P CA 0.426 63.550 63.100 0.040 0.000 0.762 222 P CB 0.237 31.956 31.700 0.032 0.000 0.764 223 L N 6.176 127.421 121.223 0.037 0.000 2.301 223 L HA 0.424 4.763 4.340 -0.002 0.000 0.264 223 L C -1.329 175.557 176.870 0.027 0.000 1.016 223 L CA -2.301 52.556 54.840 0.029 0.000 0.821 223 L CB 2.097 44.173 42.059 0.029 0.000 1.346 223 L HN 0.167 8.397 8.230 -0.000 0.000 0.429 224 P HA -0.105 4.315 4.420 -0.000 0.000 0.222 224 P C 0.595 177.905 177.300 0.017 0.000 1.147 224 P CA 1.087 64.198 63.100 0.019 0.000 0.790 224 P CB 0.251 31.960 31.700 0.015 0.000 0.780 225 Q N -1.239 118.569 119.800 0.014 0.000 2.282 225 Q HA 0.160 4.499 4.340 -0.002 0.000 0.206 225 Q C 1.762 177.758 176.000 -0.005 0.000 0.878 225 Q CA 0.057 55.862 55.803 0.004 0.000 0.944 225 Q CB -0.102 28.636 28.738 -0.000 0.000 1.100 225 Q HN 0.176 8.446 8.270 -0.000 0.000 0.509 226 S N 1.922 117.631 115.700 0.014 0.000 2.389 226 S HA -0.275 4.194 4.470 -0.002 0.000 0.231 226 S C 2.014 176.625 174.600 0.018 0.000 1.052 226 S CA 1.676 59.892 58.200 0.027 0.000 1.053 226 S CB -0.147 63.097 63.200 0.074 0.000 0.886 226 S HN 0.585 8.895 8.310 -0.000 0.000 0.456 227 A N 1.102 123.957 122.820 0.057 0.000 2.067 227 A HA 0.028 4.347 4.320 -0.002 0.000 0.217 227 A C 2.085 179.687 177.584 0.030 0.000 1.156 227 A CA 0.518 52.625 52.037 0.116 0.000 0.683 227 A CB -0.203 18.850 19.000 0.088 0.000 0.808 227 A HN 0.288 8.438 8.150 -0.000 0.000 0.455 228 R N 0.007 120.483 120.500 -0.040 0.000 2.073 228 R HA -0.134 4.205 4.340 -0.002 0.000 0.229 228 R C 2.340 178.589 176.300 -0.084 0.000 1.120 228 R CA 1.685 57.759 56.100 -0.044 0.000 0.967 228 R CB -1.320 28.954 30.300 -0.043 0.000 0.862 228 R HN 0.817 9.087 8.270 -0.000 0.000 0.436 229 C N -0.067 119.122 119.300 -0.184 0.000 2.432 229 C HA 0.056 4.515 4.460 -0.002 0.000 0.280 229 C C 2.369 177.257 174.990 -0.169 0.000 1.353 229 C CA 0.109 59.002 59.018 -0.208 0.000 1.766 229 C CB -1.086 26.483 27.740 -0.285 0.000 1.924 229 C HN 0.348 8.578 8.230 -0.000 0.000 0.509 230 H N 1.423 120.494 119.070 0.002 0.000 2.395 230 H HA -0.005 4.549 4.556 -0.002 0.000 0.299 230 H C 2.140 177.474 175.328 0.009 0.000 1.070 230 H CA 2.010 58.065 56.048 0.011 0.000 1.356 230 H CB -0.378 29.391 29.762 0.011 0.000 1.401 230 H HN 0.698 8.978 8.280 -0.000 0.000 0.524 231 E N 0.803 121.067 120.200 0.106 0.000 2.047 231 E HA -0.066 4.283 4.350 -0.002 0.000 0.191 231 E C 2.501 179.122 176.600 0.035 0.000 0.987 231 E CA 0.847 57.284 56.400 0.061 0.000 0.799 231 E CB -0.034 29.689 29.700 0.038 0.000 0.752 231 E HN 0.360 8.720 8.360 -0.000 0.000 0.449 232 A N 1.605 124.430 122.820 0.009 0.000 1.908 232 A HA -0.241 4.078 4.320 -0.002 0.000 0.218 232 A C 2.140 179.728 177.584 0.007 0.000 1.181 232 A CA 1.779 53.810 52.037 -0.011 0.000 0.627 232 A CB -0.484 18.487 19.000 -0.048 0.000 0.818 232 A HN 0.095 8.245 8.150 -0.000 0.000 0.445 233 R N -0.632 119.884 120.500 0.027 0.000 2.073 233 R HA -0.115 4.224 4.340 -0.002 0.000 0.229 233 R C 2.432 178.775 176.300 0.072 0.000 1.120 233 R CA 2.055 58.190 56.100 0.057 0.000 0.967 233 R CB -0.508 29.848 30.300 0.094 0.000 0.862 233 R HN 0.624 8.894 8.270 -0.000 0.000 0.436 234 T N -1.357 113.240 114.554 0.072 0.000 2.915 234 T HA -0.137 4.212 4.350 -0.002 0.000 0.269 234 T C 1.681 176.407 174.700 0.044 0.000 1.071 234 T CA 1.469 63.605 62.100 0.060 0.000 1.132 234 T CB -0.044 68.854 68.868 0.050 0.000 0.878 234 T HN 0.405 8.645 8.240 -0.000 0.000 0.479 235 E N 0.510 120.732 120.200 0.037 0.000 2.107 235 E HA -0.025 4.324 4.350 -0.002 0.000 0.191 235 E C 2.006 178.625 176.600 0.033 0.000 0.982 235 E CA 0.860 57.277 56.400 0.029 0.000 0.809 235 E CB -0.591 29.123 29.700 0.023 0.000 0.756 235 E HN 0.466 8.826 8.360 -0.000 0.000 0.459 236 L N 0.744 121.991 121.223 0.041 0.000 2.056 236 L HA -0.128 4.211 4.340 -0.002 0.000 0.207 236 L C 2.031 178.925 176.870 0.040 0.000 1.078 236 L CA 1.830 56.702 54.840 0.053 0.000 0.749 236 L CB -0.615 41.490 42.059 0.077 0.000 0.901 236 L HN 0.201 8.431 8.230 -0.000 0.000 0.433 237 Q N -0.321 119.506 119.800 0.046 0.000 2.046 237 Q HA -0.252 4.087 4.340 -0.002 0.000 0.200 237 Q C 2.208 178.221 176.000 0.023 0.000 0.975 237 Q CA 1.695 57.523 55.803 0.041 0.000 0.836 237 Q CB -0.361 28.414 28.738 0.063 0.000 0.896 237 Q HN 0.523 8.793 8.270 -0.000 0.000 0.428 238 K N 1.151 121.564 120.400 0.023 0.000 2.052 238 K HA -0.232 4.087 4.320 -0.002 0.000 0.215 238 K C 1.949 178.552 176.600 0.005 0.000 1.053 238 K CA 1.582 57.878 56.287 0.014 0.000 0.934 238 K CB -0.222 32.287 32.500 0.015 0.000 0.717 238 K HN 0.197 8.447 8.250 -0.000 0.000 0.450 239 I N 0.936 121.509 120.570 0.005 0.000 2.202 239 I HA -0.282 3.887 4.170 -0.002 0.000 0.242 239 I C 2.421 178.523 176.117 -0.024 0.000 1.091 239 I CA 0.891 62.187 61.300 -0.006 0.000 1.368 239 I CB -0.216 37.783 38.000 -0.002 0.000 1.058 239 I HN 0.228 8.438 8.210 -0.000 0.000 0.410 240 L N -0.106 121.099 121.223 -0.030 0.000 2.012 240 L HA -0.279 4.060 4.340 -0.002 0.000 0.210 240 L C 2.773 179.622 176.870 -0.035 0.000 1.073 240 L CA 1.596 56.406 54.840 -0.050 0.000 0.748 240 L CB -0.686 41.345 42.059 -0.047 0.000 0.891 240 L HN 0.248 8.478 8.230 -0.000 0.000 0.431 241 S N -0.291 115.399 115.700 -0.017 0.000 2.365 241 S HA -0.254 4.215 4.470 -0.002 0.000 0.225 241 S C 1.848 176.439 174.600 -0.016 0.000 1.039 241 S CA 1.828 60.020 58.200 -0.013 0.000 1.033 241 S CB -0.153 63.046 63.200 -0.002 0.000 0.887 241 S HN 0.435 8.745 8.310 -0.000 0.000 0.447 242 E N 0.114 120.306 120.200 -0.015 0.000 2.110 242 E HA -0.088 4.261 4.350 -0.002 0.000 0.193 242 E C 2.048 178.635 176.600 -0.021 0.000 0.988 242 E CA 1.140 57.532 56.400 -0.014 0.000 0.804 242 E CB -0.107 29.587 29.700 -0.011 0.000 0.745 242 E HN 0.452 8.812 8.360 -0.000 0.000 0.458 243 I N 0.902 121.454 120.570 -0.030 0.000 2.252 243 I HA -0.240 3.929 4.170 -0.002 0.000 0.245 243 I C 2.314 178.410 176.117 -0.034 0.000 1.102 243 I CA 1.254 62.532 61.300 -0.037 0.000 1.385 243 I CB -0.674 37.291 38.000 -0.058 0.000 1.064 243 I HN 0.187 8.397 8.210 -0.000 0.000 0.414 244 I N 0.682 121.231 120.570 -0.035 0.000 2.208 244 I HA -0.321 3.848 4.170 -0.002 0.000 0.245 244 I C 2.526 178.629 176.117 -0.025 0.000 1.097 244 I CA 1.571 62.851 61.300 -0.032 0.000 1.363 244 I CB -0.209 37.772 38.000 -0.031 0.000 1.051 244 I HN 0.119 8.329 8.210 -0.000 0.000 0.413 245 I N 0.610 121.168 120.570 -0.020 0.000 2.315 245 I HA -0.248 3.921 4.170 -0.002 0.000 0.248 245 I C 2.733 178.841 176.117 -0.015 0.000 1.117 245 I CA 1.211 62.501 61.300 -0.016 0.000 1.404 245 I CB -0.426 37.567 38.000 -0.013 0.000 1.071 245 I HN 0.169 8.379 8.210 -0.000 0.000 0.419 246 A N 0.505 123.316 122.820 -0.016 0.000 1.969 246 A HA -0.193 4.126 4.320 -0.002 0.000 0.218 246 A C 2.338 179.913 177.584 -0.015 0.000 1.169 246 A CA 1.383 53.411 52.037 -0.014 0.000 0.635 246 A CB -0.458 18.534 19.000 -0.014 0.000 0.810 246 A HN 0.251 8.401 8.150 -0.000 0.000 0.445 247 R N -0.244 120.245 120.500 -0.018 0.000 2.075 247 R HA -0.033 4.306 4.340 -0.002 0.000 0.232 247 R C 2.063 178.353 176.300 -0.017 0.000 1.126 247 R CA 1.789 57.878 56.100 -0.019 0.000 0.963 247 R CB -0.185 30.101 30.300 -0.024 0.000 0.858 247 R HN 0.496 8.766 8.270 -0.000 0.000 0.435 248 K N -0.789 119.600 120.400 -0.018 0.000 2.155 248 K HA 0.016 4.335 4.320 -0.002 0.000 0.203 248 K C 1.868 178.460 176.600 -0.013 0.000 1.052 248 K CA 1.112 57.389 56.287 -0.016 0.000 0.948 248 K CB 0.074 32.563 32.500 -0.017 0.000 0.728 248 K HN 0.177 8.427 8.250 -0.000 0.000 0.448 249 A N 0.968 123.781 122.820 -0.012 0.000 1.929 249 A HA -0.012 4.306 4.320 -0.002 0.000 0.216 249 A C 2.209 179.788 177.584 -0.009 0.000 1.176 249 A CA 1.589 53.620 52.037 -0.010 0.000 0.628 249 A CB -0.418 18.577 19.000 -0.009 0.000 0.816 249 A HN 0.296 8.446 8.150 -0.000 0.000 0.444 250 A N -0.676 122.138 122.820 -0.010 0.000 2.119 250 A HA 0.431 4.750 4.320 -0.002 0.000 0.216 250 A C 2.135 179.713 177.584 -0.010 0.000 1.152 250 A CA 1.246 53.278 52.037 -0.009 0.000 0.708 250 A CB -0.497 18.497 19.000 -0.009 0.000 0.805 250 A HN 0.884 9.034 8.150 -0.000 0.000 0.460 251 A N -0.603 122.210 122.820 -0.011 0.000 2.169 251 A HA 0.269 4.588 4.320 -0.002 0.000 0.212 251 A C 1.877 179.454 177.584 -0.010 0.000 1.153 251 A CA 1.132 53.162 52.037 -0.012 0.000 0.756 251 A CB -0.296 18.695 19.000 -0.014 0.000 0.813 251 A HN 0.289 8.439 8.150 -0.000 0.000 0.471 252 V N 0.293 120.201 119.914 -0.010 0.000 2.446 252 V HA -0.133 3.986 4.120 -0.002 0.000 0.244 252 V C 2.148 178.238 176.094 -0.007 0.000 1.039 252 V CA 1.799 64.094 62.300 -0.008 0.000 1.045 252 V CB -0.815 31.003 31.823 -0.008 0.000 0.681 252 V HN 0.468 8.658 8.190 -0.000 0.000 0.459 253 N N -0.157 118.538 118.700 -0.007 0.000 2.188 253 N HA -0.037 4.702 4.740 -0.002 0.000 0.184 253 N C 0.501 176.007 175.510 -0.006 0.000 1.018 253 N CA 0.582 53.629 53.050 -0.006 0.000 0.858 253 N CB -0.095 38.388 38.487 -0.006 0.000 0.989 253 N HN 0.583 8.963 8.380 -0.000 0.000 0.426 257 S N -0.654 115.041 115.700 -0.008 0.000 1.616 257 S HA -0.168 4.301 4.470 -0.002 0.000 0.237 257 S C 0.334 174.931 174.600 -0.005 0.000 0.811 257 S CA 2.434 60.629 58.200 -0.007 0.000 1.381 257 S CB -1.848 61.348 63.200 -0.007 0.000 1.728 257 S HN 1.794 10.104 8.310 -0.000 0.000 0.522 258 T N 3.155 117.709 114.554 0.000 0.000 2.756 258 T HA 0.600 4.949 4.350 -0.002 0.000 0.290 258 T C -0.079 174.628 174.700 0.011 0.000 0.985 258 T CA 0.143 62.248 62.100 0.008 0.000 0.955 258 T CB 1.455 70.333 68.868 0.016 0.000 0.930 258 T HN 0.726 8.966 8.240 -0.000 0.000 0.451 259 S N 2.994 118.701 115.700 0.012 0.000 2.593 259 S HA 0.547 5.016 4.470 -0.002 0.000 0.269 259 S C -0.312 174.314 174.600 0.044 0.000 1.334 259 S CA -0.723 57.487 58.200 0.017 0.000 1.015 259 S CB 0.688 63.892 63.200 0.008 0.000 0.912 259 S HN 0.821 9.131 8.310 -0.000 0.000 0.541 260 D N 0.462 120.891 120.400 0.048 0.000 2.837 260 D HA 0.225 4.864 4.640 -0.002 0.000 0.294 260 D C 0.800 177.146 176.300 0.076 0.000 1.158 260 D CA -0.930 53.121 54.000 0.085 0.000 1.073 260 D CB -0.099 40.757 40.800 0.093 0.000 1.419 260 D HN 0.433 8.803 8.370 -0.000 0.000 0.584 261 L N -0.257 121.026 121.223 0.101 0.000 2.083 261 L HA -0.002 4.337 4.340 -0.002 0.000 0.209 261 L C 1.937 178.830 176.870 0.039 0.000 1.083 261 L CA 1.479 56.366 54.840 0.077 0.000 0.752 261 L CB -0.982 41.139 42.059 0.102 0.000 0.899 261 L HN 0.531 8.761 8.230 -0.000 0.000 0.433 262 L N -0.621 120.616 121.223 0.022 0.000 2.005 262 L HA -0.148 4.190 4.340 -0.002 0.000 0.207 262 L C 2.766 179.614 176.870 -0.037 0.000 1.072 262 L CA 2.203 57.026 54.840 -0.028 0.000 0.744 262 L CB -1.075 40.941 42.059 -0.071 0.000 0.895 262 L HN 0.561 8.791 8.230 -0.000 0.000 0.433 263 S N -0.783 114.901 115.700 -0.026 0.000 2.368 263 S HA -0.108 4.361 4.470 -0.002 0.000 0.225 263 S C 2.155 176.728 174.600 -0.046 0.000 1.030 263 S CA 0.857 59.035 58.200 -0.036 0.000 0.999 263 S CB -1.828 61.358 63.200 -0.023 0.000 0.844 263 S HN 0.528 8.838 8.310 -0.000 0.000 0.459 264 G N 2.483 111.266 108.800 -0.027 0.000 2.586 264 G HA2 -0.183 3.776 3.960 -0.002 0.000 0.218 264 G HA3 -0.183 3.776 3.960 -0.002 0.000 0.218 264 G C 1.468 176.315 174.900 -0.089 0.000 1.216 264 G CA 1.269 46.349 45.100 -0.033 0.000 0.786 264 G HN 0.520 8.810 8.290 -0.000 0.000 0.583 265 L N -0.110 121.060 121.223 -0.088 0.000 2.083 265 L HA 0.017 4.356 4.340 -0.002 0.000 0.209 265 L C 2.938 179.674 176.870 -0.224 0.000 1.083 265 L CA 0.394 55.137 54.840 -0.162 0.000 0.752 265 L CB -0.372 41.636 42.059 -0.086 0.000 0.899 265 L HN 0.186 8.416 8.230 -0.000 0.000 0.433 266 L N -0.431 120.702 121.223 -0.150 0.000 2.093 266 L HA -0.160 4.179 4.340 -0.002 0.000 0.208 266 L C 2.544 179.308 176.870 -0.176 0.000 1.085 266 L CA 1.485 56.236 54.840 -0.147 0.000 0.755 266 L CB -0.365 41.637 42.059 -0.094 0.000 0.904 266 L HN 0.370 8.600 8.230 -0.000 0.000 0.435 267 S N -0.797 114.803 115.700 -0.166 0.000 2.593 267 S HA 0.272 4.740 4.470 -0.002 0.000 0.217 267 S C 0.961 175.423 174.600 -0.230 0.000 0.966 267 S CA -0.110 57.996 58.200 -0.156 0.000 0.914 267 S CB -0.245 62.897 63.200 -0.096 0.000 0.776 267 S HN 0.210 8.520 8.310 -0.000 0.000 0.523 268 A N 1.345 123.927 122.820 -0.397 0.000 2.483 268 A HA 0.542 4.861 4.320 -0.002 0.000 0.238 268 A C -0.080 177.151 177.584 -0.589 0.000 1.070 268 A CA -0.141 51.473 52.037 -0.705 0.000 0.770 268 A CB 0.213 18.245 19.000 -1.613 0.000 1.008 268 A HN 0.503 8.653 8.150 -0.000 0.000 0.497 269 V N 2.724 122.387 119.914 -0.419 0.000 2.623 269 V HA 0.284 4.403 4.120 -0.002 0.000 0.304 269 V C -0.576 175.516 176.094 -0.004 0.000 1.054 269 V CA -0.504 61.668 62.300 -0.214 0.000 0.882 269 V CB 1.102 32.891 31.823 -0.056 0.000 1.002 269 V HN 0.878 9.068 8.190 -0.000 0.000 0.424 270 Y N 2.303 122.684 120.300 0.135 0.000 2.223 270 Y HA 0.145 4.695 4.550 -0.001 0.000 0.352 270 Y C 1.842 177.828 175.900 0.143 0.000 1.293 270 Y CA 0.107 58.341 58.100 0.223 0.000 1.601 270 Y CB 0.511 39.060 38.460 0.149 0.000 1.407 270 Y HN 0.548 8.828 8.280 -0.000 0.000 0.639 271 R N 0.625 121.306 120.500 0.300 0.000 2.115 271 R HA -0.152 4.186 4.340 -0.002 0.000 0.230 271 R C 1.084 177.458 176.300 0.123 0.000 1.111 271 R CA 1.760 57.955 56.100 0.157 0.000 0.976 271 R CB -0.319 30.042 30.300 0.103 0.000 0.870 271 R HN 0.817 9.087 8.270 -0.000 0.000 0.445 272 D N -1.769 118.711 120.400 0.134 0.000 2.352 272 D HA 0.077 4.716 4.640 -0.002 0.000 0.232 272 D C 1.070 177.426 176.300 0.095 0.000 1.055 272 D CA 0.804 54.859 54.000 0.091 0.000 0.891 272 D CB 0.280 41.120 40.800 0.066 0.000 0.897 272 D HN 0.351 8.721 8.370 -0.000 0.000 0.529 273 G N -0.228 108.641 108.800 0.115 0.000 2.234 273 G HA2 -0.263 3.696 3.960 -0.002 0.000 0.235 273 G HA3 -0.263 3.696 3.960 -0.002 0.000 0.235 273 G C 0.535 175.485 174.900 0.083 0.000 0.997 273 G CA 0.349 45.499 45.100 0.083 0.000 0.623 273 G HN 0.832 9.122 8.290 -0.000 0.000 0.514 274 T N 0.574 115.210 114.554 0.137 0.000 2.913 274 T HA 0.707 5.056 4.350 -0.002 0.000 0.287 274 T C -2.164 172.603 174.700 0.112 0.000 1.008 274 T CA -1.172 61.008 62.100 0.132 0.000 1.067 274 T CB 2.835 71.800 68.868 0.161 0.000 0.996 274 T HN 0.217 8.457 8.240 -0.000 0.000 0.513 275 P HA 0.350 4.770 4.420 -0.000 0.000 0.281 275 P C -0.151 177.114 177.300 -0.059 0.000 1.281 275 P CA -1.061 61.959 63.100 -0.135 0.000 0.811 275 P CB 0.589 32.221 31.700 -0.112 0.000 1.154 276 M N 0.487 119.954 119.600 -0.221 0.000 2.239 276 M HA 0.109 4.588 4.480 -0.002 0.000 0.348 276 M C 1.055 177.369 176.300 0.024 0.000 1.239 276 M CA 0.271 55.551 55.300 -0.034 0.000 1.114 276 M CB 0.114 32.624 32.600 -0.149 0.000 1.641 276 M HN 0.400 8.690 8.290 -0.000 0.000 0.453 277 S N 2.286 118.044 115.700 0.096 0.000 2.593 277 S HA 0.111 4.580 4.470 -0.002 0.000 0.269 277 S C 0.751 175.392 174.600 0.068 0.000 1.334 277 S CA -0.802 57.448 58.200 0.083 0.000 1.015 277 S CB 0.909 64.184 63.200 0.125 0.000 0.912 277 S HN 0.733 9.043 8.310 -0.000 0.000 0.541 278 L N 1.070 122.331 121.223 0.064 0.000 2.131 278 L HA -0.019 4.320 4.340 -0.002 0.000 0.210 278 L C 2.394 179.318 176.870 0.090 0.000 1.092 278 L CA 2.288 57.160 54.840 0.053 0.000 0.759 278 L CB -1.257 40.828 42.059 0.043 0.000 0.903 278 L HN 1.044 9.274 8.230 -0.000 0.000 0.435 279 H N -0.178 118.912 119.070 0.033 0.000 2.319 279 H HA -0.184 4.371 4.556 -0.002 0.000 0.299 279 H C 2.022 177.388 175.328 0.063 0.000 1.092 279 H CA 2.415 58.491 56.048 0.046 0.000 1.302 279 H CB 0.045 29.832 29.762 0.043 0.000 1.373 279 H HN 0.531 8.811 8.280 -0.000 0.000 0.497 280 E N -0.436 119.748 120.200 -0.027 0.000 2.072 280 E HA -0.114 4.235 4.350 -0.002 0.000 0.191 280 E C 2.501 179.092 176.600 -0.015 0.000 0.985 280 E CA 1.182 57.555 56.400 -0.045 0.000 0.801 280 E CB -0.022 29.729 29.700 0.085 0.000 0.750 280 E HN 0.258 8.618 8.360 -0.000 0.000 0.452 281 V N 1.458 121.370 119.914 -0.002 0.000 2.252 281 V HA -0.360 3.759 4.120 -0.002 0.000 0.249 281 V C 2.585 178.685 176.094 0.009 0.000 1.056 281 V CA 1.927 64.223 62.300 -0.008 0.000 1.022 281 V CB -0.561 31.248 31.823 -0.023 0.000 0.641 281 V HN 0.588 8.778 8.190 -0.000 0.000 0.445 282 C N 1.070 120.373 119.300 0.005 0.000 2.413 282 C HA -0.090 4.369 4.460 -0.002 0.000 0.276 282 C C 2.991 178.003 174.990 0.037 0.000 1.236 282 C CA 0.942 59.976 59.018 0.028 0.000 1.735 282 C CB -1.648 26.114 27.740 0.038 0.000 2.031 282 C HN 0.640 8.870 8.230 -0.000 0.000 0.474 283 G N 0.459 109.242 108.800 -0.027 0.000 2.469 283 G HA2 -0.213 3.745 3.960 -0.002 0.000 0.220 283 G HA3 -0.213 3.745 3.960 -0.002 0.000 0.220 283 G C 1.565 176.537 174.900 0.119 0.000 1.136 283 G CA 1.310 46.419 45.100 0.016 0.000 0.759 283 G HN 0.512 8.802 8.290 -0.000 0.000 0.562 284 M N 0.036 119.695 119.600 0.098 0.000 2.236 284 M HA 0.213 4.692 4.480 -0.002 0.000 0.266 284 M C 2.638 179.023 176.300 0.142 0.000 1.070 284 M CA 0.613 55.992 55.300 0.131 0.000 1.137 284 M CB -0.743 31.918 32.600 0.102 0.000 1.378 284 M HN 0.230 8.520 8.290 -0.000 0.000 0.426 285 I N 0.132 120.780 120.570 0.131 0.000 2.226 285 I HA -0.224 3.945 4.170 -0.002 0.000 0.245 285 I C 2.495 178.763 176.117 0.251 0.000 1.100 285 I CA 1.316 62.719 61.300 0.172 0.000 1.374 285 I CB -0.578 37.511 38.000 0.147 0.000 1.057 285 I HN 0.173 8.383 8.210 -0.000 0.000 0.413 286 V N 0.173 120.233 119.914 0.242 0.000 2.667 286 V HA -0.066 4.053 4.120 -0.002 0.000 0.252 286 V C 2.487 178.700 176.094 0.199 0.000 1.065 286 V CA 1.563 64.027 62.300 0.274 0.000 1.083 286 V CB -0.408 31.503 31.823 0.148 0.000 0.692 286 V HN 0.302 8.492 8.190 -0.000 0.000 0.468 287 A N 0.687 123.599 122.820 0.153 0.000 1.873 287 A HA 0.096 4.415 4.320 -0.002 0.000 0.215 287 A C 2.548 180.274 177.584 0.238 0.000 1.186 287 A CA 2.212 54.340 52.037 0.152 0.000 0.616 287 A CB -1.186 17.999 19.000 0.308 0.000 0.823 287 A HN 0.997 9.147 8.150 -0.000 0.000 0.442 288 A N -0.533 122.411 122.820 0.207 0.000 1.865 288 A HA -0.162 4.157 4.320 -0.002 0.000 0.217 288 A C 2.224 179.913 177.584 0.176 0.000 1.191 288 A CA 2.154 54.292 52.037 0.169 0.000 0.623 288 A CB -0.515 18.547 19.000 0.104 0.000 0.826 288 A HN 0.443 8.593 8.150 -0.000 0.000 0.444 289 M N -1.880 117.847 119.600 0.212 0.000 2.200 289 M HA -0.011 4.468 4.480 -0.002 0.000 0.265 289 M C 2.174 178.604 176.300 0.216 0.000 1.066 289 M CA 1.125 56.554 55.300 0.215 0.000 1.127 289 M CB -1.407 31.429 32.600 0.393 0.000 1.379 289 M HN 0.541 8.831 8.290 -0.000 0.000 0.420 290 F N 1.649 121.675 119.950 0.127 0.000 2.126 290 F HA -0.173 4.352 4.527 -0.002 0.000 0.299 290 F C 2.360 178.247 175.800 0.145 0.000 1.096 290 F CA 1.817 59.883 58.000 0.111 0.000 1.255 290 F CB -0.384 38.640 39.000 0.038 0.000 0.997 290 F HN 0.113 8.413 8.300 -0.000 0.000 0.479 291 A N 0.275 123.164 122.820 0.115 0.000 1.877 291 A HA -0.034 4.285 4.320 -0.002 0.000 0.216 291 A C 2.490 180.076 177.584 0.004 0.000 1.186 291 A CA 1.712 53.775 52.037 0.044 0.000 0.620 291 A CB -1.794 17.321 19.000 0.192 0.000 0.822 291 A HN 0.519 8.669 8.150 -0.000 0.000 0.443 292 G N -1.137 107.696 108.800 0.055 0.000 2.403 292 G HA2 -0.181 3.778 3.960 -0.002 0.000 0.216 292 G HA3 -0.181 3.778 3.960 -0.002 0.000 0.216 292 G C 1.595 176.454 174.900 -0.067 0.000 1.154 292 G CA 1.247 46.377 45.100 0.051 0.000 0.784 292 G HN 0.522 8.812 8.290 -0.000 0.000 0.538 293 Q N 0.489 120.191 119.800 -0.164 0.000 2.045 293 Q HA -0.153 4.185 4.340 -0.002 0.000 0.206 293 Q C 2.219 177.973 176.000 -0.411 0.000 0.991 293 Q CA 2.215 57.819 55.803 -0.332 0.000 0.851 293 Q CB -0.536 27.895 28.738 -0.512 0.000 0.911 293 Q HN 0.721 8.991 8.270 -0.000 0.000 0.418 294 H N -1.417 117.532 119.070 -0.202 0.000 2.294 294 H HA 0.024 4.579 4.556 -0.001 0.000 0.306 294 H C 2.122 177.381 175.328 -0.116 0.000 1.065 294 H CA 2.020 57.957 56.048 -0.186 0.000 1.343 294 H CB -0.428 29.166 29.762 -0.280 0.000 1.396 294 H HN 0.513 8.793 8.280 -0.000 0.000 0.506 295 T N -1.339 113.226 114.554 0.019 0.000 2.759 295 T HA -0.168 4.181 4.350 -0.002 0.000 0.269 295 T C 2.147 176.872 174.700 0.043 0.000 1.042 295 T CA 1.558 63.684 62.100 0.043 0.000 1.140 295 T CB -0.517 68.391 68.868 0.067 0.000 0.864 295 T HN 0.178 8.418 8.240 -0.000 0.000 0.455 296 S N 1.614 117.319 115.700 0.008 0.000 2.371 296 S HA -0.021 4.448 4.470 -0.002 0.000 0.224 296 S C 2.511 177.087 174.600 -0.039 0.000 1.029 296 S CA 0.996 59.193 58.200 -0.005 0.000 0.978 296 S CB -0.567 62.600 63.200 -0.054 0.000 0.833 296 S HN 0.561 8.871 8.310 -0.000 0.000 0.466 297 S N 1.731 117.381 115.700 -0.084 0.000 2.370 297 S HA -0.027 4.442 4.470 -0.002 0.000 0.226 297 S C 1.790 176.336 174.600 -0.091 0.000 1.033 297 S CA 1.116 59.250 58.200 -0.110 0.000 1.011 297 S CB -0.414 62.701 63.200 -0.142 0.000 0.852 297 S HN 0.399 8.709 8.310 -0.000 0.000 0.457 298 I N 1.051 121.592 120.570 -0.049 0.000 2.252 298 I HA -0.156 4.013 4.170 -0.002 0.000 0.245 298 I C 2.477 178.654 176.117 0.101 0.000 1.102 298 I CA 1.086 62.361 61.300 -0.042 0.000 1.385 298 I CB -0.673 37.353 38.000 0.042 0.000 1.064 298 I HN 0.258 8.468 8.210 -0.000 0.000 0.414 299 T N 0.054 114.695 114.554 0.144 0.000 2.708 299 T HA -0.174 4.175 4.350 -0.002 0.000 0.266 299 T C 1.906 176.697 174.700 0.152 0.000 1.037 299 T CA 2.117 64.337 62.100 0.198 0.000 1.146 299 T CB -0.493 68.467 68.868 0.153 0.000 0.865 299 T HN 0.373 8.613 8.240 -0.000 0.000 0.435 300 T N 1.958 116.545 114.554 0.055 0.000 2.652 300 T HA -0.138 4.211 4.350 -0.002 0.000 0.267 300 T C 2.300 176.993 174.700 -0.013 0.000 1.039 300 T CA 1.770 63.881 62.100 0.018 0.000 1.153 300 T CB -0.896 67.942 68.868 -0.049 0.000 0.863 300 T HN 0.390 8.630 8.240 -0.000 0.000 0.428 301 T N 0.534 115.034 114.554 -0.089 0.000 2.652 301 T HA -0.130 4.219 4.350 -0.002 0.000 0.267 301 T C 1.636 176.230 174.700 -0.175 0.000 1.039 301 T CA 1.386 63.366 62.100 -0.201 0.000 1.153 301 T CB -0.584 68.097 68.868 -0.313 0.000 0.863 301 T HN 0.531 8.771 8.240 -0.000 0.000 0.428 302 W N 1.501 122.728 121.300 -0.121 0.000 2.317 302 W HA -0.179 4.480 4.660 -0.002 0.000 0.318 302 W C 3.056 179.474 176.519 -0.169 0.000 1.227 302 W CA 0.929 58.164 57.345 -0.184 0.000 1.269 302 W CB -0.613 28.820 29.460 -0.044 0.000 1.155 302 W HN 0.149 8.329 8.180 -0.000 0.000 0.484 303 S N 0.370 116.219 115.700 0.250 0.000 2.365 303 S HA -0.292 4.177 4.470 -0.002 0.000 0.225 303 S C 1.691 176.364 174.600 0.122 0.000 1.039 303 S CA 1.969 60.298 58.200 0.216 0.000 1.033 303 S CB -0.643 62.702 63.200 0.241 0.000 0.887 303 S HN 0.253 8.563 8.310 -0.000 0.000 0.447 304 M N 0.596 120.249 119.600 0.088 0.000 2.132 304 M HA -0.028 4.451 4.480 -0.002 0.000 0.263 304 M C 2.106 178.401 176.300 -0.008 0.000 1.065 304 M CA 1.240 56.596 55.300 0.094 0.000 1.122 304 M CB -0.736 31.752 32.600 -0.187 0.000 1.365 304 M HN 0.230 8.520 8.290 -0.000 0.000 0.411 305 L N -0.501 120.635 121.223 -0.145 0.000 1.990 305 L HA -0.279 4.060 4.340 -0.002 0.000 0.213 305 L C 2.797 179.554 176.870 -0.188 0.000 1.072 305 L CA 1.347 56.072 54.840 -0.192 0.000 0.755 305 L CB -1.195 40.691 42.059 -0.289 0.000 0.889 305 L HN 0.377 8.607 8.230 -0.000 0.000 0.432 306 H N -0.134 118.773 119.070 -0.271 0.000 2.352 306 H HA -0.151 4.404 4.556 -0.002 0.000 0.299 306 H C 2.391 177.506 175.328 -0.356 0.000 1.097 306 H CA 1.541 57.232 56.048 -0.595 0.000 1.311 306 H CB -0.404 28.328 29.762 -1.717 0.000 1.377 306 H HN 0.302 8.582 8.280 -0.000 0.000 0.504 307 L N 0.749 121.926 121.223 -0.077 0.000 2.191 307 L HA -0.176 4.163 4.340 -0.002 0.000 0.212 307 L C 2.692 179.661 176.870 0.165 0.000 1.103 307 L CA 1.228 56.110 54.840 0.070 0.000 0.769 307 L CB -0.277 41.809 42.059 0.045 0.000 0.908 307 L HN 0.321 8.551 8.230 -0.000 0.000 0.438 308 M N -2.690 117.052 119.600 0.238 0.000 2.510 308 M HA 0.045 4.524 4.480 -0.002 0.000 0.256 308 M C 1.063 177.475 176.300 0.186 0.000 1.132 308 M CA 0.533 55.998 55.300 0.276 0.000 1.105 308 M CB -0.271 32.523 32.600 0.323 0.000 1.375 308 M HN 0.032 8.322 8.290 -0.000 0.000 0.477 309 H N 3.301 122.416 119.070 0.076 0.000 2.928 309 H HA 0.097 4.652 4.556 -0.002 0.000 0.338 309 H C -1.869 173.512 175.328 0.089 0.000 1.047 309 H CA -0.554 55.534 56.048 0.066 0.000 1.435 309 H CB 1.118 30.912 29.762 0.052 0.000 1.428 309 H HN 0.064 8.344 8.280 -0.000 0.000 0.590 310 P HA -0.118 4.302 4.420 -0.000 0.000 0.216 310 P C 1.077 178.409 177.300 0.053 0.000 1.150 310 P CA 1.739 64.777 63.100 -0.104 0.000 0.837 310 P CB -0.026 31.561 31.700 -0.189 0.000 0.786 311 A N -0.506 122.434 122.820 0.201 0.000 2.178 311 A HA -0.143 4.176 4.320 -0.002 0.000 0.218 311 A C 1.523 179.276 177.584 0.281 0.000 1.157 311 A CA 1.367 53.576 52.037 0.286 0.000 0.689 311 A CB -0.964 18.276 19.000 0.400 0.000 0.787 311 A HN 0.177 8.327 8.150 -0.000 0.000 0.465 312 N N -0.135 118.752 118.700 0.312 0.000 2.275 312 N HA 0.097 4.836 4.740 -0.002 0.000 0.236 312 N C 1.321 176.968 175.510 0.227 0.000 1.154 312 N CA 0.741 54.009 53.050 0.364 0.000 0.866 312 N CB 0.591 39.365 38.487 0.478 0.000 1.093 312 N HN 0.349 8.729 8.380 -0.000 0.000 0.515 313 V N 0.038 120.027 119.914 0.125 0.000 2.439 313 V HA -0.340 3.779 4.120 -0.002 0.000 0.253 313 V C 2.368 178.473 176.094 0.018 0.000 1.074 313 V CA 1.910 64.248 62.300 0.064 0.000 1.076 313 V CB -0.867 30.974 31.823 0.031 0.000 0.664 313 V HN 0.364 8.554 8.190 -0.000 0.000 0.461 314 K N -0.173 120.198 120.400 -0.050 0.000 2.057 314 K HA -0.193 4.126 4.320 -0.002 0.000 0.206 314 K C 2.133 178.639 176.600 -0.156 0.000 1.050 314 K CA 1.819 58.011 56.287 -0.159 0.000 0.935 314 K CB -0.683 31.663 32.500 -0.257 0.000 0.715 314 K HN 0.571 8.821 8.250 -0.000 0.000 0.439 315 H N 0.451 119.624 119.070 0.173 0.000 2.462 315 H HA -0.026 4.529 4.556 -0.002 0.000 0.292 315 H C 2.117 177.598 175.328 0.254 0.000 1.049 315 H CA 1.061 57.302 56.048 0.322 0.000 1.334 315 H CB -0.014 30.068 29.762 0.534 0.000 1.404 315 H HN 0.182 8.462 8.280 -0.000 0.000 0.544 316 L N 1.623 122.971 121.223 0.208 0.000 2.056 316 L HA -0.099 4.239 4.340 -0.002 0.000 0.207 316 L C 2.083 178.948 176.870 -0.008 0.000 1.078 316 L CA 1.525 56.393 54.840 0.046 0.000 0.749 316 L CB -0.380 41.683 42.059 0.007 0.000 0.901 316 L HN 0.079 8.309 8.230 -0.000 0.000 0.433 317 E N -0.375 119.813 120.200 -0.020 0.000 2.051 317 E HA -0.233 4.116 4.350 -0.002 0.000 0.192 317 E C 2.206 178.736 176.600 -0.116 0.000 0.991 317 E CA 1.216 57.580 56.400 -0.061 0.000 0.799 317 E CB -0.373 29.285 29.700 -0.071 0.000 0.748 317 E HN 0.637 8.997 8.360 -0.000 0.000 0.449 318 A N 1.156 123.860 122.820 -0.193 0.000 1.917 318 A HA -0.212 4.107 4.320 -0.002 0.000 0.219 318 A C 2.177 179.564 177.584 -0.329 0.000 1.182 318 A CA 1.340 53.108 52.037 -0.449 0.000 0.633 318 A CB -0.563 17.844 19.000 -0.988 0.000 0.819 318 A HN 0.236 8.386 8.150 -0.000 0.000 0.448 319 L N -0.453 120.754 121.223 -0.026 0.000 2.044 319 L HA -0.058 4.280 4.340 -0.002 0.000 0.205 319 L C 2.439 179.315 176.870 0.010 0.000 1.075 319 L CA 1.740 56.668 54.840 0.147 0.000 0.747 319 L CB -0.472 41.694 42.059 0.178 0.000 0.903 319 L HN 0.298 8.528 8.230 -0.000 0.000 0.435 320 R N -0.402 120.079 120.500 -0.032 0.000 2.152 320 R HA -0.174 4.165 4.340 -0.002 0.000 0.232 320 R C 2.253 178.500 176.300 -0.090 0.000 1.117 320 R CA 1.198 57.276 56.100 -0.036 0.000 0.981 320 R CB -0.280 30.012 30.300 -0.014 0.000 0.870 320 R HN 0.418 8.688 8.270 -0.000 0.000 0.451 321 K N 1.228 121.559 120.400 -0.114 0.000 2.057 321 K HA -0.176 4.143 4.320 -0.002 0.000 0.206 321 K C 1.848 178.340 176.600 -0.181 0.000 1.050 321 K CA 1.282 57.487 56.287 -0.137 0.000 0.935 321 K CB 0.084 32.495 32.500 -0.148 0.000 0.715 321 K HN 0.091 8.341 8.250 -0.000 0.000 0.439 322 E N 0.007 120.101 120.200 -0.178 0.000 2.153 322 E HA -0.167 4.182 4.350 -0.002 0.000 0.194 322 E C 1.266 177.504 176.600 -0.604 0.000 0.988 322 E CA 1.125 57.393 56.400 -0.221 0.000 0.811 322 E CB 0.145 29.822 29.700 -0.039 0.000 0.746 322 E HN 0.262 8.622 8.360 -0.000 0.000 0.466 323 I N 0.538 120.793 120.570 -0.525 0.000 3.968 323 I HA -0.037 4.132 4.170 -0.002 0.000 0.328 323 I C 1.857 177.701 176.117 -0.456 0.000 1.290 323 I CA 0.135 60.987 61.300 -0.747 0.000 1.163 323 I CB 0.194 38.089 38.000 -0.175 0.000 1.024 323 I HN -0.027 8.183 8.210 -0.000 0.000 0.413 324 E N 1.488 121.515 120.200 -0.288 0.000 2.048 324 E HA -0.298 4.051 4.350 -0.002 0.000 0.202 324 E C 2.224 178.777 176.600 -0.079 0.000 1.021 324 E CA 2.248 58.570 56.400 -0.131 0.000 0.825 324 E CB 0.049 29.693 29.700 -0.094 0.000 0.756 324 E HN 0.634 8.994 8.360 -0.000 0.000 0.454 325 E N 0.433 120.579 120.200 -0.091 0.000 2.358 325 E HA -0.054 4.295 4.350 -0.002 0.000 0.195 325 E C 0.712 177.427 176.600 0.193 0.000 1.010 325 E CA 0.030 56.456 56.400 0.044 0.000 0.856 325 E CB -0.467 29.267 29.700 0.056 0.000 0.795 325 E HN 0.017 8.377 8.360 -0.000 0.000 0.504 326 F N 1.262 121.235 119.950 0.039 0.000 2.646 326 F HA 0.233 4.759 4.527 -0.001 0.000 0.363 326 F C -1.351 174.474 175.800 0.042 0.000 1.143 326 F CA -2.371 55.655 58.000 0.043 0.000 1.356 326 F CB 0.163 39.195 39.000 0.053 0.000 1.055 326 F HN 0.083 8.383 8.300 -0.000 0.000 0.606 327 P HA 0.240 4.660 4.420 -0.000 0.000 0.276 327 P C 0.073 177.444 177.300 0.119 0.000 1.261 327 P CA -0.195 62.980 63.100 0.124 0.000 0.800 327 P CB 0.670 32.414 31.700 0.074 0.000 1.066 328 A N 0.408 123.281 122.820 0.089 0.000 1.865 328 A HA -0.177 4.142 4.320 -0.002 0.000 0.217 328 A C 1.170 178.797 177.584 0.073 0.000 1.191 328 A CA 1.647 53.732 52.037 0.080 0.000 0.623 328 A CB -1.084 17.952 19.000 0.059 0.000 0.826 328 A HN 0.556 8.706 8.150 -0.000 0.000 0.444 329 Q N 0.194 120.029 119.800 0.058 0.000 2.377 329 Q HA 0.572 4.911 4.340 -0.002 0.000 0.249 329 Q C -0.677 175.340 176.000 0.028 0.000 1.005 329 Q CA 0.085 55.917 55.803 0.048 0.000 0.912 329 Q CB 0.752 29.518 28.738 0.047 0.000 1.223 329 Q HN 0.533 8.803 8.270 -0.000 0.000 0.459 330 L N 2.790 124.023 121.223 0.017 0.000 2.467 330 L HA 0.230 4.569 4.340 -0.002 0.000 0.270 330 L C 0.895 177.750 176.870 -0.026 0.000 1.205 330 L CA 0.002 54.817 54.840 -0.042 0.000 0.828 330 L CB 0.340 42.369 42.059 -0.050 0.000 1.101 330 L HN 0.717 8.947 8.230 -0.000 0.000 0.479 331 N N 0.089 118.753 118.700 -0.061 0.000 2.545 331 N HA 0.089 4.828 4.740 -0.002 0.000 0.289 331 N C 0.562 176.086 175.510 0.024 0.000 1.279 331 N CA -0.830 52.225 53.050 0.008 0.000 0.824 331 N CB 1.075 39.575 38.487 0.023 0.000 1.395 331 N HN 0.525 8.905 8.380 -0.000 0.000 0.526 332 Y N 0.973 121.265 120.300 -0.014 0.000 2.139 332 Y HA -0.268 4.281 4.550 -0.001 0.000 0.282 332 Y C 1.746 177.646 175.900 -0.001 0.000 1.179 332 Y CA 2.053 60.163 58.100 0.017 0.000 1.161 332 Y CB -0.472 38.008 38.460 0.034 0.000 0.970 332 Y HN 0.562 8.842 8.280 -0.000 0.000 0.511 333 N N -0.028 118.623 118.700 -0.082 0.000 2.171 333 N HA -0.187 4.552 4.740 -0.002 0.000 0.184 333 N C 1.399 176.778 175.510 -0.217 0.000 1.021 333 N CA 1.163 54.111 53.050 -0.169 0.000 0.854 333 N CB -0.384 38.095 38.487 -0.013 0.000 0.994 333 N HN 0.487 8.867 8.380 -0.000 0.000 0.426 334 N N 1.262 119.806 118.700 -0.261 0.000 2.104 334 N HA -0.126 4.612 4.740 -0.002 0.000 0.190 334 N C 1.853 177.176 175.510 -0.311 0.000 1.024 334 N CA 0.825 53.599 53.050 -0.459 0.000 0.853 334 N CB -0.402 37.587 38.487 -0.830 0.000 1.008 334 N HN 0.110 8.490 8.380 -0.000 0.000 0.424 335 V N 0.606 120.383 119.914 -0.228 0.000 2.500 335 V HA -0.004 4.115 4.120 -0.002 0.000 0.243 335 V C 2.070 178.104 176.094 -0.101 0.000 1.039 335 V CA 0.766 63.000 62.300 -0.109 0.000 1.053 335 V CB -0.107 31.670 31.823 -0.076 0.000 0.695 335 V HN 0.069 8.259 8.190 -0.000 0.000 0.463 336 M N 0.032 119.500 119.600 -0.219 0.000 2.132 336 M HA -0.030 4.448 4.480 -0.002 0.000 0.263 336 M C 1.665 177.881 176.300 -0.140 0.000 1.065 336 M CA 1.776 56.939 55.300 -0.228 0.000 1.122 336 M CB -1.073 31.194 32.600 -0.555 0.000 1.365 336 M HN 0.417 8.707 8.290 -0.000 0.000 0.411 337 D N -0.941 119.376 120.400 -0.138 0.000 2.454 337 D HA 0.057 4.696 4.640 -0.002 0.000 0.219 337 D C 0.734 177.040 176.300 0.009 0.000 1.081 337 D CA 0.398 54.364 54.000 -0.057 0.000 0.867 337 D CB 0.269 41.033 40.800 -0.059 0.000 1.054 337 D HN 0.428 8.798 8.370 -0.000 0.000 0.500 338 E N -0.034 120.188 120.200 0.036 0.000 2.569 338 E HA 0.268 4.617 4.350 -0.002 0.000 0.205 338 E C 0.401 177.154 176.600 0.255 0.000 1.006 338 E CA -0.033 56.460 56.400 0.155 0.000 0.985 338 E CB 0.713 30.551 29.700 0.230 0.000 1.060 338 E HN 0.050 8.410 8.360 -0.000 0.000 0.460 339 M N 1.472 121.174 119.600 0.170 0.000 3.075 339 M HA 0.166 4.645 4.480 -0.002 0.000 0.340 339 M C -1.985 174.396 176.300 0.135 0.000 1.329 339 M CA -1.322 54.095 55.300 0.194 0.000 0.778 339 M CB 0.937 33.656 32.600 0.199 0.000 1.389 339 M HN -0.084 8.206 8.290 -0.000 0.000 0.499 340 P HA -0.151 4.269 4.420 -0.000 0.000 0.220 340 P C 1.277 178.644 177.300 0.111 0.000 1.148 340 P CA 1.252 64.406 63.100 0.090 0.000 0.803 340 P CB 0.055 31.805 31.700 0.083 0.000 0.782 341 F N 1.636 121.599 119.950 0.021 0.000 2.128 341 F HA 0.020 4.546 4.527 -0.002 0.000 0.295 341 F C 2.519 178.340 175.800 0.035 0.000 1.100 341 F CA 1.339 59.347 58.000 0.013 0.000 1.260 341 F CB -1.034 37.977 39.000 0.018 0.000 1.009 341 F HN -0.095 8.205 8.300 -0.000 0.000 0.476 342 A N -0.163 122.723 122.820 0.110 0.000 1.927 342 A HA -0.334 3.985 4.320 -0.002 0.000 0.220 342 A C 2.156 179.727 177.584 -0.021 0.000 1.185 342 A CA 2.243 54.315 52.037 0.058 0.000 0.639 342 A CB -1.108 17.977 19.000 0.143 0.000 0.820 342 A HN 0.569 8.719 8.150 -0.000 0.000 0.451 343 E N -0.690 119.500 120.200 -0.015 0.000 2.107 343 E HA -0.145 4.204 4.350 -0.002 0.000 0.191 343 E C 2.256 178.791 176.600 -0.107 0.000 0.982 343 E CA 0.894 57.279 56.400 -0.025 0.000 0.809 343 E CB -0.082 29.615 29.700 -0.005 0.000 0.756 343 E HN 0.597 8.957 8.360 -0.000 0.000 0.459 344 R N -0.317 120.058 120.500 -0.209 0.000 2.081 344 R HA -0.114 4.225 4.340 -0.002 0.000 0.235 344 R C 2.504 178.556 176.300 -0.413 0.000 1.131 344 R CA 1.384 57.286 56.100 -0.331 0.000 0.960 344 R CB -0.449 29.615 30.300 -0.393 0.000 0.856 344 R HN 0.339 8.609 8.270 -0.000 0.000 0.436 345 C N 0.036 119.074 119.300 -0.436 0.000 2.413 345 C HA -0.130 4.329 4.460 -0.002 0.000 0.276 345 C C 2.913 177.939 174.990 0.061 0.000 1.236 345 C CA 0.869 59.777 59.018 -0.184 0.000 1.735 345 C CB -1.064 26.645 27.740 -0.051 0.000 2.031 345 C HN 0.608 8.838 8.230 -0.000 0.000 0.474 346 A N 0.832 123.681 122.820 0.047 0.000 1.841 346 A HA -0.210 4.108 4.320 -0.002 0.000 0.216 346 A C 2.220 179.859 177.584 0.092 0.000 1.199 346 A CA 1.795 53.904 52.037 0.119 0.000 0.621 346 A CB -0.698 18.378 19.000 0.127 0.000 0.835 346 A HN 0.651 8.801 8.150 -0.000 0.000 0.445 347 R N -0.740 119.769 120.500 0.015 0.000 2.112 347 R HA -0.232 4.106 4.340 -0.002 0.000 0.242 347 R C 2.302 178.533 176.300 -0.114 0.000 1.137 347 R CA 1.882 57.951 56.100 -0.051 0.000 0.944 347 R CB -0.454 29.691 30.300 -0.260 0.000 0.857 347 R HN 0.708 8.978 8.270 -0.000 0.000 0.435 348 E N 0.782 120.839 120.200 -0.238 0.000 2.118 348 E HA -0.139 4.210 4.350 -0.002 0.000 0.195 348 E C 1.790 178.297 176.600 -0.155 0.000 0.992 348 E CA 1.848 58.036 56.400 -0.352 0.000 0.804 348 E CB -0.059 29.220 29.700 -0.702 0.000 0.741 348 E HN 0.146 8.506 8.360 -0.000 0.000 0.458 349 S N -0.053 115.722 115.700 0.125 0.000 2.359 349 S HA -0.137 4.332 4.470 -0.002 0.000 0.224 349 S C 1.936 176.533 174.600 -0.006 0.000 1.035 349 S CA 1.400 59.734 58.200 0.222 0.000 1.018 349 S CB -0.348 63.071 63.200 0.365 0.000 0.876 349 S HN 0.329 8.639 8.310 -0.000 0.000 0.448 350 I N 0.945 121.536 120.570 0.035 0.000 2.252 350 I HA -0.145 4.023 4.170 -0.002 0.000 0.245 350 I C 2.821 178.935 176.117 -0.004 0.000 1.102 350 I CA 0.858 62.164 61.300 0.010 0.000 1.385 350 I CB -0.282 37.719 38.000 0.002 0.000 1.064 350 I HN 0.154 8.364 8.210 -0.000 0.000 0.414 351 R N 1.322 121.788 120.500 -0.057 0.000 2.080 351 R HA -0.194 4.145 4.340 -0.002 0.000 0.236 351 R C 2.363 178.478 176.300 -0.307 0.000 1.137 351 R CA 1.827 57.695 56.100 -0.387 0.000 0.943 351 R CB -0.525 29.472 30.300 -0.506 0.000 0.846 351 R HN 0.298 8.568 8.270 -0.000 0.000 0.431 352 R N -0.056 120.294 120.500 -0.251 0.000 2.062 352 R HA -0.059 4.280 4.340 -0.002 0.000 0.231 352 R C -0.177 176.051 176.300 -0.121 0.000 1.136 352 R CA 1.595 57.565 56.100 -0.216 0.000 0.948 352 R CB 0.135 30.346 30.300 -0.149 0.000 0.845 352 R HN 0.170 8.440 8.270 -0.000 0.000 0.430 353 D N 1.487 121.740 120.400 -0.244 0.000 2.412 353 D HA 0.220 4.859 4.640 -0.002 0.000 0.276 353 D C -2.538 173.725 176.300 -0.060 0.000 1.196 353 D CA -1.338 52.528 54.000 -0.224 0.000 0.905 353 D CB 1.758 42.124 40.800 -0.724 0.000 1.081 353 D HN 0.227 8.597 8.370 -0.000 0.000 0.502 354 P HA 0.192 4.612 4.420 -0.000 0.000 0.276 354 P C -2.176 175.165 177.300 0.068 0.000 1.235 354 P CA -1.210 61.913 63.100 0.039 0.000 0.772 354 P CB 1.441 33.148 31.700 0.011 0.000 0.871 355 P HA 0.086 4.506 4.420 -0.000 0.000 0.233 355 P C 0.094 177.436 177.300 0.069 0.000 1.167 355 P CA 1.037 64.192 63.100 0.091 0.000 0.770 355 P CB 0.340 32.088 31.700 0.079 0.000 0.837 356 L N -0.165 121.084 121.223 0.045 0.000 2.318 356 L HA 0.301 4.640 4.340 -0.002 0.000 0.277 356 L C 1.264 178.162 176.870 0.047 0.000 1.008 356 L CA -0.552 54.323 54.840 0.060 0.000 0.846 356 L CB 1.670 43.767 42.059 0.063 0.000 1.220 356 L HN -0.186 8.044 8.230 -0.000 0.000 0.423 357 L N 2.543 123.813 121.223 0.078 0.000 2.131 357 L HA 0.151 4.490 4.340 -0.002 0.000 0.206 357 L C 0.581 177.479 176.870 0.047 0.000 1.087 357 L CA 1.006 55.881 54.840 0.058 0.000 0.767 357 L CB -0.056 42.058 42.059 0.091 0.000 0.917 357 L HN 0.553 8.783 8.230 -0.000 0.000 0.441 358 M N 1.365 121.022 119.600 0.094 0.000 2.106 358 M HA 0.385 4.864 4.480 -0.002 0.000 0.288 358 M C -1.216 175.162 176.300 0.130 0.000 0.941 358 M CA -0.182 55.171 55.300 0.089 0.000 0.934 358 M CB 2.397 35.086 32.600 0.149 0.000 1.551 358 M HN -0.012 8.278 8.290 -0.000 0.000 0.437 359 L N 4.316 125.595 121.223 0.093 0.000 2.292 359 L HA 0.606 4.945 4.340 -0.002 0.000 0.284 359 L C -0.250 176.738 176.870 0.196 0.000 1.065 359 L CA -0.133 54.852 54.840 0.242 0.000 0.806 359 L CB 0.954 43.192 42.059 0.298 0.000 1.175 359 L HN 0.673 8.903 8.230 -0.000 0.000 0.431 360 M N 3.574 123.348 119.600 0.290 0.000 2.591 360 M HA 0.617 5.096 4.480 -0.002 0.000 0.306 360 M C -0.720 175.527 176.300 -0.088 0.000 1.190 360 M CA -0.737 54.635 55.300 0.121 0.000 0.889 360 M CB 2.733 35.379 32.600 0.077 0.000 1.728 360 M HN 0.485 8.775 8.290 -0.000 0.000 0.458 361 R N 1.122 121.606 120.500 -0.026 0.000 2.836 361 R HA 0.554 4.893 4.340 -0.002 0.000 0.269 361 R C -1.382 174.843 176.300 -0.125 0.000 1.010 361 R CA -1.098 54.885 56.100 -0.196 0.000 0.930 361 R CB 2.090 32.235 30.300 -0.258 0.000 1.218 361 R HN 0.476 8.746 8.270 -0.000 0.000 0.473 362 K N 0.936 121.251 120.400 -0.142 0.000 2.263 362 K HA 0.236 4.555 4.320 -0.002 0.000 0.272 362 K C -0.714 175.847 176.600 -0.065 0.000 1.033 362 K CA -0.454 55.785 56.287 -0.080 0.000 0.884 362 K CB 1.165 33.625 32.500 -0.067 0.000 1.107 362 K HN 0.346 8.596 8.250 -0.000 0.000 0.460 363 V N 7.007 126.896 119.914 -0.041 0.000 2.409 363 V HA -0.032 4.087 4.120 -0.002 0.000 0.270 363 V C 1.110 177.191 176.094 -0.023 0.000 1.019 363 V CA 0.079 62.359 62.300 -0.033 0.000 1.066 363 V CB 0.181 31.995 31.823 -0.016 0.000 1.021 363 V HN 0.873 9.063 8.190 -0.000 0.000 0.476 364 M N 3.281 122.864 119.600 -0.027 0.000 2.506 364 M HA 0.316 4.795 4.480 -0.002 0.000 0.260 364 M C 0.688 176.985 176.300 -0.004 0.000 1.104 364 M CA 0.518 55.812 55.300 -0.009 0.000 1.112 364 M CB -0.469 32.129 32.600 -0.003 0.000 1.401 364 M HN 0.751 9.041 8.290 -0.000 0.000 0.473 365 A N -0.259 122.555 122.820 -0.010 0.000 2.594 365 A HA 0.495 4.814 4.320 -0.002 0.000 0.296 365 A C -1.258 176.324 177.584 -0.002 0.000 1.061 365 A CA -1.050 50.985 52.037 -0.003 0.000 0.689 365 A CB 0.686 19.684 19.000 -0.003 0.000 1.280 365 A HN 0.168 8.318 8.150 -0.000 0.000 0.406 366 D N 0.248 120.651 120.400 0.005 0.000 2.703 366 D HA 0.258 4.897 4.640 -0.002 0.000 0.225 366 D C -0.183 176.123 176.300 0.010 0.000 1.119 366 D CA 1.190 55.197 54.000 0.011 0.000 0.845 366 D CB 0.808 41.618 40.800 0.016 0.000 1.182 366 D HN 0.642 9.012 8.370 -0.000 0.000 0.493 367 V N 0.630 120.553 119.914 0.016 0.000 2.841 367 V HA 0.608 4.727 4.120 -0.002 0.000 0.310 367 V C -0.579 175.537 176.094 0.036 0.000 1.090 367 V CA -0.686 61.624 62.300 0.017 0.000 0.930 367 V CB 1.774 33.600 31.823 0.006 0.000 1.014 367 V HN 0.607 8.797 8.190 -0.000 0.000 0.425 368 K N 4.060 124.483 120.400 0.038 0.000 2.339 368 K HA 0.672 4.991 4.320 -0.002 0.000 0.286 368 K C -0.817 175.824 176.600 0.069 0.000 1.050 368 K CA -0.004 56.314 56.287 0.053 0.000 0.956 368 K CB 1.053 33.576 32.500 0.038 0.000 0.990 368 K HN 1.091 9.341 8.250 -0.000 0.000 0.475 369 V N 2.243 122.217 119.914 0.100 0.000 2.501 369 V HA 0.660 4.779 4.120 -0.002 0.000 0.277 369 V C 0.902 177.092 176.094 0.160 0.000 1.004 369 V CA -0.064 62.307 62.300 0.118 0.000 0.862 369 V CB 0.044 31.934 31.823 0.111 0.000 1.035 369 V HN 1.742 9.932 8.190 -0.000 0.000 0.448 370 G N 4.727 113.594 108.800 0.112 0.000 2.509 370 G HA2 -0.214 3.745 3.960 -0.002 0.000 0.259 370 G HA3 -0.214 3.745 3.960 -0.002 0.000 0.259 370 G C 0.435 175.330 174.900 -0.008 0.000 1.169 370 G CA 0.251 45.397 45.100 0.077 0.000 0.953 370 G HN 1.385 9.675 8.290 -0.000 0.000 0.563 371 S N -0.538 115.072 115.700 -0.151 0.000 2.587 371 S HA 0.519 4.988 4.470 -0.002 0.000 0.252 371 S C 0.240 174.725 174.600 -0.192 0.000 1.282 371 S CA 1.054 59.077 58.200 -0.295 0.000 0.977 371 S CB 0.045 62.902 63.200 -0.571 0.000 1.015 371 S HN 2.105 10.415 8.310 -0.000 0.000 0.557 372 Y N -3.011 117.301 120.300 0.021 0.000 2.535 372 Y HA -0.085 4.464 4.550 -0.002 0.000 0.023 372 Y C -0.623 175.288 175.900 0.019 0.000 1.731 372 Y CA -0.418 57.695 58.100 0.022 0.000 1.399 372 Y CB -1.504 36.972 38.460 0.027 0.000 2.046 372 Y HN 0.558 8.838 8.280 -0.000 0.000 0.258 373 V N 4.300 124.333 119.914 0.197 0.000 2.407 373 V HA 0.513 4.632 4.120 -0.002 0.000 0.291 373 V C -0.443 175.701 176.094 0.084 0.000 1.018 373 V CA -1.048 61.317 62.300 0.109 0.000 0.842 373 V CB 1.804 33.671 31.823 0.074 0.000 0.996 373 V HN 0.568 8.758 8.190 -0.000 0.000 0.426 374 V N 8.536 128.486 119.914 0.061 0.000 2.408 374 V HA 0.302 4.421 4.120 -0.002 0.000 0.267 374 V C -1.902 174.204 176.094 0.021 0.000 1.047 374 V CA -1.477 60.839 62.300 0.028 0.000 0.937 374 V CB 1.109 32.941 31.823 0.016 0.000 0.999 374 V HN 0.692 8.882 8.190 -0.000 0.000 0.472 375 P HA 0.191 4.611 4.420 -0.000 0.000 0.281 375 P C -0.270 177.035 177.300 0.008 0.000 1.249 375 P CA -0.831 62.278 63.100 0.015 0.000 0.810 375 P CB 0.805 32.515 31.700 0.016 0.000 1.008 376 K N 0.958 121.362 120.400 0.007 0.000 2.579 376 K HA -0.062 4.257 4.320 -0.002 0.000 0.277 376 K C 1.242 177.845 176.600 0.005 0.000 0.985 376 K CA 1.843 58.133 56.287 0.004 0.000 1.088 376 K CB -0.694 31.810 32.500 0.006 0.000 0.836 376 K HN 0.850 9.100 8.250 -0.000 0.000 0.487 377 G N 3.032 111.834 108.800 0.002 0.000 2.317 377 G HA2 -0.259 3.700 3.960 -0.002 0.000 0.227 377 G HA3 -0.259 3.700 3.960 -0.002 0.000 0.227 377 G C -0.145 174.759 174.900 0.006 0.000 1.042 377 G CA 0.254 45.356 45.100 0.005 0.000 0.623 377 G HN 0.747 9.037 8.290 -0.000 0.000 0.509 378 D N 0.565 120.967 120.400 0.004 0.000 2.390 378 D HA 0.438 5.077 4.640 -0.002 0.000 0.236 378 D C 0.858 177.159 176.300 0.002 0.000 1.189 378 D CA 0.483 54.486 54.000 0.005 0.000 0.887 378 D CB 0.574 41.372 40.800 -0.003 0.000 1.198 378 D HN 0.382 8.752 8.370 -0.000 0.000 0.444 379 I N 2.060 122.637 120.570 0.011 0.000 2.321 379 I HA 0.271 4.440 4.170 -0.002 0.000 0.291 379 I C -0.040 176.077 176.117 0.001 0.000 0.998 379 I CA -0.546 60.759 61.300 0.008 0.000 1.227 379 I CB 1.039 39.063 38.000 0.040 0.000 1.368 379 I HN 0.212 8.422 8.210 -0.000 0.000 0.466 380 I N 6.192 126.769 120.570 0.011 0.000 2.437 380 I HA 0.705 4.874 4.170 -0.002 0.000 0.298 380 I C -0.322 175.821 176.117 0.043 0.000 0.984 380 I CA -0.191 61.123 61.300 0.023 0.000 1.214 380 I CB 1.159 39.209 38.000 0.084 0.000 1.365 380 I HN 0.685 8.895 8.210 -0.000 0.000 0.469 381 A N 6.625 129.360 122.820 -0.142 0.000 2.422 381 A HA 0.581 4.900 4.320 -0.002 0.000 0.302 381 A C -1.461 175.714 177.584 -0.681 0.000 1.041 381 A CA -0.461 51.378 52.037 -0.331 0.000 0.708 381 A CB 1.389 20.279 19.000 -0.184 0.000 1.257 381 A HN 0.773 8.923 8.150 -0.000 0.000 0.414 382 C N 1.801 120.393 119.300 -1.179 0.000 2.351 382 C HA 0.802 5.261 4.460 -0.002 0.000 0.326 382 C C 0.546 175.273 174.990 -0.439 0.000 1.272 382 C CA -0.144 58.332 59.018 -0.903 0.000 1.650 382 C CB 0.550 27.422 27.740 -1.446 0.000 2.257 382 C HN 0.986 9.216 8.230 -0.000 0.000 0.505 383 S N 6.353 121.914 115.700 -0.231 0.000 2.498 383 S HA 0.463 4.932 4.470 -0.002 0.000 0.324 383 S C -1.774 172.735 174.600 -0.152 0.000 1.071 383 S CA -1.127 56.999 58.200 -0.123 0.000 1.113 383 S CB 1.268 64.441 63.200 -0.045 0.000 0.976 383 S HN 0.681 8.991 8.310 -0.000 0.000 0.462 384 P HA -0.097 4.323 4.420 -0.000 0.000 0.215 384 P C 1.655 178.636 177.300 -0.530 0.000 1.153 384 P CA 0.457 63.230 63.100 -0.544 0.000 0.853 384 P CB 0.065 31.473 31.700 -0.486 0.000 0.788 385 L N -0.748 120.352 121.223 -0.204 0.000 2.013 385 L HA -0.190 4.149 4.340 -0.002 0.000 0.212 385 L C 2.143 179.053 176.870 0.066 0.000 1.073 385 L CA 1.933 56.756 54.840 -0.028 0.000 0.753 385 L CB -1.500 40.539 42.059 -0.033 0.000 0.890 385 L HN -0.109 8.121 8.230 -0.000 0.000 0.432 386 L N -1.382 119.848 121.223 0.011 0.000 2.056 386 L HA -0.105 4.234 4.340 -0.002 0.000 0.207 386 L C 2.470 179.433 176.870 0.155 0.000 1.078 386 L CA 1.976 56.859 54.840 0.073 0.000 0.749 386 L CB -0.798 41.297 42.059 0.061 0.000 0.901 386 L HN 0.291 8.521 8.230 -0.000 0.000 0.433 387 S N -1.299 114.475 115.700 0.124 0.000 2.383 387 S HA -0.155 4.314 4.470 -0.002 0.000 0.227 387 S C 1.641 176.472 174.600 0.385 0.000 1.026 387 S CA 1.120 59.471 58.200 0.251 0.000 0.981 387 S CB -0.616 62.797 63.200 0.355 0.000 0.818 387 S HN 0.664 8.974 8.310 -0.000 0.000 0.472 388 H N -0.856 118.299 119.070 0.142 0.000 2.563 388 H HA 0.052 4.607 4.556 -0.002 0.000 0.272 388 H C 0.655 175.777 175.328 -0.344 0.000 1.005 388 H CA 0.554 56.489 56.048 -0.188 0.000 1.171 388 H CB 0.109 29.616 29.762 -0.426 0.000 1.351 388 H HN 0.441 8.721 8.280 -0.000 0.000 0.602 389 H N -0.766 118.419 119.070 0.192 0.000 2.581 389 H HA 0.049 4.604 4.556 -0.002 0.000 0.275 389 H C -0.062 175.363 175.328 0.162 0.000 1.126 389 H CA -0.383 55.752 56.048 0.145 0.000 1.097 389 H CB 0.529 30.329 29.762 0.064 0.000 1.626 389 H HN 0.220 8.500 8.280 -0.000 0.000 0.565 390 D N 1.321 121.892 120.400 0.286 0.000 2.382 390 D HA -0.059 4.579 4.640 -0.002 0.000 0.259 390 D C 0.567 176.960 176.300 0.156 0.000 1.224 390 D CA 0.314 54.428 54.000 0.190 0.000 0.894 390 D CB 0.910 41.802 40.800 0.152 0.000 1.127 390 D HN 0.434 8.804 8.370 -0.000 0.000 0.487 391 E N 2.341 122.607 120.200 0.111 0.000 2.418 391 E HA -0.131 4.218 4.350 -0.002 0.000 0.197 391 E C 1.408 178.032 176.600 0.040 0.000 1.026 391 E CA 0.403 56.853 56.400 0.082 0.000 0.862 391 E CB 0.320 30.060 29.700 0.068 0.000 0.799 391 E HN 0.607 8.967 8.360 -0.000 0.000 0.518 392 E N 0.103 120.317 120.200 0.024 0.000 2.033 392 E HA -0.130 4.219 4.350 -0.002 0.000 0.189 392 E C 1.979 178.520 176.600 -0.097 0.000 0.979 392 E CA 0.856 57.249 56.400 -0.012 0.000 0.802 392 E CB -0.020 29.693 29.700 0.021 0.000 0.763 392 E HN 0.239 8.599 8.360 -0.000 0.000 0.449 393 A N 0.352 123.072 122.820 -0.167 0.000 1.873 393 A HA -0.065 4.254 4.320 -0.002 0.000 0.215 393 A C 0.562 177.723 177.584 -0.706 0.000 1.186 393 A CA 0.998 52.741 52.037 -0.491 0.000 0.616 393 A CB -0.130 18.535 19.000 -0.559 0.000 0.823 393 A HN 0.276 8.426 8.150 -0.000 0.000 0.442 394 F N -0.223 119.716 119.950 -0.019 0.000 2.809 394 F HA 0.366 4.892 4.527 -0.002 0.000 0.369 394 F C -2.777 173.001 175.800 -0.037 0.000 1.225 394 F CA -3.030 54.941 58.000 -0.049 0.000 1.201 394 F CB 1.115 40.064 39.000 -0.084 0.000 1.527 394 F HN -0.076 8.224 8.300 -0.000 0.000 0.565 395 P HA -0.010 4.410 4.420 -0.000 0.000 0.265 395 P C 0.063 177.403 177.300 0.066 0.000 1.193 395 P CA 0.504 63.641 63.100 0.061 0.000 0.765 395 P CB 0.469 32.186 31.700 0.028 0.000 0.823 396 E N 1.621 121.858 120.200 0.062 0.000 2.271 396 E HA -0.174 4.175 4.350 -0.002 0.000 0.223 396 E C -1.329 175.299 176.600 0.046 0.000 1.223 396 E CA -0.138 56.294 56.400 0.054 0.000 0.704 396 E CB -0.601 29.124 29.700 0.041 0.000 1.194 396 E HN 0.495 8.855 8.360 -0.000 0.000 0.375 397 P HA -0.135 4.285 4.420 -0.000 0.000 0.226 397 P C 0.897 178.178 177.300 -0.032 0.000 1.153 397 P CA 0.700 63.784 63.100 -0.027 0.000 0.777 397 P CB 0.268 31.951 31.700 -0.030 0.000 0.794 398 R N -0.017 120.533 120.500 0.084 0.000 2.310 398 R HA 0.109 4.448 4.340 -0.002 0.000 0.202 398 R C 1.186 177.520 176.300 0.056 0.000 0.933 398 R CA -0.086 56.072 56.100 0.097 0.000 1.054 398 R CB -0.684 29.685 30.300 0.115 0.000 0.985 398 R HN 0.284 8.554 8.270 -0.000 0.000 0.489 399 R N 0.014 120.534 120.500 0.035 0.000 2.312 399 R HA 0.080 4.418 4.340 -0.002 0.000 0.311 399 R C -1.133 175.174 176.300 0.012 0.000 1.004 399 R CA -0.510 55.617 56.100 0.045 0.000 0.902 399 R CB 0.534 30.863 30.300 0.047 0.000 1.073 399 R HN -0.026 8.244 8.270 -0.000 0.000 0.457 400 W N 5.860 127.036 121.300 -0.206 0.000 2.358 400 W HA 0.217 4.875 4.660 -0.002 0.000 0.307 400 W C -1.044 175.307 176.519 -0.281 0.000 1.203 400 W CA -0.150 56.978 57.345 -0.363 0.000 1.279 400 W CB 0.865 29.911 29.460 -0.689 0.000 1.264 400 W HN 0.545 8.725 8.180 -0.000 0.000 0.474 401 D N 8.473 128.472 120.400 -0.667 0.000 2.336 401 D HA 0.262 4.901 4.640 -0.002 0.000 0.248 401 D C -1.804 173.996 176.300 -0.833 0.000 1.326 401 D CA -2.198 51.426 54.000 -0.626 0.000 0.973 401 D CB 2.027 42.687 40.800 -0.233 0.000 1.255 401 D HN 0.090 8.460 8.370 -0.000 0.000 0.558 402 P HA -0.037 4.383 4.420 -0.000 0.000 0.226 402 P C 0.634 177.659 177.300 -0.459 0.000 1.153 402 P CA 0.706 63.241 63.100 -0.941 0.000 0.777 402 P CB 0.434 31.431 31.700 -1.172 0.000 0.794 403 E N -0.219 119.830 120.200 -0.253 0.000 2.482 403 E HA -0.070 4.279 4.350 -0.002 0.000 0.196 403 E C 0.973 177.516 176.600 -0.094 0.000 1.047 403 E CA -0.069 56.294 56.400 -0.062 0.000 0.869 403 E CB -0.260 29.479 29.700 0.064 0.000 0.836 403 E HN 0.423 8.783 8.360 -0.000 0.000 0.520 404 R N 1.087 121.493 120.500 -0.157 0.000 2.679 404 R HA 0.191 4.530 4.340 -0.002 0.000 0.269 404 R C -0.406 175.841 176.300 -0.088 0.000 1.076 404 R CA -0.047 55.992 56.100 -0.101 0.000 1.160 404 R CB 0.655 30.901 30.300 -0.090 0.000 1.054 404 R HN -0.256 8.014 8.270 -0.000 0.000 0.507 405 D N 0.512 120.882 120.400 -0.051 0.000 2.601 405 D HA 0.079 4.717 4.640 -0.002 0.000 0.230 405 D C -0.796 175.465 176.300 -0.065 0.000 1.106 405 D CA -0.694 53.275 54.000 -0.052 0.000 0.873 405 D CB 1.834 42.598 40.800 -0.061 0.000 1.515 405 D HN 0.715 9.085 8.370 -0.000 0.000 0.468 406 E N 0.890 121.041 120.200 -0.082 0.000 2.417 406 E HA 0.033 4.382 4.350 -0.002 0.000 0.261 406 E C 0.271 176.705 176.600 -0.276 0.000 1.000 406 E CA -0.175 56.040 56.400 -0.309 0.000 0.919 406 E CB 0.998 30.591 29.700 -0.178 0.000 0.955 406 E HN 0.086 8.446 8.360 -0.000 0.000 0.455 407 K N 2.462 122.645 120.400 -0.362 0.000 2.305 407 K HA 0.077 4.396 4.320 -0.002 0.000 0.199 407 K C 0.264 176.753 176.600 -0.186 0.000 1.047 407 K CA 0.259 56.419 56.287 -0.212 0.000 0.976 407 K CB 0.341 32.739 32.500 -0.172 0.000 0.765 407 K HN 0.373 8.623 8.250 -0.000 0.000 0.474 408 V N 2.723 122.475 119.914 -0.270 0.000 2.328 408 V HA 0.111 4.230 4.120 -0.002 0.000 0.278 408 V C 0.132 176.119 176.094 -0.178 0.000 1.021 408 V CA -1.004 61.151 62.300 -0.240 0.000 0.838 408 V CB 1.100 32.681 31.823 -0.405 0.000 0.999 408 V HN 0.202 8.392 8.190 -0.000 0.000 0.447 409 E N 3.894 124.038 120.200 -0.094 0.000 2.765 409 E HA 0.137 4.486 4.350 -0.002 0.000 0.256 409 E C 1.314 177.918 176.600 0.007 0.000 0.935 409 E CA 1.288 57.671 56.400 -0.029 0.000 0.954 409 E CB 0.096 29.797 29.700 0.001 0.000 0.908 409 E HN 1.081 9.441 8.360 -0.000 0.000 0.500 410 G N 2.733 111.580 108.800 0.077 0.000 2.148 410 G HA2 -0.360 3.599 3.960 -0.002 0.000 0.254 410 G HA3 -0.360 3.599 3.960 -0.002 0.000 0.254 410 G C 0.808 175.897 174.900 0.314 0.000 0.981 410 G CA 0.534 45.739 45.100 0.175 0.000 0.670 410 G HN 0.785 9.075 8.290 -0.000 0.000 0.528 411 A N -0.568 122.389 122.820 0.228 0.000 2.014 411 A HA 0.490 4.808 4.320 -0.002 0.000 0.218 411 A C 1.007 178.991 177.584 0.666 0.000 1.163 411 A CA 1.106 53.365 52.037 0.369 0.000 0.652 411 A CB -0.094 18.931 19.000 0.042 0.000 0.808 411 A HN 1.308 9.458 8.150 -0.000 0.000 0.449 412 F N 1.394 121.593 119.950 0.415 0.000 2.506 412 F HA 0.393 4.918 4.527 -0.002 0.000 0.371 412 F C 0.611 176.570 175.800 0.266 0.000 1.078 412 F CA -0.297 57.890 58.000 0.312 0.000 1.195 412 F CB 0.549 39.627 39.000 0.131 0.000 1.099 412 F HN 0.250 8.550 8.300 -0.000 0.000 0.548 413 I N 3.514 123.986 120.570 -0.164 0.000 3.621 413 I HA 0.391 4.560 4.170 -0.002 0.000 0.325 413 I C 1.263 177.090 176.117 -0.483 0.000 1.554 413 I CA -0.127 60.971 61.300 -0.336 0.000 1.053 413 I CB 0.160 37.996 38.000 -0.273 0.000 1.302 413 I HN 0.660 8.870 8.210 -0.000 0.000 0.518 414 G N 1.648 109.784 108.800 -1.107 0.000 2.422 414 G HA2 -0.152 3.807 3.960 -0.002 0.000 0.218 414 G HA3 -0.152 3.807 3.960 -0.002 0.000 0.218 414 G C 0.742 175.307 174.900 -0.558 0.000 1.146 414 G CA 0.821 45.435 45.100 -0.809 0.000 0.769 414 G HN 0.432 8.722 8.290 -0.000 0.000 0.547 415 F N 1.759 121.610 119.950 -0.165 0.000 2.730 415 F HA 0.445 4.971 4.527 -0.002 0.000 0.295 415 F C 1.671 177.472 175.800 0.002 0.000 1.143 415 F CA -0.283 57.733 58.000 0.027 0.000 1.367 415 F CB 0.029 39.110 39.000 0.135 0.000 0.970 415 F HN 0.361 8.661 8.300 -0.000 0.000 0.514 416 G N 1.091 109.916 108.800 0.042 0.000 2.633 416 G HA2 0.129 4.088 3.960 -0.002 0.000 0.263 416 G HA3 0.129 4.088 3.960 -0.002 0.000 0.263 416 G C -0.390 174.316 174.900 -0.323 0.000 1.310 416 G CA -0.319 44.764 45.100 -0.029 0.000 0.914 416 G HN 1.052 9.342 8.290 -0.000 0.000 0.569 417 A N -2.559 119.979 122.820 -0.470 0.000 2.566 417 A HA 1.081 5.400 4.320 -0.002 0.000 0.290 417 A C 1.169 178.726 177.584 -0.045 0.000 1.071 417 A CA 1.245 53.029 52.037 -0.423 0.000 0.658 417 A CB 0.636 19.151 19.000 -0.809 0.000 1.285 417 A HN 3.216 11.366 8.150 -0.000 0.000 0.427 418 G N -1.077 107.735 108.800 0.020 0.000 2.527 418 G HA2 0.034 3.993 3.960 -0.002 0.000 0.268 418 G HA3 0.034 3.993 3.960 -0.002 0.000 0.268 418 G C 1.429 176.360 174.900 0.052 0.000 1.175 418 G CA 1.807 46.964 45.100 0.095 0.000 0.962 418 G HN 2.371 10.662 8.290 -0.000 0.000 0.560 419 V N -1.426 118.491 119.914 0.005 0.000 2.515 419 V HA 0.013 4.132 4.120 -0.002 0.000 0.250 419 V C 1.878 177.789 176.094 -0.304 0.000 1.058 419 V CA 2.735 64.932 62.300 -0.172 0.000 1.064 419 V CB -0.559 31.109 31.823 -0.258 0.000 0.675 419 V HN 0.790 8.980 8.190 -0.000 0.000 0.461 420 H N 0.237 119.388 119.070 0.135 0.000 2.505 420 H HA 0.353 4.908 4.556 -0.002 0.000 0.286 420 H C 0.835 176.290 175.328 0.212 0.000 1.072 420 H CA -0.284 55.881 56.048 0.194 0.000 1.141 420 H CB 0.079 29.978 29.762 0.228 0.000 1.550 420 H HN 0.527 8.807 8.280 -0.000 0.000 0.547 421 K N 1.435 121.963 120.400 0.215 0.000 2.579 421 K HA -0.122 4.197 4.320 -0.002 0.000 0.277 421 K C 0.117 176.837 176.600 0.200 0.000 0.985 421 K CA 0.076 56.461 56.287 0.163 0.000 1.088 421 K CB 0.408 32.957 32.500 0.082 0.000 0.836 421 K HN 0.249 8.499 8.250 -0.000 0.000 0.487 422 C N 6.594 126.032 119.300 0.230 0.000 2.633 422 C HA 0.075 4.534 4.460 -0.002 0.000 0.415 422 C C 1.921 177.011 174.990 0.166 0.000 1.393 422 C CA -0.282 58.884 59.018 0.246 0.000 1.700 422 C CB -1.375 26.574 27.740 0.347 0.000 2.541 422 C HN 0.852 9.082 8.230 -0.000 0.000 0.603 423 I N 3.458 124.128 120.570 0.166 0.000 3.578 423 I HA 0.320 4.489 4.170 -0.002 0.000 0.295 423 I C 1.503 177.703 176.117 0.138 0.000 1.280 423 I CA 1.224 62.599 61.300 0.125 0.000 1.347 423 I CB -0.236 37.835 38.000 0.117 0.000 1.051 423 I HN 0.667 8.877 8.210 -0.000 0.000 0.460 424 G N 0.353 109.259 108.800 0.177 0.000 3.062 424 G HA2 0.004 3.963 3.960 -0.002 0.000 0.228 424 G HA3 0.004 3.963 3.960 -0.002 0.000 0.228 424 G C 1.270 176.302 174.900 0.220 0.000 1.094 424 G CA 0.260 45.501 45.100 0.236 0.000 0.782 424 G HN 0.426 8.716 8.290 -0.000 0.000 0.541 425 Q N 0.575 120.415 119.800 0.067 0.000 2.084 425 Q HA -0.324 4.015 4.340 -0.002 0.000 0.215 425 Q C 2.294 178.234 176.000 -0.100 0.000 1.020 425 Q CA 2.346 57.993 55.803 -0.260 0.000 0.887 425 Q CB -0.073 28.287 28.738 -0.631 0.000 0.975 425 Q HN 0.257 8.527 8.270 -0.000 0.000 0.413 426 K N -0.194 120.230 120.400 0.040 0.000 2.032 426 K HA -0.153 4.166 4.320 -0.002 0.000 0.209 426 K C 1.687 178.505 176.600 0.363 0.000 1.048 426 K CA 1.682 58.086 56.287 0.195 0.000 0.927 426 K CB -0.699 31.950 32.500 0.248 0.000 0.712 426 K HN 0.338 8.588 8.250 -0.000 0.000 0.441 427 F N 0.427 120.569 119.950 0.320 0.000 2.134 427 F HA -0.053 4.472 4.527 -0.003 0.000 0.299 427 F C 1.956 177.773 175.800 0.028 0.000 1.097 427 F CA 1.835 59.948 58.000 0.188 0.000 1.264 427 F CB -0.757 38.379 39.000 0.226 0.000 1.001 427 F HN 0.075 8.375 8.300 -0.000 0.000 0.479 428 G N 0.602 109.431 108.800 0.048 0.000 2.418 428 G HA2 -0.222 3.736 3.960 -0.002 0.000 0.217 428 G HA3 -0.222 3.736 3.960 -0.002 0.000 0.217 428 G C 1.777 176.635 174.900 -0.070 0.000 1.158 428 G CA 1.034 46.103 45.100 -0.052 0.000 0.771 428 G HN 0.433 8.723 8.290 -0.000 0.000 0.545 429 L N -0.313 120.920 121.223 0.017 0.000 2.217 429 L HA 0.067 4.406 4.340 -0.002 0.000 0.211 429 L C 2.629 179.479 176.870 -0.034 0.000 1.107 429 L CA 0.062 54.923 54.840 0.035 0.000 0.783 429 L CB -0.242 41.856 42.059 0.064 0.000 0.919 429 L HN 0.221 8.451 8.230 -0.000 0.000 0.442 430 L N -0.220 120.943 121.223 -0.100 0.000 1.989 430 L HA -0.276 4.063 4.340 -0.002 0.000 0.211 430 L C 2.582 179.320 176.870 -0.220 0.000 1.071 430 L CA 1.876 56.616 54.840 -0.168 0.000 0.749 430 L CB -0.460 41.400 42.059 -0.331 0.000 0.890 430 L HN 0.238 8.468 8.230 -0.000 0.000 0.431 431 Q N -1.181 118.401 119.800 -0.362 0.000 2.061 431 Q HA -0.213 4.126 4.340 -0.002 0.000 0.204 431 Q C 2.191 178.090 176.000 -0.169 0.000 0.984 431 Q CA 2.144 57.748 55.803 -0.332 0.000 0.846 431 Q CB -0.346 28.113 28.738 -0.465 0.000 0.902 431 Q HN 0.487 8.757 8.270 -0.000 0.000 0.421 432 V N 1.201 121.052 119.914 -0.105 0.000 2.261 432 V HA -0.296 3.823 4.120 -0.002 0.000 0.246 432 V C 2.062 178.166 176.094 0.018 0.000 1.047 432 V CA 2.000 64.285 62.300 -0.024 0.000 1.015 432 V CB -0.426 31.418 31.823 0.034 0.000 0.642 432 V HN 0.314 8.504 8.190 -0.000 0.000 0.446 433 K N -0.278 120.135 120.400 0.023 0.000 2.057 433 K HA -0.149 4.170 4.320 -0.002 0.000 0.207 433 K C 2.190 178.834 176.600 0.072 0.000 1.049 433 K CA 1.913 58.240 56.287 0.066 0.000 0.931 433 K CB -0.540 31.993 32.500 0.056 0.000 0.714 433 K HN 0.468 8.718 8.250 -0.000 0.000 0.440 434 T N 1.644 116.207 114.554 0.014 0.000 2.720 434 T HA -0.123 4.226 4.350 -0.002 0.000 0.268 434 T C 1.887 176.610 174.700 0.038 0.000 1.037 434 T CA 1.182 63.292 62.100 0.017 0.000 1.144 434 T CB -0.199 68.645 68.868 -0.040 0.000 0.864 434 T HN 0.131 8.371 8.240 -0.000 0.000 0.444 435 I N 0.650 121.223 120.570 0.005 0.000 2.133 435 I HA -0.126 4.042 4.170 -0.002 0.000 0.238 435 I C 2.336 178.512 176.117 0.098 0.000 1.074 435 I CA 1.200 62.504 61.300 0.007 0.000 1.342 435 I CB -0.445 37.521 38.000 -0.056 0.000 1.053 435 I HN 0.182 8.392 8.210 -0.000 0.000 0.404 436 L N 0.598 121.910 121.223 0.149 0.000 2.089 436 L HA -0.291 4.048 4.340 -0.002 0.000 0.213 436 L C 2.774 179.872 176.870 0.380 0.000 1.079 436 L CA 1.608 56.630 54.840 0.303 0.000 0.758 436 L CB -0.805 41.432 42.059 0.297 0.000 0.891 436 L HN 0.314 8.544 8.230 -0.000 0.000 0.433 437 A N -0.539 122.448 122.820 0.278 0.000 1.854 437 A HA -0.144 4.175 4.320 -0.002 0.000 0.214 437 A C 2.356 180.110 177.584 0.283 0.000 1.192 437 A CA 1.953 54.170 52.037 0.300 0.000 0.611 437 A CB -0.912 18.262 19.000 0.291 0.000 0.832 437 A HN 0.358 8.508 8.150 -0.000 0.000 0.442 438 T N 0.803 115.484 114.554 0.213 0.000 2.635 438 T HA -0.125 4.224 4.350 -0.002 0.000 0.267 438 T C 2.219 177.076 174.700 0.262 0.000 1.040 438 T CA 1.990 64.206 62.100 0.192 0.000 1.156 438 T CB -0.626 68.310 68.868 0.113 0.000 0.863 438 T HN 0.593 8.833 8.240 -0.000 0.000 0.430 439 A N 0.736 123.713 122.820 0.261 0.000 1.908 439 A HA -0.010 4.309 4.320 -0.002 0.000 0.218 439 A C 1.955 179.783 177.584 0.407 0.000 1.181 439 A CA 1.441 53.691 52.037 0.355 0.000 0.627 439 A CB -0.896 18.238 19.000 0.222 0.000 0.818 439 A HN 0.477 8.627 8.150 -0.000 0.000 0.445 440 F N -0.630 119.569 119.950 0.415 0.000 2.664 440 F HA 0.113 4.639 4.527 -0.002 0.000 0.296 440 F C 2.233 178.163 175.800 0.218 0.000 1.125 440 F CA 0.776 58.984 58.000 0.347 0.000 1.444 440 F CB -0.166 39.013 39.000 0.299 0.000 1.114 440 F HN 0.220 8.520 8.300 -0.000 0.000 0.576 441 R N -0.173 120.538 120.500 0.351 0.000 2.091 441 R HA -0.146 4.192 4.340 -0.002 0.000 0.238 441 R C 1.469 177.848 176.300 0.132 0.000 1.136 441 R CA 2.097 58.323 56.100 0.210 0.000 0.959 441 R CB -0.343 30.067 30.300 0.183 0.000 0.856 441 R HN 0.137 8.407 8.270 -0.000 0.000 0.437 442 S N -1.540 114.235 115.700 0.125 0.000 2.512 442 S HA 0.202 4.671 4.470 -0.002 0.000 0.216 442 S C -0.766 173.607 174.600 -0.379 0.000 1.006 442 S CA -0.210 57.917 58.200 -0.123 0.000 0.915 442 S CB 0.388 63.482 63.200 -0.177 0.000 0.824 442 S HN 0.238 8.548 8.310 -0.000 0.000 0.497 443 Y N 0.937 121.238 120.300 0.001 0.000 2.576 443 Y HA 0.517 5.066 4.550 -0.002 0.000 0.346 443 Y C -0.146 175.581 175.900 -0.289 0.000 1.018 443 Y CA -1.336 56.628 58.100 -0.226 0.000 1.050 443 Y CB 1.158 39.313 38.460 -0.508 0.000 1.280 443 Y HN -0.072 8.208 8.280 -0.000 0.000 0.474 444 D N 0.402 120.665 120.400 -0.228 0.000 2.442 444 D HA 0.518 5.157 4.640 -0.002 0.000 0.254 444 D C -1.462 174.436 176.300 -0.670 0.000 1.069 444 D CA -0.149 53.725 54.000 -0.209 0.000 1.017 444 D CB 1.829 42.616 40.800 -0.020 0.000 1.172 444 D HN 0.258 8.628 8.370 -0.000 0.000 0.561 445 F N 0.350 120.368 119.950 0.112 0.000 2.574 445 F HA 0.214 4.739 4.527 -0.002 0.000 0.313 445 F C 0.090 175.901 175.800 0.018 0.000 1.130 445 F CA -0.851 57.155 58.000 0.010 0.000 0.936 445 F CB 1.927 40.896 39.000 -0.051 0.000 1.219 445 F HN -0.002 8.298 8.300 -0.000 0.000 0.445 446 Q N 3.704 123.581 119.800 0.129 0.000 2.347 446 Q HA 0.521 4.860 4.340 -0.002 0.000 0.262 446 Q C -1.465 174.563 176.000 0.048 0.000 0.980 446 Q CA -1.071 54.768 55.803 0.061 0.000 0.867 446 Q CB 1.724 30.463 28.738 0.003 0.000 1.242 446 Q HN 0.767 9.037 8.270 -0.000 0.000 0.453 447 L N 5.158 126.407 121.223 0.043 0.000 2.367 447 L HA 0.162 4.501 4.340 -0.002 0.000 0.275 447 L C -0.420 176.451 176.870 0.002 0.000 1.129 447 L CA 0.527 55.379 54.840 0.021 0.000 0.839 447 L CB 0.652 42.740 42.059 0.049 0.000 1.133 447 L HN 0.827 9.057 8.230 -0.000 0.000 0.453 448 L N 6.197 127.412 121.223 -0.012 0.000 2.888 448 L HA 0.299 4.638 4.340 -0.002 0.000 0.237 448 L C 0.112 176.976 176.870 -0.010 0.000 1.288 448 L CA -0.208 54.622 54.840 -0.017 0.000 1.110 448 L CB -0.881 41.160 42.059 -0.029 0.000 1.441 448 L HN 0.740 8.970 8.230 -0.000 0.000 0.474 449 R N -3.483 117.020 120.500 0.006 0.000 2.756 449 R HA 0.309 4.648 4.340 -0.002 0.000 0.273 449 R C -0.515 175.812 176.300 0.045 0.000 1.030 449 R CA -0.967 55.143 56.100 0.017 0.000 0.887 449 R CB 0.508 30.817 30.300 0.013 0.000 1.274 449 R HN -0.266 8.004 8.270 -0.000 0.000 0.461 450 D N 0.252 120.687 120.400 0.060 0.000 2.234 450 D HA 0.006 4.645 4.640 -0.002 0.000 0.205 450 D C -0.307 176.130 176.300 0.229 0.000 0.962 450 D CA 1.327 55.387 54.000 0.100 0.000 0.855 450 D CB 0.371 41.218 40.800 0.079 0.000 0.951 450 D HN 0.303 8.673 8.370 -0.000 0.000 0.500 451 E N 0.444 120.741 120.200 0.162 0.000 2.256 451 E HA 0.289 4.638 4.350 -0.002 0.000 0.267 451 E C -0.160 176.469 176.600 0.049 0.000 0.892 451 E CA -1.000 55.468 56.400 0.114 0.000 0.775 451 E CB 2.664 32.397 29.700 0.055 0.000 1.207 451 E HN -0.258 8.102 8.360 -0.000 0.000 0.420 452 V N 3.544 123.418 119.914 -0.067 0.000 2.872 452 V HA -0.074 4.045 4.120 -0.002 0.000 0.302 452 V C -1.904 174.202 176.094 0.021 0.000 1.166 452 V CA -0.232 62.034 62.300 -0.057 0.000 1.298 452 V CB -0.279 31.473 31.823 -0.118 0.000 0.894 452 V HN 0.527 8.717 8.190 -0.000 0.000 0.509 453 P HA 0.068 4.488 4.420 -0.000 0.000 0.269 453 P C -0.572 176.794 177.300 0.110 0.000 1.217 453 P CA -0.167 62.926 63.100 -0.012 0.000 0.783 453 P CB 0.326 31.922 31.700 -0.172 0.000 0.898 454 D N 2.592 123.025 120.400 0.055 0.000 2.382 454 D HA 0.110 4.749 4.640 -0.002 0.000 0.245 454 D C -1.964 174.384 176.300 0.080 0.000 1.120 454 D CA -0.927 53.118 54.000 0.074 0.000 0.890 454 D CB -0.202 40.608 40.800 0.017 0.000 1.201 454 D HN 0.255 8.625 8.370 -0.000 0.000 0.433 455 P HA 0.068 4.488 4.420 -0.000 0.000 0.272 455 P C -0.514 176.577 177.300 -0.349 0.000 1.223 455 P CA -0.240 62.818 63.100 -0.071 0.000 0.784 455 P CB 0.836 32.381 31.700 -0.259 0.000 0.923 456 D N 1.357 121.577 120.400 -0.300 0.000 2.440 456 D HA 0.170 4.809 4.640 -0.002 0.000 0.239 456 D C -0.391 175.811 176.300 -0.163 0.000 1.084 456 D CA -0.601 53.291 54.000 -0.180 0.000 0.843 456 D CB 0.248 41.031 40.800 -0.027 0.000 1.097 456 D HN 0.157 8.527 8.370 -0.000 0.000 0.531 457 Y N 1.778 122.113 120.300 0.058 0.000 2.490 457 Y HA 0.056 4.605 4.550 -0.002 0.000 0.281 457 Y C 1.873 177.802 175.900 0.048 0.000 1.174 457 Y CA 0.229 58.347 58.100 0.030 0.000 1.295 457 Y CB -0.517 37.941 38.460 -0.004 0.000 1.062 457 Y HN 0.638 8.918 8.280 -0.000 0.000 0.522 458 H N -0.916 118.228 119.070 0.123 0.000 2.495 458 H HA 0.024 4.579 4.556 -0.002 0.000 0.287 458 H C 0.780 176.149 175.328 0.067 0.000 1.033 458 H CA 1.015 57.112 56.048 0.082 0.000 1.307 458 H CB -0.336 29.454 29.762 0.046 0.000 1.401 458 H HN 0.077 8.357 8.280 -0.000 0.000 0.555 459 T N -3.083 111.197 114.554 -0.457 0.000 2.928 459 T HA 0.128 4.477 4.350 -0.002 0.000 0.284 459 T C 1.498 176.129 174.700 -0.115 0.000 1.008 459 T CA -0.461 61.399 62.100 -0.399 0.000 1.057 459 T CB 1.518 70.128 68.868 -0.430 0.000 1.018 459 T HN 0.419 8.659 8.240 -0.000 0.000 0.493 460 M N 1.663 121.225 119.600 -0.063 0.000 2.089 460 M HA -0.052 4.426 4.480 -0.002 0.000 0.257 460 M C -0.244 176.072 176.300 0.027 0.000 1.071 460 M CA 1.785 57.099 55.300 0.024 0.000 1.096 460 M CB -0.058 32.588 32.600 0.077 0.000 1.330 460 M HN 0.521 8.811 8.290 -0.000 0.000 0.403 461 V N 1.851 121.738 119.914 -0.045 0.000 2.378 461 V HA 0.305 4.424 4.120 -0.002 0.000 0.288 461 V C -0.390 175.688 176.094 -0.027 0.000 1.016 461 V CA -0.907 61.373 62.300 -0.034 0.000 0.840 461 V CB 1.282 33.034 31.823 -0.119 0.000 0.994 461 V HN 0.004 8.194 8.190 -0.000 0.000 0.431 462 V N 4.494 124.432 119.914 0.039 0.000 2.546 462 V HA 0.808 4.927 4.120 -0.002 0.000 0.284 462 V C 0.874 177.015 176.094 0.077 0.000 1.050 462 V CA 0.357 62.686 62.300 0.047 0.000 0.981 462 V CB 1.248 33.150 31.823 0.132 0.000 0.990 462 V HN 0.982 9.172 8.190 -0.000 0.000 0.474 463 G N 4.778 113.585 108.800 0.011 0.000 3.015 463 G HA2 0.726 4.685 3.960 -0.002 0.000 0.281 463 G HA3 0.726 4.685 3.960 -0.002 0.000 0.281 463 G C -3.109 171.708 174.900 -0.139 0.000 1.386 463 G CA -1.433 43.652 45.100 -0.025 0.000 0.959 463 G HN 0.526 8.816 8.290 -0.000 0.000 0.522 464 P HA 0.176 4.596 4.420 -0.000 0.000 0.272 464 P C -0.010 177.079 177.300 -0.351 0.000 1.223 464 P CA 0.111 62.799 63.100 -0.687 0.000 0.784 464 P CB 0.440 31.346 31.700 -1.324 0.000 0.923 465 T N 2.152 116.570 114.554 -0.227 0.000 2.784 465 T HA 0.164 4.512 4.350 -0.002 0.000 0.291 465 T C 1.722 176.335 174.700 -0.145 0.000 0.942 465 T CA 0.384 62.405 62.100 -0.132 0.000 1.161 465 T CB 0.325 69.146 68.868 -0.079 0.000 0.885 465 T HN 0.434 8.674 8.240 -0.000 0.000 0.534 466 A N 4.115 126.870 122.820 -0.109 0.000 1.892 466 A HA -0.151 4.168 4.320 -0.002 0.000 0.218 466 A C 2.556 180.090 177.584 -0.082 0.000 1.188 466 A CA 2.122 54.098 52.037 -0.101 0.000 0.631 466 A CB -1.126 17.839 19.000 -0.057 0.000 0.822 466 A HN 0.894 9.044 8.150 -0.000 0.000 0.447 467 S N -0.499 115.167 115.700 -0.057 0.000 2.419 467 S HA -0.252 4.217 4.470 -0.002 0.000 0.235 467 S C 1.633 176.199 174.600 -0.057 0.000 1.019 467 S CA 1.665 59.838 58.200 -0.046 0.000 0.982 467 S CB -0.507 62.674 63.200 -0.033 0.000 0.789 467 S HN 0.708 9.018 8.310 -0.000 0.000 0.490 468 Q N -0.717 119.037 119.800 -0.076 0.000 2.360 468 Q HA 0.264 4.603 4.340 -0.002 0.000 0.202 468 Q C 0.672 176.609 176.000 -0.104 0.000 0.915 468 Q CA 0.109 55.865 55.803 -0.079 0.000 0.943 468 Q CB 0.029 28.722 28.738 -0.075 0.000 1.064 468 Q HN 0.614 8.884 8.270 -0.000 0.000 0.511 469 C N 1.628 120.853 119.300 -0.126 0.000 2.525 469 C HA 0.241 4.700 4.460 -0.002 0.000 0.313 469 C C 0.577 175.499 174.990 -0.114 0.000 1.311 469 C CA -0.600 58.327 59.018 -0.151 0.000 1.725 469 C CB -1.254 26.366 27.740 -0.201 0.000 1.926 469 C HN 0.287 8.517 8.230 -0.000 0.000 0.595 470 R N 0.901 121.353 120.500 -0.081 0.000 2.491 470 R HA 0.484 4.823 4.340 -0.002 0.000 0.283 470 R C -0.561 175.698 176.300 -0.069 0.000 1.072 470 R CA 0.397 56.459 56.100 -0.064 0.000 1.048 470 R CB 0.725 30.997 30.300 -0.046 0.000 0.983 470 R HN 0.140 8.410 8.270 -0.000 0.000 0.450 471 V N 2.284 122.156 119.914 -0.071 0.000 3.049 471 V HA 0.264 4.383 4.120 -0.002 0.000 0.309 471 V C -0.670 175.392 176.094 -0.054 0.000 1.148 471 V CA -0.997 61.266 62.300 -0.060 0.000 0.990 471 V CB 2.670 34.436 31.823 -0.094 0.000 1.039 471 V HN 0.627 8.817 8.190 -0.000 0.000 0.430 472 K N 2.661 123.040 120.400 -0.035 0.000 2.240 472 K HA 0.515 4.834 4.320 -0.002 0.000 0.271 472 K C -1.111 175.445 176.600 -0.072 0.000 1.018 472 K CA -0.533 55.691 56.287 -0.105 0.000 0.874 472 K CB 0.895 33.329 32.500 -0.110 0.000 1.098 472 K HN 0.683 8.933 8.250 -0.000 0.000 0.458 473 Y N 3.265 123.453 120.300 -0.188 0.000 2.310 473 Y HA 0.584 5.133 4.550 -0.001 0.000 0.326 473 Y C -0.680 175.113 175.900 -0.178 0.000 1.151 473 Y CA -1.091 56.814 58.100 -0.325 0.000 1.195 473 Y CB 0.587 38.703 38.460 -0.572 0.000 1.210 473 Y HN 0.273 8.553 8.280 -0.000 0.000 0.483 474 I N 4.453 125.000 120.570 -0.037 0.000 2.478 474 I HA 0.383 4.551 4.170 -0.002 0.000 0.287 474 I C -0.319 175.846 176.117 0.081 0.000 1.042 474 I CA -1.116 60.176 61.300 -0.012 0.000 1.067 474 I CB 1.738 39.693 38.000 -0.076 0.000 1.233 474 I HN 0.581 8.791 8.210 -0.000 0.000 0.431 475 R N 5.083 125.644 120.500 0.102 0.000 2.734 475 R HA 0.279 4.617 4.340 -0.002 0.000 0.266 475 R C -0.384 175.841 176.300 -0.124 0.000 1.044 475 R CA 0.246 56.288 56.100 -0.097 0.000 1.128 475 R CB 0.560 30.834 30.300 -0.044 0.000 1.010 475 R HN 0.507 8.777 8.270 -0.000 0.000 0.461 476 R N 1.982 122.368 120.500 -0.190 0.000 2.540 476 R HA 0.240 4.578 4.340 -0.002 0.000 0.287 476 R C 0.603 176.855 176.300 -0.080 0.000 0.980 476 R CA -0.040 55.998 56.100 -0.103 0.000 0.966 476 R CB 1.216 31.468 30.300 -0.081 0.000 1.106 476 R HN 0.706 8.976 8.270 -0.000 0.000 0.480 477 K N 0.726 121.098 120.400 -0.047 0.000 2.459 477 K HA 0.214 4.533 4.320 -0.002 0.000 0.193 477 K C 0.591 177.175 176.600 -0.026 0.000 1.030 477 K CA 1.309 57.576 56.287 -0.034 0.000 1.026 477 K CB 0.273 32.759 32.500 -0.023 0.000 0.809 477 K HN 0.724 8.974 8.250 -0.000 0.000 0.504 478 A N 0.000 122.805 122.820 -0.025 0.000 2.254 478 A HA 0.000 4.319 4.320 -0.002 0.000 0.244 478 A CA 0.000 52.029 52.037 -0.012 0.000 0.836 478 A CB 0.000 18.997 19.000 -0.005 0.000 0.831 478 A HN 0.000 8.150 8.150 -0.000 0.000 0.486