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 3i4d_1_M DATA FIRST_RESID 1 DATA SEQUENCE AEYQNIFSQV QVRGPADLGM TEDVNLANRS GVGPFSTLLG WFGNAQLGPI DATA SEQUENCE YLGSLGVLSL FSGLMWFFTI GIWFWYQAGW NPAVFLRDLF FFSLEPPAPE DATA SEQUENCE YGLSFAAPLK EGGLWLIASF FMFVAVWSWW GRTYLRAQAL GMGKHTAWAF DATA SEQUENCE LSAIWLWMVL GFIRPILMGS WSEAVPYGIF SHLDWTNNFS LVHGNLFYNP DATA SEQUENCE FHGLSIAFLY GSALLFAMHG ATILAVSRFG GERELEQIAD RGTAAERAAL DATA SEQUENCE FWRWTMGFNA TMEGIHRWAI WMAVLVTLTG GIGILLSGTV VDNWYVWGQN DATA SEQUENCE HG VARS RESID RESNAME ATOMNAME SS_SHIFT SHIFT RC_SHIFT HM_SHIFT EF_SHIFT SIGMA FORMAT %4d %4s %4s %9.3f %9.3f %9.3f %9.3f %9.3f %9.3f 1 A HA 0.000 4.320 4.320 -0.000 0.000 0.244 1 A C 0.000 177.612 177.584 0.047 0.000 1.274 1 A CA 0.000 52.056 52.037 0.032 0.000 0.836 1 A CB 0.000 19.020 19.000 0.034 0.000 0.831 2 E N 0.645 120.874 120.200 0.049 0.000 2.146 2 E HA 0.497 4.849 4.350 0.003 0.000 0.282 2 E C -0.814 175.847 176.600 0.101 0.000 0.989 2 E CA -0.616 55.822 56.400 0.064 0.000 0.799 2 E CB 1.289 31.008 29.700 0.031 0.000 1.088 2 E HN 0.659 9.019 8.360 -0.000 0.000 0.397 3 Y N 2.991 123.288 120.300 -0.006 0.000 2.610 3 Y HA -0.076 4.476 4.550 0.003 0.000 0.332 3 Y C 0.455 176.347 175.900 -0.014 0.000 1.201 3 Y CA 0.455 58.554 58.100 -0.001 0.000 1.465 3 Y CB 0.757 39.216 38.460 -0.003 0.000 1.283 3 Y HN 0.560 8.840 8.280 -0.000 0.000 0.563 4 Q N 3.650 123.106 119.800 -0.573 0.000 2.189 4 Q HA 0.042 4.384 4.340 0.003 0.000 0.223 4 Q C 0.281 175.874 176.000 -0.678 0.000 0.828 4 Q CA 0.277 55.788 55.803 -0.487 0.000 0.967 4 Q CB 0.001 28.592 28.738 -0.246 0.000 1.139 4 Q HN 0.883 9.153 8.270 -0.000 0.000 0.497 5 N N 0.453 118.366 118.700 -1.313 0.000 2.741 5 N HA -0.165 4.577 4.740 0.003 0.000 0.250 5 N C 0.347 175.615 175.510 -0.402 0.000 1.115 5 N CA 0.369 52.942 53.050 -0.795 0.000 0.724 5 N CB -0.877 37.349 38.487 -0.436 0.000 1.090 5 N HN 0.205 8.585 8.380 -0.000 0.000 0.558 6 I N -1.474 118.874 120.570 -0.370 0.000 2.480 6 I HA 0.053 4.224 4.170 0.003 0.000 0.251 6 I C 0.597 176.388 176.117 -0.544 0.000 1.124 6 I CA 1.082 62.135 61.300 -0.411 0.000 1.444 6 I CB -0.443 37.324 38.000 -0.387 0.000 1.098 6 I HN 0.015 8.225 8.210 -0.000 0.000 0.428 7 F N -0.123 119.894 119.950 0.112 0.000 2.577 7 F HA 0.392 4.921 4.527 0.003 0.000 0.318 7 F C 0.756 176.749 175.800 0.321 0.000 1.065 7 F CA -0.813 57.335 58.000 0.247 0.000 0.929 7 F CB 1.307 40.449 39.000 0.236 0.000 1.237 7 F HN -0.348 7.952 8.300 -0.000 0.000 0.468 8 S N 0.892 116.934 115.700 0.571 0.000 2.592 8 S HA 0.157 4.628 4.470 0.003 0.000 0.271 8 S C 0.745 175.643 174.600 0.498 0.000 1.326 8 S CA -0.595 57.891 58.200 0.476 0.000 1.024 8 S CB 1.237 64.635 63.200 0.330 0.000 0.921 8 S HN 0.694 9.004 8.310 -0.000 0.000 0.527 9 Q N 0.068 120.030 119.800 0.270 0.000 2.297 9 Q HA 0.168 4.510 4.340 0.003 0.000 0.203 9 Q C -0.398 175.746 176.000 0.241 0.000 0.931 9 Q CA 0.620 56.523 55.803 0.165 0.000 0.885 9 Q CB 0.262 28.927 28.738 -0.123 0.000 0.991 9 Q HN 0.425 8.695 8.270 -0.000 0.000 0.498 10 V N 1.410 121.422 119.914 0.163 0.000 2.686 10 V HA 0.242 4.363 4.120 0.003 0.000 0.306 10 V C -0.890 175.221 176.094 0.029 0.000 1.065 10 V CA -0.895 61.465 62.300 0.101 0.000 0.894 10 V CB 1.917 33.758 31.823 0.030 0.000 1.004 10 V HN 0.106 8.296 8.190 -0.000 0.000 0.424 11 Q N 2.476 122.236 119.800 -0.067 0.000 2.245 11 Q HA 0.776 5.118 4.340 0.003 0.000 0.256 11 Q C -0.685 175.255 176.000 -0.099 0.000 0.942 11 Q CA -0.729 54.991 55.803 -0.138 0.000 0.896 11 Q CB 2.699 31.248 28.738 -0.316 0.000 1.272 11 Q HN 0.774 9.044 8.270 -0.000 0.000 0.442 12 V N -0.663 119.204 119.914 -0.078 0.000 2.864 12 V HA 0.775 4.896 4.120 0.003 0.000 0.314 12 V C -0.805 175.242 176.094 -0.079 0.000 1.073 12 V CA -1.038 61.220 62.300 -0.070 0.000 0.956 12 V CB 2.125 33.921 31.823 -0.045 0.000 1.023 12 V HN 0.802 8.992 8.190 -0.000 0.000 0.435 13 R N 1.125 121.563 120.500 -0.103 0.000 2.673 13 R HA 0.787 5.128 4.340 0.003 0.000 0.281 13 R C -0.181 176.045 176.300 -0.122 0.000 0.991 13 R CA 0.102 56.119 56.100 -0.138 0.000 0.896 13 R CB 2.323 32.458 30.300 -0.275 0.000 1.201 13 R HN 1.228 9.498 8.270 -0.000 0.000 0.457 14 G N 2.170 110.916 108.800 -0.090 0.000 3.176 14 G HA2 0.561 4.522 3.960 0.003 0.000 0.272 14 G HA3 0.561 4.522 3.960 0.003 0.000 0.272 14 G C -2.592 172.279 174.900 -0.049 0.000 1.349 14 G CA -1.082 43.980 45.100 -0.062 0.000 0.953 14 G HN 0.431 8.721 8.290 -0.000 0.000 0.559 15 P HA 0.398 4.818 4.420 -0.000 0.000 0.267 15 P C 0.138 177.500 177.300 0.102 0.000 1.200 15 P CA -0.023 63.091 63.100 0.024 0.000 0.772 15 P CB 0.635 32.346 31.700 0.017 0.000 0.855 16 A N 2.247 125.178 122.820 0.184 0.000 2.584 16 A HA -0.014 4.308 4.320 0.003 0.000 0.239 16 A C 0.486 178.135 177.584 0.109 0.000 1.043 16 A CA 0.300 52.484 52.037 0.245 0.000 0.756 16 A CB -0.374 18.748 19.000 0.204 0.000 0.963 16 A HN 0.534 8.684 8.150 -0.000 0.000 0.511 17 D N 2.704 123.153 120.400 0.082 0.000 2.365 17 D HA 0.278 4.920 4.640 0.003 0.000 0.237 17 D C 0.798 177.104 176.300 0.009 0.000 1.190 17 D CA -0.092 53.929 54.000 0.035 0.000 0.867 17 D CB 0.590 41.405 40.800 0.025 0.000 1.050 17 D HN 0.490 8.860 8.370 -0.000 0.000 0.491 18 L N 2.955 124.183 121.223 0.009 0.000 2.599 18 L HA 0.210 4.552 4.340 0.003 0.000 0.230 18 L C 1.442 178.309 176.870 -0.005 0.000 1.141 18 L CA 0.218 55.058 54.840 0.000 0.000 0.877 18 L CB -0.650 41.412 42.059 0.005 0.000 1.009 18 L HN 0.596 8.826 8.230 -0.000 0.000 0.447 19 G N -0.115 108.680 108.800 -0.008 0.000 2.712 19 G HA2 -0.166 3.795 3.960 0.003 0.000 0.683 19 G HA3 -0.166 3.795 3.960 0.003 0.000 0.683 19 G C -0.396 174.493 174.900 -0.018 0.000 1.320 19 G CA -0.972 44.118 45.100 -0.017 0.000 0.847 19 G HN -0.141 8.149 8.290 -0.000 0.000 0.553 20 M N 0.389 119.972 119.600 -0.028 0.000 2.248 20 M HA 0.277 4.759 4.480 0.003 0.000 0.337 20 M C 1.663 177.944 176.300 -0.031 0.000 1.121 20 M CA 0.625 55.907 55.300 -0.031 0.000 1.155 20 M CB 0.218 32.792 32.600 -0.043 0.000 1.514 20 M HN 0.697 8.987 8.290 -0.000 0.000 0.452 21 T N 0.001 114.539 114.554 -0.027 0.000 2.980 21 T HA 0.025 4.377 4.350 0.003 0.000 0.239 21 T C 0.707 175.386 174.700 -0.035 0.000 1.011 21 T CA 0.136 62.223 62.100 -0.022 0.000 1.171 21 T CB 0.223 69.083 68.868 -0.014 0.000 0.873 21 T HN 0.610 8.850 8.240 -0.000 0.000 0.431 22 E N 1.167 121.345 120.200 -0.037 0.000 3.374 22 E HA -0.213 4.138 4.350 0.003 0.000 0.375 22 E C 0.084 176.659 176.600 -0.041 0.000 1.535 22 E CA 1.650 58.023 56.400 -0.044 0.000 1.664 22 E CB -1.251 28.412 29.700 -0.062 0.000 1.707 22 E HN 0.392 8.752 8.360 -0.000 0.000 0.469 23 D N 1.009 121.377 120.400 -0.054 0.000 2.388 23 D HA 0.178 4.820 4.640 0.003 0.000 0.221 23 D C -0.080 176.192 176.300 -0.048 0.000 1.133 23 D CA 0.073 54.046 54.000 -0.046 0.000 0.831 23 D CB 0.235 41.005 40.800 -0.051 0.000 0.962 23 D HN -0.048 8.322 8.370 -0.000 0.000 0.502 24 V N 1.976 121.858 119.914 -0.053 0.000 2.655 24 V HA -0.055 4.067 4.120 0.003 0.000 0.300 24 V C 0.919 177.042 176.094 0.049 0.000 1.044 24 V CA -0.413 61.864 62.300 -0.039 0.000 1.095 24 V CB 0.779 32.572 31.823 -0.050 0.000 0.952 24 V HN 0.084 8.274 8.190 -0.000 0.000 0.485 25 N N 4.392 123.175 118.700 0.139 0.000 2.448 25 N HA 0.152 4.893 4.740 0.003 0.000 0.250 25 N C 0.785 176.375 175.510 0.135 0.000 1.136 25 N CA 0.098 53.224 53.050 0.128 0.000 0.953 25 N CB 0.385 38.955 38.487 0.139 0.000 1.251 25 N HN 0.666 9.046 8.380 -0.000 0.000 0.502 26 L N 2.174 123.439 121.223 0.069 0.000 2.261 26 L HA -0.156 4.186 4.340 0.003 0.000 0.216 26 L C 2.088 178.955 176.870 -0.004 0.000 1.114 26 L CA 1.047 55.914 54.840 0.044 0.000 0.777 26 L CB -0.372 41.699 42.059 0.020 0.000 0.910 26 L HN 0.557 8.787 8.230 -0.000 0.000 0.440 27 A N 0.184 122.992 122.820 -0.019 0.000 2.070 27 A HA -0.199 4.123 4.320 0.003 0.000 0.220 27 A C 1.797 179.309 177.584 -0.120 0.000 1.159 27 A CA 1.712 53.717 52.037 -0.054 0.000 0.656 27 A CB -0.653 18.322 19.000 -0.041 0.000 0.800 27 A HN 0.570 8.720 8.150 -0.000 0.000 0.453 28 N N -1.177 117.401 118.700 -0.205 0.000 2.336 28 N HA 0.075 4.817 4.740 0.003 0.000 0.189 28 N C 0.232 175.452 175.510 -0.483 0.000 1.113 28 N CA -0.210 52.568 53.050 -0.454 0.000 0.858 28 N CB 0.256 38.221 38.487 -0.870 0.000 0.970 28 N HN 0.331 8.711 8.380 -0.000 0.000 0.471 29 R N 1.267 121.635 120.500 -0.219 0.000 2.357 29 R HA 0.183 4.524 4.340 0.003 0.000 0.296 29 R C 0.451 176.698 176.300 -0.089 0.000 1.052 29 R CA -0.282 55.755 56.100 -0.105 0.000 0.988 29 R CB 1.046 31.349 30.300 0.004 0.000 1.025 29 R HN 0.146 8.416 8.270 -0.000 0.000 0.469 30 S N 1.219 116.876 115.700 -0.072 0.000 2.606 30 S HA 0.244 4.715 4.470 0.003 0.000 0.257 30 S C 0.767 175.346 174.600 -0.035 0.000 1.327 30 S CA -0.643 57.526 58.200 -0.052 0.000 0.984 30 S CB 0.905 64.079 63.200 -0.043 0.000 0.941 30 S HN 0.666 8.976 8.310 -0.000 0.000 0.576 31 G N -0.507 108.276 108.800 -0.029 0.000 2.651 31 G HA2 0.442 4.404 3.960 0.003 0.000 0.260 31 G HA3 0.442 4.404 3.960 0.003 0.000 0.260 31 G C 0.198 175.081 174.900 -0.028 0.000 1.216 31 G CA -0.396 44.692 45.100 -0.020 0.000 0.913 31 G HN 1.452 9.742 8.290 -0.000 0.000 0.535 32 V N -0.774 119.124 119.914 -0.028 0.000 2.924 32 V HA 0.646 4.768 4.120 0.003 0.000 0.305 32 V C 1.136 177.191 176.094 -0.066 0.000 1.073 32 V CA -0.197 62.065 62.300 -0.063 0.000 1.098 32 V CB 0.451 32.229 31.823 -0.074 0.000 1.000 32 V HN 0.942 9.132 8.190 -0.000 0.000 0.484 33 G N 2.695 111.429 108.800 -0.110 0.000 2.508 33 G HA2 0.586 4.548 3.960 0.003 0.000 0.278 33 G HA3 0.586 4.548 3.960 0.003 0.000 0.278 33 G C -2.367 172.467 174.900 -0.111 0.000 1.389 33 G CA -1.024 44.021 45.100 -0.091 0.000 1.050 33 G HN 0.822 9.112 8.290 -0.000 0.000 0.522 34 P HA 0.369 4.789 4.420 -0.000 0.000 0.278 34 P C -1.213 176.051 177.300 -0.060 0.000 1.258 34 P CA -0.429 62.682 63.100 0.018 0.000 0.811 34 P CB 0.995 32.718 31.700 0.038 0.000 1.063 35 F N -0.309 119.631 119.950 -0.016 0.000 2.399 35 F HA 0.350 4.879 4.527 0.003 0.000 0.334 35 F C 1.279 177.063 175.800 -0.026 0.000 1.097 35 F CA -0.020 57.965 58.000 -0.026 0.000 1.076 35 F CB 1.392 40.369 39.000 -0.038 0.000 1.162 35 F HN 0.123 8.423 8.300 -0.000 0.000 0.495 36 S N 1.453 117.227 115.700 0.124 0.000 2.566 36 S HA 0.246 4.718 4.470 0.003 0.000 0.324 36 S C 0.679 175.298 174.600 0.031 0.000 1.081 36 S CA -0.553 57.688 58.200 0.069 0.000 1.105 36 S CB 0.832 64.057 63.200 0.042 0.000 0.981 36 S HN 0.718 9.028 8.310 -0.000 0.000 0.464 37 T N 5.328 119.879 114.554 -0.005 0.000 2.867 37 T HA -0.091 4.261 4.350 0.003 0.000 0.268 37 T C 1.737 176.326 174.700 -0.184 0.000 1.057 37 T CA 1.287 63.297 62.100 -0.151 0.000 1.136 37 T CB -0.287 68.515 68.868 -0.110 0.000 0.874 37 T HN 0.570 8.810 8.240 -0.000 0.000 0.466 38 L N 0.965 122.218 121.223 0.050 0.000 1.994 38 L HA 0.041 4.383 4.340 0.003 0.000 0.208 38 L C 2.146 179.142 176.870 0.209 0.000 1.071 38 L CA 1.651 56.621 54.840 0.218 0.000 0.745 38 L CB -0.637 41.525 42.059 0.172 0.000 0.892 38 L HN 0.220 8.450 8.230 -0.000 0.000 0.431 39 L N -0.575 120.720 121.223 0.119 0.000 2.083 39 L HA -0.132 4.210 4.340 0.003 0.000 0.209 39 L C 2.432 179.386 176.870 0.140 0.000 1.083 39 L CA 1.173 56.100 54.840 0.145 0.000 0.752 39 L CB -1.217 40.897 42.059 0.092 0.000 0.899 39 L HN 0.504 8.734 8.230 -0.000 0.000 0.433 40 G N -1.023 107.767 108.800 -0.017 0.000 2.498 40 G HA2 -0.252 3.710 3.960 0.003 0.000 0.219 40 G HA3 -0.252 3.710 3.960 0.003 0.000 0.219 40 G C 1.047 175.880 174.900 -0.112 0.000 1.119 40 G CA 0.116 45.149 45.100 -0.111 0.000 0.766 40 G HN 0.447 8.737 8.290 -0.000 0.000 0.552 41 W N -1.357 120.063 121.300 0.200 0.000 2.519 41 W HA 0.261 4.923 4.660 0.003 0.000 0.266 41 W C 1.864 178.644 176.519 0.435 0.000 1.253 41 W CA -0.295 57.216 57.345 0.276 0.000 1.274 41 W CB -0.093 29.507 29.460 0.234 0.000 1.114 41 W HN 0.173 8.353 8.180 -0.000 0.000 0.596 42 F N -1.063 119.127 119.950 0.401 0.000 2.619 42 F HA 0.449 4.978 4.527 0.003 0.000 0.281 42 F C 1.371 177.237 175.800 0.111 0.000 1.065 42 F CA 1.088 59.249 58.000 0.268 0.000 1.304 42 F CB -0.171 38.998 39.000 0.282 0.000 1.059 42 F HN -0.241 8.059 8.300 -0.000 0.000 0.648 43 G N -0.488 108.414 108.800 0.170 0.000 3.085 43 G HA2 0.197 4.159 3.960 0.003 0.000 0.264 43 G HA3 0.197 4.159 3.960 0.003 0.000 0.264 43 G C -1.295 173.633 174.900 0.045 0.000 1.206 43 G CA -0.794 44.330 45.100 0.040 0.000 0.809 43 G HN -0.094 8.196 8.290 -0.000 0.000 0.592 44 N N 0.468 119.184 118.700 0.027 0.000 2.518 44 N HA 0.364 5.106 4.740 0.003 0.000 0.266 44 N C 1.148 176.673 175.510 0.024 0.000 1.196 44 N CA 0.459 53.520 53.050 0.018 0.000 0.947 44 N CB 1.702 40.189 38.487 0.001 0.000 1.098 44 N HN 0.554 8.934 8.380 -0.000 0.000 0.450 45 A N 2.206 125.050 122.820 0.039 0.000 2.021 45 A HA -0.082 4.240 4.320 0.003 0.000 0.216 45 A C 0.979 178.552 177.584 -0.020 0.000 1.163 45 A CA 0.604 52.681 52.037 0.066 0.000 0.676 45 A CB -0.186 18.913 19.000 0.166 0.000 0.818 45 A HN 0.758 8.908 8.150 -0.000 0.000 0.453 46 Q N 0.176 119.899 119.800 -0.127 0.000 2.304 46 Q HA 0.443 4.785 4.340 0.003 0.000 0.260 46 Q C -1.504 174.287 176.000 -0.348 0.000 0.965 46 Q CA -0.320 55.165 55.803 -0.529 0.000 0.898 46 Q CB 0.461 28.935 28.738 -0.439 0.000 1.196 46 Q HN 0.321 8.591 8.270 -0.000 0.000 0.402 47 L N 3.764 124.745 121.223 -0.403 0.000 2.322 47 L HA 0.658 5.000 4.340 0.003 0.000 0.279 47 L C 0.428 177.170 176.870 -0.214 0.000 1.036 47 L CA 0.927 55.633 54.840 -0.223 0.000 0.807 47 L CB 1.689 43.657 42.059 -0.152 0.000 1.226 47 L HN 0.947 9.177 8.230 -0.000 0.000 0.433 48 G N 3.299 112.021 108.800 -0.130 0.000 2.855 48 G HA2 -0.135 3.826 3.960 0.003 0.000 0.352 48 G HA3 -0.135 3.826 3.960 0.003 0.000 0.352 48 G C -2.896 171.945 174.900 -0.099 0.000 1.415 48 G CA -0.863 44.180 45.100 -0.095 0.000 0.871 48 G HN 0.492 8.782 8.290 -0.000 0.000 0.543 49 P HA 0.586 5.006 4.420 -0.000 0.000 0.274 49 P C -0.028 177.261 177.300 -0.018 0.000 1.256 49 P CA -0.507 62.570 63.100 -0.039 0.000 0.795 49 P CB 0.894 32.580 31.700 -0.024 0.000 1.038 50 I N 0.083 120.649 120.570 -0.008 0.000 2.693 50 I HA 0.385 4.557 4.170 0.003 0.000 0.303 50 I C -1.014 175.124 176.117 0.035 0.000 1.025 50 I CA -1.383 59.929 61.300 0.020 0.000 1.086 50 I CB 1.562 39.574 38.000 0.019 0.000 1.268 50 I HN 0.209 8.419 8.210 -0.000 0.000 0.440 51 Y N 7.072 127.332 120.300 -0.065 0.000 2.326 51 Y HA 0.601 5.153 4.550 0.003 0.000 0.337 51 Y C -1.332 174.524 175.900 -0.073 0.000 1.023 51 Y CA -0.383 57.672 58.100 -0.075 0.000 1.143 51 Y CB 0.881 39.280 38.460 -0.102 0.000 1.183 51 Y HN 0.373 8.653 8.280 -0.000 0.000 0.485 52 L N 7.169 128.136 121.223 -0.427 0.000 2.518 52 L HA 0.476 4.818 4.340 0.003 0.000 0.262 52 L C 0.255 176.925 176.870 -0.333 0.000 0.982 52 L CA -0.521 54.181 54.840 -0.231 0.000 0.873 52 L CB 1.340 43.342 42.059 -0.094 0.000 1.198 52 L HN 0.878 9.108 8.230 -0.000 0.000 0.427 53 G N 0.535 109.205 108.800 -0.217 0.000 2.606 53 G HA2 0.301 4.262 3.960 0.003 0.000 0.262 53 G HA3 0.301 4.262 3.960 0.003 0.000 0.262 53 G C 0.727 175.609 174.900 -0.030 0.000 1.394 53 G CA -0.124 44.906 45.100 -0.118 0.000 1.044 53 G HN 0.461 8.751 8.290 -0.000 0.000 0.553 54 S N -0.764 114.935 115.700 -0.003 0.000 2.383 54 S HA -0.125 4.347 4.470 0.003 0.000 0.227 54 S C 2.297 176.915 174.600 0.030 0.000 1.026 54 S CA 0.885 59.089 58.200 0.007 0.000 0.981 54 S CB -0.322 62.884 63.200 0.010 0.000 0.818 54 S HN 0.327 8.637 8.310 -0.000 0.000 0.472 55 L N 1.997 123.242 121.223 0.038 0.000 2.056 55 L HA 0.058 4.400 4.340 0.003 0.000 0.207 55 L C 2.271 179.172 176.870 0.052 0.000 1.078 55 L CA 1.793 56.660 54.840 0.045 0.000 0.749 55 L CB -1.268 40.803 42.059 0.021 0.000 0.901 55 L HN 0.321 8.551 8.230 -0.000 0.000 0.433 56 G N -1.458 107.360 108.800 0.031 0.000 2.408 56 G HA2 -0.167 3.795 3.960 0.003 0.000 0.217 56 G HA3 -0.167 3.795 3.960 0.003 0.000 0.217 56 G C 1.530 176.493 174.900 0.105 0.000 1.150 56 G CA 0.949 46.075 45.100 0.042 0.000 0.776 56 G HN 0.309 8.599 8.290 -0.000 0.000 0.542 57 V N 0.831 120.788 119.914 0.072 0.000 2.295 57 V HA -0.140 3.982 4.120 0.003 0.000 0.246 57 V C 2.674 178.854 176.094 0.144 0.000 1.049 57 V CA 1.627 63.979 62.300 0.087 0.000 1.024 57 V CB -0.509 31.333 31.823 0.031 0.000 0.648 57 V HN 0.364 8.554 8.190 -0.000 0.000 0.447 58 L N 0.158 121.460 121.223 0.131 0.000 2.012 58 L HA -0.166 4.176 4.340 0.003 0.000 0.210 58 L C 2.599 179.612 176.870 0.238 0.000 1.073 58 L CA 2.518 57.471 54.840 0.190 0.000 0.748 58 L CB -0.863 41.284 42.059 0.147 0.000 0.891 58 L HN 0.317 8.547 8.230 -0.000 0.000 0.431 59 S N -1.050 114.774 115.700 0.206 0.000 2.356 59 S HA -0.138 4.334 4.470 0.003 0.000 0.223 59 S C 2.006 176.718 174.600 0.187 0.000 1.032 59 S CA 1.579 59.916 58.200 0.228 0.000 1.005 59 S CB -0.385 63.028 63.200 0.354 0.000 0.867 59 S HN 0.498 8.808 8.310 -0.000 0.000 0.449 60 L N -0.042 121.300 121.223 0.199 0.000 2.056 60 L HA -0.029 4.312 4.340 0.003 0.000 0.207 60 L C 2.306 179.230 176.870 0.091 0.000 1.078 60 L CA 1.474 56.383 54.840 0.114 0.000 0.749 60 L CB -0.639 41.496 42.059 0.126 0.000 0.901 60 L HN 0.367 8.597 8.230 -0.000 0.000 0.433 61 F N 0.253 120.218 119.950 0.025 0.000 2.095 61 F HA -0.278 4.251 4.527 0.003 0.000 0.298 61 F C 2.776 178.554 175.800 -0.037 0.000 1.104 61 F CA 1.884 59.889 58.000 0.008 0.000 1.232 61 F CB -0.360 38.664 39.000 0.039 0.000 0.987 61 F HN -0.062 8.238 8.300 -0.000 0.000 0.475 62 S N -0.187 115.499 115.700 -0.023 0.000 2.368 62 S HA -0.048 4.423 4.470 0.003 0.000 0.224 62 S C 2.342 176.860 174.600 -0.137 0.000 1.029 62 S CA 1.185 59.335 58.200 -0.085 0.000 0.988 62 S CB -1.154 62.142 63.200 0.161 0.000 0.838 62 S HN 0.579 8.889 8.310 -0.000 0.000 0.462 63 G N 1.557 110.300 108.800 -0.094 0.000 2.440 63 G HA2 -0.146 3.816 3.960 0.003 0.000 0.218 63 G HA3 -0.146 3.816 3.960 0.003 0.000 0.218 63 G C 1.377 176.201 174.900 -0.126 0.000 1.154 63 G CA 0.884 45.929 45.100 -0.091 0.000 0.767 63 G HN 0.507 8.797 8.290 -0.000 0.000 0.552 64 L N -0.159 120.885 121.223 -0.298 0.000 2.093 64 L HA -0.037 4.305 4.340 0.003 0.000 0.208 64 L C 2.970 179.454 176.870 -0.644 0.000 1.085 64 L CA 0.621 55.132 54.840 -0.549 0.000 0.755 64 L CB -0.292 41.507 42.059 -0.433 0.000 0.904 64 L HN 0.133 8.363 8.230 -0.000 0.000 0.435 65 M N -1.472 117.756 119.600 -0.620 0.000 2.296 65 M HA -0.191 4.290 4.480 0.003 0.000 0.265 65 M C 1.991 178.023 176.300 -0.447 0.000 1.064 65 M CA 1.302 56.159 55.300 -0.738 0.000 1.109 65 M CB -1.209 30.396 32.600 -1.659 0.000 1.396 65 M HN 0.434 8.724 8.290 -0.000 0.000 0.430 66 W N 0.602 121.661 121.300 -0.402 0.000 2.354 66 W HA -0.259 4.403 4.660 0.003 0.000 0.315 66 W C 2.213 178.610 176.519 -0.202 0.000 1.206 66 W CA 1.445 58.677 57.345 -0.188 0.000 1.290 66 W CB -0.957 28.400 29.460 -0.173 0.000 1.152 66 W HN 0.178 8.358 8.180 -0.000 0.000 0.489 67 F N 0.082 119.692 119.950 -0.567 0.000 2.134 67 F HA -0.164 4.365 4.527 0.003 0.000 0.299 67 F C 2.006 177.511 175.800 -0.492 0.000 1.097 67 F CA 1.952 59.477 58.000 -0.790 0.000 1.264 67 F CB -0.903 37.722 39.000 -0.625 0.000 1.001 67 F HN -0.167 8.133 8.300 -0.000 0.000 0.479 68 F N 0.073 119.912 119.950 -0.186 0.000 2.259 68 F HA -0.072 4.456 4.527 0.003 0.000 0.298 68 F C 2.547 178.231 175.800 -0.193 0.000 1.088 68 F CA 1.352 59.232 58.000 -0.200 0.000 1.358 68 F CB -1.733 37.205 39.000 -0.103 0.000 1.040 68 F HN -0.138 8.162 8.300 -0.000 0.000 0.505 69 T N 0.823 115.364 114.554 -0.022 0.000 2.746 69 T HA -0.160 4.192 4.350 0.003 0.000 0.267 69 T C 2.252 176.908 174.700 -0.074 0.000 1.039 69 T CA 1.481 63.584 62.100 0.006 0.000 1.142 69 T CB -0.452 68.452 68.868 0.060 0.000 0.866 69 T HN 0.170 8.410 8.240 -0.000 0.000 0.444 70 I N 1.064 121.428 120.570 -0.343 0.000 2.252 70 I HA -0.071 4.101 4.170 0.003 0.000 0.245 70 I C 2.907 178.716 176.117 -0.514 0.000 1.102 70 I CA 1.236 62.260 61.300 -0.460 0.000 1.385 70 I CB -0.696 36.793 38.000 -0.852 0.000 1.064 70 I HN 0.306 8.516 8.210 -0.000 0.000 0.414 71 G N 1.438 109.932 108.800 -0.509 0.000 2.418 71 G HA2 -0.186 3.776 3.960 0.003 0.000 0.217 71 G HA3 -0.186 3.776 3.960 0.003 0.000 0.217 71 G C 1.548 176.553 174.900 0.175 0.000 1.158 71 G CA 0.460 45.398 45.100 -0.270 0.000 0.771 71 G HN 0.174 8.464 8.290 -0.000 0.000 0.545 72 I N 0.009 120.701 120.570 0.204 0.000 2.315 72 I HA -0.093 4.078 4.170 0.003 0.000 0.248 72 I C 2.333 178.619 176.117 0.282 0.000 1.117 72 I CA 0.127 61.613 61.300 0.311 0.000 1.404 72 I CB -1.317 36.844 38.000 0.268 0.000 1.071 72 I HN 0.458 8.668 8.210 -0.000 0.000 0.419 73 W N 1.528 122.889 121.300 0.101 0.000 2.335 73 W HA -0.298 4.363 4.660 0.003 0.000 0.311 73 W C 2.371 178.996 176.519 0.177 0.000 1.213 73 W CA 1.262 58.702 57.345 0.159 0.000 1.274 73 W CB -0.407 29.166 29.460 0.188 0.000 1.148 73 W HN 0.020 8.200 8.180 -0.000 0.000 0.498 74 F N -0.206 119.633 119.950 -0.186 0.000 2.065 74 F HA -0.207 4.321 4.527 0.003 0.000 0.298 74 F C 2.146 177.416 175.800 -0.883 0.000 1.112 74 F CA 1.492 59.090 58.000 -0.671 0.000 1.212 74 F CB -1.795 36.949 39.000 -0.426 0.000 0.975 74 F HN -0.059 8.241 8.300 -0.000 0.000 0.476 75 W N -1.216 119.937 121.300 -0.244 0.000 2.335 75 W HA -0.280 4.382 4.660 0.003 0.000 0.311 75 W C 2.643 178.482 176.519 -1.134 0.000 1.213 75 W CA 1.869 58.917 57.345 -0.495 0.000 1.274 75 W CB -1.287 27.976 29.460 -0.329 0.000 1.148 75 W HN 0.068 8.248 8.180 -0.000 0.000 0.498 76 Y N 1.329 120.907 120.300 -1.204 0.000 2.081 76 Y HA -0.361 4.191 4.550 0.003 0.000 0.280 76 Y C 2.345 177.661 175.900 -0.974 0.000 1.163 76 Y CA 2.369 59.670 58.100 -1.331 0.000 1.135 76 Y CB -0.940 37.038 38.460 -0.802 0.000 0.970 76 Y HN 0.062 8.342 8.280 -0.000 0.000 0.498 77 Q N -0.622 118.532 119.800 -1.078 0.000 2.291 77 Q HA -0.111 4.230 4.340 0.003 0.000 0.206 77 Q C 2.074 177.695 176.000 -0.633 0.000 0.976 77 Q CA 0.973 56.234 55.803 -0.904 0.000 0.875 77 Q CB -0.275 28.011 28.738 -0.754 0.000 0.927 77 Q HN 0.600 8.870 8.270 -0.000 0.000 0.450 78 A N 0.208 122.598 122.820 -0.716 0.000 2.238 78 A HA 0.252 4.574 4.320 0.003 0.000 0.208 78 A C 1.410 178.860 177.584 -0.223 0.000 1.177 78 A CA 0.598 52.433 52.037 -0.336 0.000 0.804 78 A CB -0.436 18.380 19.000 -0.307 0.000 0.823 78 A HN 0.415 8.565 8.150 -0.000 0.000 0.482 79 G N -1.914 106.646 108.800 -0.401 0.000 2.321 79 G HA2 -0.315 3.647 3.960 0.003 0.000 0.287 79 G HA3 -0.315 3.647 3.960 0.003 0.000 0.287 79 G C 0.322 175.245 174.900 0.039 0.000 1.018 79 G CA 0.340 45.300 45.100 -0.234 0.000 0.855 79 G HN 1.122 9.412 8.290 -0.000 0.000 0.507 80 W N -2.526 118.846 121.300 0.120 0.000 3.834 80 W HA -0.201 4.460 4.660 0.003 0.000 0.320 80 W C 0.675 177.370 176.519 0.292 0.000 1.201 80 W CA 0.343 57.842 57.345 0.257 0.000 0.701 80 W CB -1.866 27.657 29.460 0.106 0.000 2.264 80 W HN 0.603 8.783 8.180 -0.000 0.000 1.413 81 N N 0.888 119.808 118.700 0.366 0.000 2.457 81 N HA 0.219 4.961 4.740 0.003 0.000 0.250 81 N C -1.133 174.569 175.510 0.319 0.000 0.982 81 N CA -1.947 51.278 53.050 0.292 0.000 0.941 81 N CB 1.557 40.141 38.487 0.161 0.000 1.120 81 N HN -0.259 8.121 8.380 -0.000 0.000 0.505 82 P HA -0.093 4.327 4.420 -0.000 0.000 0.216 82 P C 0.826 178.258 177.300 0.220 0.000 1.150 82 P CA 1.166 64.485 63.100 0.365 0.000 0.837 82 P CB 0.289 32.194 31.700 0.341 0.000 0.786 83 A N -0.550 122.367 122.820 0.162 0.000 1.873 83 A HA -0.138 4.184 4.320 0.003 0.000 0.215 83 A C 2.362 179.994 177.584 0.079 0.000 1.186 83 A CA 1.806 53.905 52.037 0.103 0.000 0.616 83 A CB -1.649 17.396 19.000 0.075 0.000 0.823 83 A HN 0.031 8.181 8.150 -0.000 0.000 0.442 84 V N -1.087 118.879 119.914 0.087 0.000 2.343 84 V HA -0.257 3.865 4.120 0.003 0.000 0.247 84 V C 2.277 178.443 176.094 0.119 0.000 1.051 84 V CA 2.129 64.471 62.300 0.070 0.000 1.036 84 V CB -1.032 30.833 31.823 0.070 0.000 0.654 84 V HN 0.614 8.804 8.190 -0.000 0.000 0.451 85 F N 0.146 120.053 119.950 -0.071 0.000 2.087 85 F HA -0.261 4.268 4.527 0.003 0.000 0.299 85 F C 2.049 177.812 175.800 -0.062 0.000 1.100 85 F CA 1.833 59.724 58.000 -0.181 0.000 1.226 85 F CB -0.180 38.321 39.000 -0.831 0.000 0.983 85 F HN 0.061 8.361 8.300 -0.000 0.000 0.479 86 L N 0.388 121.635 121.223 0.041 0.000 2.109 86 L HA -0.095 4.247 4.340 0.003 0.000 0.207 86 L C 2.517 179.285 176.870 -0.170 0.000 1.086 86 L CA 1.495 56.293 54.840 -0.070 0.000 0.760 86 L CB -1.417 40.664 42.059 0.035 0.000 0.910 86 L HN 0.175 8.405 8.230 -0.000 0.000 0.437 87 R N -0.211 120.220 120.500 -0.115 0.000 2.066 87 R HA -0.127 4.215 4.340 0.003 0.000 0.232 87 R C 0.512 176.697 176.300 -0.192 0.000 1.131 87 R CA 1.641 57.663 56.100 -0.129 0.000 0.955 87 R CB 0.093 30.341 30.300 -0.086 0.000 0.851 87 R HN 0.253 8.523 8.270 -0.000 0.000 0.432 88 D N 0.418 120.634 120.400 -0.307 0.000 2.427 88 D HA 0.001 4.642 4.640 0.003 0.000 0.224 88 D C 1.140 176.873 176.300 -0.945 0.000 1.157 88 D CA -0.098 53.615 54.000 -0.478 0.000 0.828 88 D CB 0.596 40.952 40.800 -0.740 0.000 0.974 88 D HN 0.129 8.499 8.370 -0.000 0.000 0.498 89 L N 0.063 120.884 121.223 -0.671 0.000 2.042 89 L HA -0.148 4.194 4.340 0.003 0.000 0.210 89 L C 1.401 178.023 176.870 -0.412 0.000 1.076 89 L CA 1.730 56.237 54.840 -0.555 0.000 0.749 89 L CB -0.381 41.392 42.059 -0.476 0.000 0.893 89 L HN -0.037 8.193 8.230 -0.000 0.000 0.432 90 F N -1.597 117.898 119.950 -0.758 0.000 2.748 90 F HA 0.048 4.577 4.527 0.003 0.000 0.299 90 F C 1.756 176.875 175.800 -1.135 0.000 1.154 90 F CA 0.122 57.494 58.000 -1.046 0.000 1.446 90 F CB -1.014 36.971 39.000 -1.690 0.000 1.112 90 F HN 0.076 8.376 8.300 -0.000 0.000 0.584 91 F N -1.862 117.733 119.950 -0.590 0.000 2.714 91 F HA 0.131 4.660 4.527 0.003 0.000 0.294 91 F C 0.846 176.403 175.800 -0.404 0.000 1.120 91 F CA -0.376 57.397 58.000 -0.378 0.000 1.398 91 F CB -0.538 38.222 39.000 -0.400 0.000 1.120 91 F HN -0.347 7.953 8.300 -0.000 0.000 0.589 92 F N 0.436 120.167 119.950 -0.364 0.000 2.496 92 F HA 0.367 4.895 4.527 0.003 0.000 0.344 92 F C 0.731 176.263 175.800 -0.446 0.000 1.155 92 F CA -0.591 57.011 58.000 -0.664 0.000 1.302 92 F CB 0.381 38.364 39.000 -1.695 0.000 1.159 92 F HN -0.344 7.956 8.300 -0.000 0.000 0.595 93 S N 1.927 117.761 115.700 0.223 0.000 2.562 93 S HA 0.507 4.978 4.470 0.003 0.000 0.274 93 S C -1.908 173.130 174.600 0.731 0.000 1.160 93 S CA -0.691 57.809 58.200 0.501 0.000 0.933 93 S CB 0.828 64.238 63.200 0.349 0.000 1.100 93 S HN 0.532 8.842 8.310 -0.000 0.000 0.468 94 L N 4.760 126.401 121.223 0.696 0.000 2.255 94 L HA 0.636 4.977 4.340 0.003 0.000 0.289 94 L C -0.389 176.694 176.870 0.354 0.000 1.046 94 L CA 0.293 55.349 54.840 0.360 0.000 0.816 94 L CB 0.801 43.053 42.059 0.320 0.000 1.197 94 L HN 0.624 8.854 8.230 -0.000 0.000 0.427 95 E N 6.570 126.861 120.200 0.152 0.000 2.212 95 E HA 0.514 4.866 4.350 0.003 0.000 0.270 95 E C -2.508 173.929 176.600 -0.272 0.000 0.956 95 E CA -1.906 54.492 56.400 -0.004 0.000 0.825 95 E CB 1.325 31.051 29.700 0.044 0.000 1.167 95 E HN 0.418 8.778 8.360 -0.000 0.000 0.400 96 P HA 0.216 4.636 4.420 -0.000 0.000 0.274 96 P C -2.533 174.538 177.300 -0.382 0.000 1.256 96 P CA -1.464 61.016 63.100 -1.034 0.000 0.795 96 P CB -0.683 30.095 31.700 -1.537 0.000 1.038 97 P HA -0.001 4.419 4.420 -0.000 0.000 0.267 97 P C -0.134 177.193 177.300 0.044 0.000 1.201 97 P CA 0.528 63.592 63.100 -0.061 0.000 0.775 97 P CB -0.019 31.682 31.700 0.002 0.000 0.854 98 A N 4.990 127.926 122.820 0.194 0.000 2.406 98 A HA 0.269 4.591 4.320 0.003 0.000 0.243 98 A C -1.285 176.374 177.584 0.125 0.000 1.082 98 A CA -0.794 51.332 52.037 0.148 0.000 0.786 98 A CB -1.002 18.098 19.000 0.167 0.000 1.029 98 A HN 0.416 8.566 8.150 -0.000 0.000 0.495 99 P HA -0.173 4.247 4.420 -0.000 0.000 0.219 99 P C 1.094 178.375 177.300 -0.031 0.000 1.146 99 P CA 1.504 64.603 63.100 -0.002 0.000 0.808 99 P CB 0.044 31.730 31.700 -0.024 0.000 0.779 100 E N -1.146 119.007 120.200 -0.079 0.000 2.333 100 E HA -0.196 4.156 4.350 0.003 0.000 0.198 100 E C 1.054 177.504 176.600 -0.250 0.000 1.007 100 E CA 1.196 57.484 56.400 -0.186 0.000 0.845 100 E CB -1.106 28.436 29.700 -0.262 0.000 0.766 100 E HN 0.353 8.713 8.360 -0.000 0.000 0.507 101 Y N 1.380 121.673 120.300 -0.012 0.000 2.546 101 Y HA 0.177 4.728 4.550 0.003 0.000 0.287 101 Y C 1.933 177.818 175.900 -0.025 0.000 1.158 101 Y CA 0.479 58.579 58.100 0.001 0.000 1.307 101 Y CB -0.068 38.409 38.460 0.028 0.000 1.036 101 Y HN 0.237 8.517 8.280 -0.000 0.000 0.532 102 G N 0.790 109.612 108.800 0.036 0.000 2.614 102 G HA2 -0.356 3.606 3.960 0.003 0.000 0.303 102 G HA3 -0.356 3.606 3.960 0.003 0.000 0.303 102 G C 0.626 175.414 174.900 -0.187 0.000 1.270 102 G CA 0.604 45.657 45.100 -0.078 0.000 0.988 102 G HN 0.275 8.565 8.290 -0.000 0.000 0.551 103 L N 1.923 122.961 121.223 -0.308 0.000 2.653 103 L HA 0.329 4.671 4.340 0.003 0.000 0.231 103 L C 1.863 178.663 176.870 -0.116 0.000 1.153 103 L CA 0.533 55.012 54.840 -0.601 0.000 0.933 103 L CB -0.090 41.554 42.059 -0.692 0.000 1.175 103 L HN 0.691 8.921 8.230 -0.000 0.000 0.473 104 S N -0.664 115.051 115.700 0.025 0.000 2.589 104 S HA 0.157 4.629 4.470 0.003 0.000 0.265 104 S C 0.177 174.765 174.600 -0.019 0.000 1.342 104 S CA -0.165 58.106 58.200 0.118 0.000 1.005 104 S CB 0.374 63.685 63.200 0.185 0.000 0.909 104 S HN 0.179 8.489 8.310 -0.000 0.000 0.555 105 F N 0.202 120.261 119.950 0.181 0.000 2.819 105 F HA 0.482 5.011 4.527 0.003 0.000 0.294 105 F C 1.559 177.368 175.800 0.016 0.000 1.166 105 F CA -0.265 57.783 58.000 0.079 0.000 1.374 105 F CB -0.189 38.831 39.000 0.033 0.000 0.956 105 F HN 0.756 9.056 8.300 -0.000 0.000 0.509 106 A N 0.053 122.952 122.820 0.133 0.000 2.348 106 A HA 0.619 4.941 4.320 0.003 0.000 0.224 106 A C 1.293 178.822 177.584 -0.091 0.000 1.227 106 A CA 0.075 52.169 52.037 0.095 0.000 0.885 106 A CB -0.366 18.752 19.000 0.197 0.000 0.933 106 A HN 0.191 8.341 8.150 -0.000 0.000 0.506 107 A N 1.380 123.946 122.820 -0.422 0.000 2.462 107 A HA 0.542 4.864 4.320 0.003 0.000 0.243 107 A C -2.336 175.050 177.584 -0.331 0.000 1.076 107 A CA -1.026 50.472 52.037 -0.899 0.000 0.773 107 A CB -0.343 18.020 19.000 -1.062 0.000 1.010 107 A HN 0.239 8.389 8.150 -0.000 0.000 0.493 108 P HA 0.073 4.493 4.420 -0.000 0.000 0.269 108 P C 1.033 178.288 177.300 -0.074 0.000 1.217 108 P CA -0.329 62.730 63.100 -0.068 0.000 0.783 108 P CB 0.409 32.113 31.700 0.006 0.000 0.898 109 L N 1.033 122.235 121.223 -0.034 0.000 2.081 109 L HA -0.219 4.123 4.340 0.003 0.000 0.212 109 L C 1.897 178.713 176.870 -0.090 0.000 1.080 109 L CA 1.842 56.657 54.840 -0.043 0.000 0.754 109 L CB -0.487 41.570 42.059 -0.003 0.000 0.893 109 L HN 0.459 8.689 8.230 -0.000 0.000 0.433 110 K N -0.259 120.128 120.400 -0.021 0.000 2.426 110 K HA -0.002 4.319 4.320 0.003 0.000 0.193 110 K C 0.375 176.969 176.600 -0.012 0.000 1.028 110 K CA 0.464 56.764 56.287 0.022 0.000 1.047 110 K CB 0.249 32.897 32.500 0.247 0.000 0.821 110 K HN 0.378 8.628 8.250 -0.000 0.000 0.513 111 E N -0.343 119.832 120.200 -0.042 0.000 2.989 111 E HA 0.155 4.507 4.350 0.003 0.000 0.207 111 E C 0.391 176.922 176.600 -0.115 0.000 0.989 111 E CA -0.225 56.159 56.400 -0.027 0.000 1.186 111 E CB 1.269 30.994 29.700 0.041 0.000 1.141 111 E HN 0.355 8.715 8.360 -0.000 0.000 0.454 112 G N -0.010 108.705 108.800 -0.141 0.000 3.006 112 G HA2 -0.229 3.733 3.960 0.003 0.000 0.195 112 G HA3 -0.229 3.733 3.960 0.003 0.000 0.195 112 G C 1.168 176.045 174.900 -0.038 0.000 1.034 112 G CA -0.177 44.859 45.100 -0.107 0.000 0.807 112 G HN 0.395 8.685 8.290 -0.000 0.000 0.469 113 G N 1.032 109.776 108.800 -0.094 0.000 2.476 113 G HA2 -0.056 3.906 3.960 0.003 0.000 0.218 113 G HA3 -0.056 3.906 3.960 0.003 0.000 0.218 113 G C 1.711 176.604 174.900 -0.012 0.000 1.164 113 G CA 1.629 46.700 45.100 -0.048 0.000 0.768 113 G HN 0.512 8.802 8.290 -0.000 0.000 0.560 114 L N -0.686 120.504 121.223 -0.055 0.000 2.141 114 L HA 0.085 4.426 4.340 0.003 0.000 0.209 114 L C 2.290 179.174 176.870 0.024 0.000 1.094 114 L CA 0.855 55.669 54.840 -0.043 0.000 0.763 114 L CB -1.162 40.804 42.059 -0.155 0.000 0.908 114 L HN 0.570 8.800 8.230 -0.000 0.000 0.437 115 W N -0.008 121.217 121.300 -0.124 0.000 2.358 115 W HA -0.230 4.432 4.660 0.003 0.000 0.303 115 W C 2.298 178.844 176.519 0.044 0.000 1.208 115 W CA 1.506 58.857 57.345 0.011 0.000 1.274 115 W CB -0.142 29.293 29.460 -0.041 0.000 1.138 115 W HN 0.065 8.245 8.180 -0.000 0.000 0.515 116 L N 0.176 121.501 121.223 0.170 0.000 2.046 116 L HA -0.242 4.100 4.340 0.003 0.000 0.208 116 L C 2.447 179.250 176.870 -0.112 0.000 1.077 116 L CA 1.468 56.271 54.840 -0.061 0.000 0.747 116 L CB -0.823 41.231 42.059 -0.009 0.000 0.896 116 L HN 0.037 8.267 8.230 -0.000 0.000 0.432 117 I N -0.280 120.256 120.570 -0.057 0.000 2.142 117 I HA -0.313 3.859 4.170 0.003 0.000 0.240 117 I C 2.828 178.936 176.117 -0.014 0.000 1.078 117 I CA 1.249 62.498 61.300 -0.085 0.000 1.343 117 I CB -0.544 37.448 38.000 -0.013 0.000 1.046 117 I HN 0.214 8.424 8.210 -0.000 0.000 0.405 118 A N 0.230 123.082 122.820 0.053 0.000 1.892 118 A HA -0.238 4.084 4.320 0.003 0.000 0.218 118 A C 2.489 180.142 177.584 0.115 0.000 1.188 118 A CA 2.476 54.596 52.037 0.138 0.000 0.631 118 A CB -0.870 18.065 19.000 -0.109 0.000 0.822 118 A HN 0.413 8.563 8.150 -0.000 0.000 0.447 119 S N -1.256 114.345 115.700 -0.165 0.000 2.368 119 S HA -0.121 4.350 4.470 0.003 0.000 0.225 119 S C 1.637 176.216 174.600 -0.036 0.000 1.030 119 S CA 1.355 59.428 58.200 -0.211 0.000 0.999 119 S CB -0.533 62.228 63.200 -0.732 0.000 0.844 119 S HN 0.623 8.933 8.310 -0.000 0.000 0.459 120 F N 1.964 121.797 119.950 -0.194 0.000 2.091 120 F HA -0.171 4.358 4.527 0.003 0.000 0.299 120 F C 1.668 177.451 175.800 -0.028 0.000 1.103 120 F CA 1.384 59.285 58.000 -0.165 0.000 1.228 120 F CB -0.529 38.277 39.000 -0.323 0.000 0.984 120 F HN 0.124 8.424 8.300 -0.000 0.000 0.477 121 F N -0.119 119.856 119.950 0.042 0.000 2.171 121 F HA -0.213 4.316 4.527 0.003 0.000 0.300 121 F C 2.650 178.374 175.800 -0.127 0.000 1.090 121 F CA 1.624 59.589 58.000 -0.059 0.000 1.293 121 F CB -0.989 38.051 39.000 0.067 0.000 1.013 121 F HN 0.065 8.365 8.300 -0.000 0.000 0.486 122 M N -1.376 118.233 119.600 0.015 0.000 2.175 122 M HA -0.209 4.272 4.480 0.003 0.000 0.264 122 M C 2.265 178.558 176.300 -0.012 0.000 1.063 122 M CA 1.574 56.703 55.300 -0.285 0.000 1.119 122 M CB -0.371 31.891 32.600 -0.562 0.000 1.377 122 M HN 0.187 8.477 8.290 -0.000 0.000 0.415 123 F N 0.274 120.219 119.950 -0.007 0.000 2.095 123 F HA -0.237 4.292 4.527 0.003 0.000 0.298 123 F C 1.911 177.777 175.800 0.110 0.000 1.104 123 F CA 1.876 59.970 58.000 0.157 0.000 1.232 123 F CB -0.419 38.558 39.000 -0.039 0.000 0.987 123 F HN -0.114 8.186 8.300 -0.000 0.000 0.475 124 V N 0.257 120.217 119.914 0.077 0.000 2.407 124 V HA -0.302 3.820 4.120 0.003 0.000 0.248 124 V C 2.641 178.766 176.094 0.052 0.000 1.055 124 V CA 1.692 64.010 62.300 0.029 0.000 1.049 124 V CB -1.525 30.229 31.823 -0.116 0.000 0.662 124 V HN 0.486 8.676 8.190 -0.000 0.000 0.455 125 A N -0.299 122.515 122.820 -0.010 0.000 1.873 125 A HA -0.133 4.188 4.320 0.003 0.000 0.215 125 A C 2.379 179.937 177.584 -0.043 0.000 1.186 125 A CA 2.030 54.053 52.037 -0.024 0.000 0.616 125 A CB -0.601 18.314 19.000 -0.143 0.000 0.823 125 A HN 0.329 8.479 8.150 -0.000 0.000 0.442 126 V N -2.473 117.294 119.914 -0.246 0.000 2.379 126 V HA -0.234 3.888 4.120 0.003 0.000 0.245 126 V C 2.221 178.166 176.094 -0.248 0.000 1.044 126 V CA 1.567 63.613 62.300 -0.424 0.000 1.036 126 V CB -0.888 30.222 31.823 -1.187 0.000 0.664 126 V HN 0.784 8.974 8.190 -0.000 0.000 0.453 127 W N 0.745 121.936 121.300 -0.183 0.000 2.418 127 W HA -0.152 4.509 4.660 0.003 0.000 0.292 127 W C 2.951 179.531 176.519 0.102 0.000 1.213 127 W CA 1.388 58.673 57.345 -0.101 0.000 1.283 127 W CB -0.345 28.940 29.460 -0.292 0.000 1.119 127 W HN 0.340 8.520 8.180 -0.000 0.000 0.542 128 S N -0.645 115.233 115.700 0.298 0.000 2.382 128 S HA -0.277 4.195 4.470 0.003 0.000 0.228 128 S C 1.709 176.445 174.600 0.226 0.000 1.027 128 S CA 1.042 59.383 58.200 0.235 0.000 0.991 128 S CB -1.336 61.974 63.200 0.182 0.000 0.823 128 S HN 0.480 8.790 8.310 -0.000 0.000 0.469 129 W N 0.845 122.199 121.300 0.090 0.000 2.363 129 W HA -0.119 4.543 4.660 0.003 0.000 0.296 129 W C 1.987 178.631 176.519 0.208 0.000 1.212 129 W CA 1.119 58.519 57.345 0.090 0.000 1.260 129 W CB -0.538 28.951 29.460 0.049 0.000 1.131 129 W HN 0.502 8.682 8.180 -0.000 0.000 0.530 130 W N 1.533 123.017 121.300 0.307 0.000 2.335 130 W HA -0.162 4.499 4.660 0.003 0.000 0.311 130 W C 2.495 179.069 176.519 0.092 0.000 1.213 130 W CA 3.430 60.892 57.345 0.195 0.000 1.274 130 W CB -0.913 28.481 29.460 -0.111 0.000 1.148 130 W HN -0.105 8.075 8.180 -0.000 0.000 0.498 131 G N 0.177 109.044 108.800 0.112 0.000 2.440 131 G HA2 -0.303 3.659 3.960 0.003 0.000 0.218 131 G HA3 -0.303 3.659 3.960 0.003 0.000 0.218 131 G C 1.622 176.355 174.900 -0.277 0.000 1.154 131 G CA 1.104 46.132 45.100 -0.120 0.000 0.767 131 G HN 0.277 8.567 8.290 -0.000 0.000 0.552 132 R N -0.025 120.297 120.500 -0.296 0.000 2.083 132 R HA -0.116 4.226 4.340 0.003 0.000 0.237 132 R C 3.106 179.112 176.300 -0.489 0.000 1.137 132 R CA 1.964 57.800 56.100 -0.440 0.000 0.951 132 R CB -0.642 29.209 30.300 -0.747 0.000 0.851 132 R HN 0.566 8.836 8.270 -0.000 0.000 0.434 133 T N -2.110 112.135 114.554 -0.516 0.000 2.833 133 T HA -0.212 4.140 4.350 0.003 0.000 0.269 133 T C 1.780 176.189 174.700 -0.485 0.000 1.054 133 T CA 1.162 62.989 62.100 -0.455 0.000 1.135 133 T CB -0.441 68.238 68.868 -0.314 0.000 0.869 133 T HN 0.318 8.558 8.240 -0.000 0.000 0.466 134 Y N 1.612 121.486 120.300 -0.710 0.000 2.184 134 Y HA 0.246 4.797 4.550 0.003 0.000 0.290 134 Y C 2.152 177.772 175.900 -0.466 0.000 1.129 134 Y CA 0.940 58.627 58.100 -0.689 0.000 1.144 134 Y CB -0.290 37.628 38.460 -0.904 0.000 0.995 134 Y HN 0.134 8.414 8.280 -0.000 0.000 0.513 135 L N -0.434 120.675 121.223 -0.189 0.000 2.156 135 L HA -0.160 4.182 4.340 0.003 0.000 0.208 135 L C 2.471 179.158 176.870 -0.306 0.000 1.095 135 L CA 0.692 55.428 54.840 -0.174 0.000 0.770 135 L CB -0.413 41.562 42.059 -0.141 0.000 0.914 135 L HN 0.089 8.319 8.230 -0.000 0.000 0.439 136 R N 0.307 120.581 120.500 -0.376 0.000 2.096 136 R HA -0.080 4.262 4.340 0.003 0.000 0.235 136 R C 2.253 178.343 176.300 -0.350 0.000 1.127 136 R CA 1.438 57.291 56.100 -0.411 0.000 0.968 136 R CB -0.927 29.129 30.300 -0.407 0.000 0.861 136 R HN 0.341 8.611 8.270 -0.000 0.000 0.440 137 A N 0.814 123.414 122.820 -0.367 0.000 1.897 137 A HA -0.169 4.153 4.320 0.003 0.000 0.215 137 A C 2.192 179.580 177.584 -0.327 0.000 1.181 137 A CA 1.282 53.114 52.037 -0.342 0.000 0.620 137 A CB -0.410 18.352 19.000 -0.397 0.000 0.821 137 A HN 0.388 8.538 8.150 -0.000 0.000 0.443 138 Q N -0.335 119.239 119.800 -0.376 0.000 2.084 138 Q HA -0.119 4.223 4.340 0.003 0.000 0.202 138 Q C 2.083 177.963 176.000 -0.200 0.000 0.978 138 Q CA 1.600 57.230 55.803 -0.288 0.000 0.844 138 Q CB -0.350 28.251 28.738 -0.228 0.000 0.898 138 Q HN 0.572 8.842 8.270 -0.000 0.000 0.426 139 A N 0.397 123.088 122.820 -0.216 0.000 2.019 139 A HA -0.079 4.242 4.320 0.003 0.000 0.219 139 A C 1.795 179.284 177.584 -0.157 0.000 1.164 139 A CA 0.900 52.827 52.037 -0.183 0.000 0.644 139 A CB -0.305 18.549 19.000 -0.242 0.000 0.805 139 A HN 0.457 8.607 8.150 -0.000 0.000 0.449 140 L N -1.499 119.620 121.223 -0.173 0.000 2.592 140 L HA 0.238 4.579 4.340 0.003 0.000 0.227 140 L C 1.571 178.370 176.870 -0.118 0.000 1.127 140 L CA 0.498 55.255 54.840 -0.139 0.000 0.884 140 L CB 0.036 42.005 42.059 -0.151 0.000 1.065 140 L HN 0.538 8.768 8.230 -0.000 0.000 0.457 141 G N 0.217 108.942 108.800 -0.125 0.000 2.143 141 G HA2 -0.292 3.669 3.960 0.003 0.000 0.248 141 G HA3 -0.292 3.669 3.960 0.003 0.000 0.248 141 G C 0.212 175.051 174.900 -0.102 0.000 0.991 141 G CA 0.064 45.103 45.100 -0.101 0.000 0.689 141 G HN 0.245 8.535 8.290 -0.000 0.000 0.522 142 M N 0.440 119.960 119.600 -0.134 0.000 2.359 142 M HA 0.544 5.026 4.480 0.003 0.000 0.322 142 M C 1.404 177.631 176.300 -0.122 0.000 1.166 142 M CA 0.088 55.317 55.300 -0.117 0.000 1.067 142 M CB 0.949 33.466 32.600 -0.138 0.000 1.523 142 M HN 0.214 8.504 8.290 -0.000 0.000 0.467 143 G N 0.729 109.511 108.800 -0.030 0.000 2.684 143 G HA2 0.162 4.124 3.960 0.003 0.000 0.255 143 G HA3 0.162 4.124 3.960 0.003 0.000 0.255 143 G C 0.150 174.983 174.900 -0.111 0.000 1.219 143 G CA -0.517 44.586 45.100 0.005 0.000 0.901 143 G HN 0.628 8.918 8.290 -0.000 0.000 0.548 144 K N -0.387 119.845 120.400 -0.280 0.000 2.576 144 K HA 0.145 4.467 4.320 0.003 0.000 0.209 144 K C 1.182 177.491 176.600 -0.484 0.000 1.049 144 K CA -0.199 55.757 56.287 -0.553 0.000 1.140 144 K CB 0.077 32.084 32.500 -0.821 0.000 0.871 144 K HN 0.577 8.827 8.250 -0.000 0.000 0.479 145 H N 0.082 119.043 119.070 -0.182 0.000 2.421 145 H HA -0.063 4.495 4.556 0.003 0.000 0.298 145 H C 1.623 176.899 175.328 -0.086 0.000 1.087 145 H CA 1.880 57.899 56.048 -0.048 0.000 1.330 145 H CB -0.059 29.682 29.762 -0.035 0.000 1.388 145 H HN 0.082 8.362 8.280 -0.000 0.000 0.526 146 T N 0.155 114.684 114.554 -0.042 0.000 2.737 146 T HA -0.107 4.245 4.350 0.003 0.000 0.265 146 T C 2.427 177.113 174.700 -0.024 0.000 1.038 146 T CA 1.167 63.236 62.100 -0.051 0.000 1.144 146 T CB -0.521 68.276 68.868 -0.119 0.000 0.866 146 T HN 0.506 8.746 8.240 -0.000 0.000 0.434 147 A N 0.646 123.333 122.820 -0.221 0.000 1.908 147 A HA -0.125 4.197 4.320 0.003 0.000 0.218 147 A C 2.140 179.837 177.584 0.188 0.000 1.181 147 A CA 1.455 53.356 52.037 -0.226 0.000 0.627 147 A CB -1.203 17.349 19.000 -0.746 0.000 0.818 147 A HN 0.741 8.891 8.150 -0.000 0.000 0.445 148 W N -0.578 120.851 121.300 0.214 0.000 2.379 148 W HA 0.003 4.665 4.660 0.003 0.000 0.307 148 W C 2.808 179.387 176.519 0.100 0.000 1.200 148 W CA 0.559 58.001 57.345 0.161 0.000 1.297 148 W CB -0.165 29.303 29.460 0.013 0.000 1.140 148 W HN 0.391 8.571 8.180 -0.000 0.000 0.507 149 A N 0.339 123.319 122.820 0.266 0.000 1.908 149 A HA -0.264 4.058 4.320 0.003 0.000 0.218 149 A C 1.779 179.521 177.584 0.263 0.000 1.181 149 A CA 1.528 53.658 52.037 0.155 0.000 0.627 149 A CB -1.256 17.786 19.000 0.071 0.000 0.818 149 A HN 0.349 8.499 8.150 -0.000 0.000 0.445 150 F N 0.176 120.207 119.950 0.135 0.000 2.202 150 F HA -0.121 4.408 4.527 0.003 0.000 0.301 150 F C 1.742 177.639 175.800 0.162 0.000 1.082 150 F CA 1.183 59.269 58.000 0.143 0.000 1.313 150 F CB -0.648 38.462 39.000 0.183 0.000 1.024 150 F HN 0.181 8.481 8.300 -0.000 0.000 0.495 151 L N -0.303 121.068 121.223 0.246 0.000 2.191 151 L HA -0.157 4.184 4.340 0.003 0.000 0.212 151 L C 2.714 179.628 176.870 0.074 0.000 1.103 151 L CA 1.917 56.770 54.840 0.022 0.000 0.769 151 L CB -1.234 40.959 42.059 0.224 0.000 0.908 151 L HN 0.259 8.489 8.230 -0.000 0.000 0.438 152 S N -1.207 114.574 115.700 0.134 0.000 2.368 152 S HA -0.132 4.339 4.470 0.003 0.000 0.224 152 S C 2.177 176.901 174.600 0.208 0.000 1.029 152 S CA 1.075 59.367 58.200 0.152 0.000 0.988 152 S CB -0.239 63.017 63.200 0.093 0.000 0.838 152 S HN 0.563 8.873 8.310 -0.000 0.000 0.462 153 A N 1.456 124.380 122.820 0.173 0.000 1.902 153 A HA 0.023 4.345 4.320 0.003 0.000 0.217 153 A C 2.117 179.767 177.584 0.109 0.000 1.181 153 A CA 1.468 53.600 52.037 0.160 0.000 0.623 153 A CB -0.808 18.318 19.000 0.210 0.000 0.818 153 A HN 0.619 8.769 8.150 -0.000 0.000 0.443 154 I N -1.343 119.201 120.570 -0.043 0.000 2.264 154 I HA -0.293 3.878 4.170 0.003 0.000 0.248 154 I C 2.487 178.710 176.117 0.176 0.000 1.111 154 I CA 1.425 62.655 61.300 -0.116 0.000 1.382 154 I CB -0.324 37.282 38.000 -0.656 0.000 1.060 154 I HN 0.770 8.980 8.210 -0.000 0.000 0.418 155 W N 1.686 122.982 121.300 -0.006 0.000 2.333 155 W HA -0.318 4.344 4.660 0.003 0.000 0.316 155 W C 2.352 178.916 176.519 0.076 0.000 1.215 155 W CA 1.333 58.704 57.345 0.043 0.000 1.278 155 W CB -0.331 29.145 29.460 0.026 0.000 1.154 155 W HN 0.146 8.326 8.180 -0.000 0.000 0.486 156 L N 1.067 122.281 121.223 -0.014 0.000 2.017 156 L HA -0.167 4.175 4.340 0.003 0.000 0.208 156 L C 2.352 179.193 176.870 -0.049 0.000 1.073 156 L CA 2.837 57.584 54.840 -0.156 0.000 0.745 156 L CB -1.758 40.303 42.059 0.003 0.000 0.894 156 L HN 0.263 8.493 8.230 -0.000 0.000 0.432 157 W N -0.099 121.128 121.300 -0.122 0.000 2.318 157 W HA -0.291 4.371 4.660 0.003 0.000 0.313 157 W C 2.259 178.739 176.519 -0.065 0.000 1.221 157 W CA 2.254 59.536 57.345 -0.105 0.000 1.266 157 W CB -0.267 29.106 29.460 -0.145 0.000 1.150 157 W HN 0.125 8.305 8.180 -0.000 0.000 0.496 158 M N -0.076 119.376 119.600 -0.246 0.000 2.132 158 M HA -0.165 4.317 4.480 0.003 0.000 0.263 158 M C 1.949 178.144 176.300 -0.174 0.000 1.065 158 M CA 1.385 56.484 55.300 -0.335 0.000 1.122 158 M CB -1.584 31.008 32.600 -0.014 0.000 1.365 158 M HN -0.013 8.277 8.290 -0.000 0.000 0.411 159 V N 0.840 120.581 119.914 -0.288 0.000 2.287 159 V HA -0.281 3.841 4.120 0.003 0.000 0.248 159 V C 2.525 178.533 176.094 -0.143 0.000 1.053 159 V CA 1.572 63.684 62.300 -0.314 0.000 1.027 159 V CB -0.682 30.777 31.823 -0.607 0.000 0.646 159 V HN 0.395 8.585 8.190 -0.000 0.000 0.447 160 L N 0.121 121.257 121.223 -0.146 0.000 2.012 160 L HA -0.111 4.231 4.340 0.003 0.000 0.210 160 L C 2.353 179.203 176.870 -0.034 0.000 1.073 160 L CA 1.990 56.782 54.840 -0.079 0.000 0.748 160 L CB -0.801 41.180 42.059 -0.130 0.000 0.891 160 L HN 0.490 8.720 8.230 -0.000 0.000 0.431 161 G N -2.905 105.851 108.800 -0.072 0.000 2.921 161 G HA2 -0.047 3.914 3.960 0.003 0.000 0.213 161 G HA3 -0.047 3.914 3.960 0.003 0.000 0.213 161 G C 0.927 176.013 174.900 0.310 0.000 1.143 161 G CA -0.004 45.147 45.100 0.085 0.000 0.764 161 G HN 0.268 8.558 8.290 -0.000 0.000 0.542 162 F N -0.307 119.666 119.950 0.037 0.000 2.212 162 F HA 0.385 4.913 4.527 0.003 0.000 0.262 162 F C 2.025 177.890 175.800 0.108 0.000 0.906 162 F CA -0.034 58.066 58.000 0.166 0.000 1.127 162 F CB 0.034 39.089 39.000 0.092 0.000 1.178 162 F HN -0.039 8.261 8.300 -0.000 0.000 0.779 163 I N 0.733 121.384 120.570 0.136 0.000 2.233 163 I HA -0.173 3.999 4.170 0.003 0.000 0.243 163 I C 2.541 178.620 176.117 -0.063 0.000 1.093 163 I CA 1.374 62.677 61.300 0.004 0.000 1.380 163 I CB -0.468 37.570 38.000 0.063 0.000 1.067 163 I HN 0.124 8.334 8.210 -0.000 0.000 0.413 164 R N 1.052 121.536 120.500 -0.025 0.000 2.066 164 R HA -0.107 4.234 4.340 0.003 0.000 0.232 164 R C -0.436 175.854 176.300 -0.017 0.000 1.131 164 R CA 1.538 57.639 56.100 0.001 0.000 0.955 164 R CB -1.076 29.265 30.300 0.067 0.000 0.851 164 R HN 0.189 8.459 8.270 -0.000 0.000 0.432 165 P HA -0.149 4.271 4.420 -0.000 0.000 0.215 165 P C 1.121 178.241 177.300 -0.299 0.000 1.153 165 P CA 1.372 64.427 63.100 -0.075 0.000 0.853 165 P CB -0.033 31.706 31.700 0.065 0.000 0.788 166 I N -1.455 118.878 120.570 -0.394 0.000 2.179 166 I HA -0.227 3.944 4.170 0.003 0.000 0.242 166 I C 2.275 178.221 176.117 -0.285 0.000 1.088 166 I CA 1.357 62.369 61.300 -0.479 0.000 1.357 166 I CB -0.595 37.102 38.000 -0.507 0.000 1.051 166 I HN -0.113 8.097 8.210 -0.000 0.000 0.409 167 L N -0.377 120.736 121.223 -0.183 0.000 2.093 167 L HA -0.200 4.142 4.340 0.003 0.000 0.208 167 L C 2.493 179.299 176.870 -0.107 0.000 1.085 167 L CA 0.968 55.739 54.840 -0.115 0.000 0.755 167 L CB -0.430 41.592 42.059 -0.062 0.000 0.904 167 L HN 0.293 8.523 8.230 -0.000 0.000 0.435 168 M N -0.662 118.876 119.600 -0.104 0.000 2.557 168 M HA 0.055 4.537 4.480 0.003 0.000 0.259 168 M C 1.609 177.832 176.300 -0.128 0.000 1.086 168 M CA 1.183 56.432 55.300 -0.085 0.000 1.096 168 M CB -1.002 31.573 32.600 -0.041 0.000 1.424 168 M HN 0.462 8.752 8.290 -0.000 0.000 0.488 169 G N 1.684 110.365 108.800 -0.198 0.000 2.141 169 G HA2 -0.210 3.752 3.960 0.003 0.000 0.242 169 G HA3 -0.210 3.752 3.960 0.003 0.000 0.242 169 G C 0.140 174.874 174.900 -0.278 0.000 0.982 169 G CA 0.473 45.435 45.100 -0.230 0.000 0.662 169 G HN 0.713 9.003 8.290 -0.000 0.000 0.527 170 S N -2.268 113.242 115.700 -0.315 0.000 2.543 170 S HA 0.527 4.999 4.470 0.003 0.000 0.274 170 S C 0.276 174.706 174.600 -0.283 0.000 1.149 170 S CA -0.127 57.884 58.200 -0.314 0.000 0.866 170 S CB 0.510 63.624 63.200 -0.142 0.000 1.111 170 S HN 0.450 8.760 8.310 -0.000 0.000 0.457 171 W N 1.604 122.826 121.300 -0.130 0.000 2.595 171 W HA 0.022 4.684 4.660 0.003 0.000 0.257 171 W C 2.654 178.989 176.519 -0.306 0.000 1.267 171 W CA 0.551 57.775 57.345 -0.202 0.000 1.300 171 W CB -0.040 29.282 29.460 -0.229 0.000 1.120 171 W HN 0.940 9.120 8.180 -0.000 0.000 0.618 172 S N 0.238 115.932 115.700 -0.011 0.000 2.440 172 S HA -0.208 4.264 4.470 0.003 0.000 0.238 172 S C 1.430 176.042 174.600 0.021 0.000 1.010 172 S CA 1.256 59.426 58.200 -0.049 0.000 0.972 172 S CB -0.303 62.893 63.200 -0.007 0.000 0.774 172 S HN 0.269 8.579 8.310 -0.000 0.000 0.501 173 E N 1.475 121.718 120.200 0.071 0.000 2.427 173 E HA 0.281 4.633 4.350 0.003 0.000 0.196 173 E C 1.056 177.870 176.600 0.357 0.000 1.028 173 E CA 0.531 57.061 56.400 0.217 0.000 0.864 173 E CB -0.163 29.635 29.700 0.164 0.000 0.813 173 E HN 0.748 9.108 8.360 -0.000 0.000 0.514 174 A N 0.877 123.781 122.820 0.140 0.000 2.259 174 A HA 0.350 4.672 4.320 0.003 0.000 0.278 174 A C 0.311 177.757 177.584 -0.230 0.000 1.107 174 A CA -0.494 51.580 52.037 0.062 0.000 0.828 174 A CB 0.684 19.785 19.000 0.169 0.000 1.111 174 A HN -0.039 8.111 8.150 -0.000 0.000 0.498 175 V N 2.426 122.069 119.914 -0.452 0.000 2.498 175 V HA 0.317 4.439 4.120 0.003 0.000 0.279 175 V C -1.895 173.999 176.094 -0.334 0.000 1.048 175 V CA -1.117 60.693 62.300 -0.817 0.000 0.967 175 V CB 0.867 32.199 31.823 -0.818 0.000 0.988 175 V HN 0.838 9.028 8.190 -0.000 0.000 0.473 176 P HA 0.206 4.626 4.420 -0.000 0.000 0.276 176 P C -1.386 175.890 177.300 -0.039 0.000 1.244 176 P CA -0.397 62.669 63.100 -0.055 0.000 0.801 176 P CB 0.518 32.268 31.700 0.084 0.000 1.006 177 Y N 0.682 121.200 120.300 0.363 0.000 2.595 177 Y HA 0.583 5.134 4.550 0.003 0.000 0.347 177 Y C 1.339 177.442 175.900 0.338 0.000 1.025 177 Y CA 0.341 58.600 58.100 0.265 0.000 1.295 177 Y CB 0.192 38.747 38.460 0.159 0.000 1.147 177 Y HN 0.545 8.825 8.280 -0.000 0.000 0.515 178 G N 1.568 110.599 108.800 0.385 0.000 2.579 178 G HA2 0.348 4.309 3.960 0.003 0.000 0.292 178 G HA3 0.348 4.309 3.960 0.003 0.000 0.292 178 G C -0.145 174.914 174.900 0.265 0.000 1.484 178 G CA -0.768 44.567 45.100 0.390 0.000 0.813 178 G HN 0.212 8.502 8.290 -0.000 0.000 0.515 179 I N 0.414 121.062 120.570 0.130 0.000 2.130 179 I HA 0.050 4.222 4.170 0.003 0.000 0.234 179 I C 2.569 178.834 176.117 0.248 0.000 1.067 179 I CA 1.172 62.488 61.300 0.026 0.000 1.339 179 I CB -1.064 36.614 38.000 -0.537 0.000 1.073 179 I HN 0.431 8.641 8.210 -0.000 0.000 0.405 180 F N 2.069 122.003 119.950 -0.028 0.000 2.134 180 F HA -0.168 4.360 4.527 0.003 0.000 0.299 180 F C 3.048 178.892 175.800 0.073 0.000 1.097 180 F CA 1.309 59.289 58.000 -0.033 0.000 1.264 180 F CB -1.724 37.191 39.000 -0.142 0.000 1.001 180 F HN 0.197 8.497 8.300 -0.000 0.000 0.479 181 S N -0.037 115.860 115.700 0.329 0.000 2.400 181 S HA -0.256 4.215 4.470 0.003 0.000 0.232 181 S C 2.047 176.845 174.600 0.330 0.000 1.025 181 S CA 1.532 59.909 58.200 0.295 0.000 0.993 181 S CB -1.250 62.118 63.200 0.280 0.000 0.808 181 S HN 0.665 8.975 8.310 -0.000 0.000 0.478 182 H N 1.929 121.125 119.070 0.210 0.000 2.495 182 H HA 0.186 4.743 4.556 0.003 0.000 0.287 182 H C 1.843 177.328 175.328 0.263 0.000 1.033 182 H CA 1.062 57.235 56.048 0.208 0.000 1.307 182 H CB -0.515 29.321 29.762 0.124 0.000 1.401 182 H HN 0.448 8.728 8.280 -0.000 0.000 0.555 183 L N 0.643 121.779 121.223 -0.146 0.000 2.095 183 L HA -0.098 4.244 4.340 0.003 0.000 0.204 183 L C 2.263 179.155 176.870 0.037 0.000 1.080 183 L CA 1.120 55.879 54.840 -0.136 0.000 0.759 183 L CB -0.315 41.680 42.059 -0.107 0.000 0.914 183 L HN 0.107 8.337 8.230 -0.000 0.000 0.439 184 D N -0.415 120.044 120.400 0.098 0.000 2.123 184 D HA -0.249 4.393 4.640 0.003 0.000 0.196 184 D C 1.714 178.109 176.300 0.158 0.000 0.992 184 D CA 1.185 55.249 54.000 0.106 0.000 0.833 184 D CB -0.318 40.556 40.800 0.123 0.000 0.954 184 D HN 0.386 8.756 8.370 -0.000 0.000 0.455 185 W N 1.729 123.070 121.300 0.069 0.000 2.318 185 W HA -0.251 4.411 4.660 0.003 0.000 0.313 185 W C 2.309 178.898 176.519 0.117 0.000 1.221 185 W CA 2.490 59.896 57.345 0.103 0.000 1.266 185 W CB -0.515 29.019 29.460 0.124 0.000 1.150 185 W HN -0.128 8.052 8.180 -0.000 0.000 0.496 186 T N 0.317 115.080 114.554 0.348 0.000 2.708 186 T HA -0.297 4.055 4.350 0.003 0.000 0.266 186 T C 1.439 176.144 174.700 0.007 0.000 1.037 186 T CA 1.765 63.966 62.100 0.168 0.000 1.146 186 T CB -0.793 68.179 68.868 0.174 0.000 0.865 186 T HN 0.249 8.489 8.240 -0.000 0.000 0.435 187 N N 1.691 120.393 118.700 0.003 0.000 2.043 187 N HA -0.138 4.603 4.740 0.003 0.000 0.193 187 N C 1.679 177.156 175.510 -0.055 0.000 1.037 187 N CA 1.571 54.601 53.050 -0.033 0.000 0.851 187 N CB -0.437 38.033 38.487 -0.028 0.000 1.027 187 N HN 0.182 8.562 8.380 -0.000 0.000 0.422 188 N N -0.322 118.332 118.700 -0.076 0.000 2.166 188 N HA -0.141 4.601 4.740 0.003 0.000 0.186 188 N C 1.457 176.864 175.510 -0.171 0.000 1.019 188 N CA 0.639 53.615 53.050 -0.123 0.000 0.856 188 N CB -0.680 37.726 38.487 -0.135 0.000 0.993 188 N HN 0.324 8.704 8.380 -0.000 0.000 0.426 189 F N 1.362 121.068 119.950 -0.407 0.000 2.126 189 F HA -0.186 4.343 4.527 0.003 0.000 0.299 189 F C 2.653 178.433 175.800 -0.033 0.000 1.096 189 F CA 1.373 59.160 58.000 -0.354 0.000 1.255 189 F CB -0.480 38.073 39.000 -0.744 0.000 0.997 189 F HN -0.023 8.277 8.300 -0.000 0.000 0.479 190 S N 0.053 115.834 115.700 0.134 0.000 2.357 190 S HA -0.124 4.347 4.470 0.003 0.000 0.221 190 S C 2.147 176.751 174.600 0.007 0.000 1.031 190 S CA 1.361 59.607 58.200 0.077 0.000 0.982 190 S CB -0.516 62.646 63.200 -0.064 0.000 0.853 190 S HN 0.416 8.726 8.310 -0.000 0.000 0.458 191 L N 1.007 122.197 121.223 -0.054 0.000 2.012 191 L HA -0.063 4.278 4.340 0.003 0.000 0.210 191 L C 2.497 179.301 176.870 -0.110 0.000 1.073 191 L CA 1.090 55.888 54.840 -0.070 0.000 0.748 191 L CB -0.665 41.346 42.059 -0.081 0.000 0.891 191 L HN 0.212 8.442 8.230 -0.000 0.000 0.431 192 V N -0.911 118.876 119.914 -0.211 0.000 2.594 192 V HA -0.263 3.858 4.120 0.003 0.000 0.253 192 V C 1.304 177.110 176.094 -0.480 0.000 1.069 192 V CA 1.627 63.702 62.300 -0.375 0.000 1.082 192 V CB -0.813 30.693 31.823 -0.528 0.000 0.680 192 V HN 0.508 8.698 8.190 -0.000 0.000 0.469 193 H N -0.687 118.279 119.070 -0.174 0.000 2.487 193 H HA 0.461 5.019 4.556 0.003 0.000 0.290 193 H C 1.475 176.870 175.328 0.111 0.000 1.081 193 H CA 0.532 56.533 56.048 -0.078 0.000 1.116 193 H CB 0.230 29.947 29.762 -0.075 0.000 1.560 193 H HN 0.365 8.645 8.280 -0.000 0.000 0.548 194 G N 1.349 110.238 108.800 0.148 0.000 2.141 194 G HA2 -0.331 3.631 3.960 0.003 0.000 0.242 194 G HA3 -0.331 3.631 3.960 0.003 0.000 0.242 194 G C -0.277 174.833 174.900 0.350 0.000 0.982 194 G CA -0.030 45.198 45.100 0.214 0.000 0.662 194 G HN 0.600 8.890 8.290 -0.000 0.000 0.527 195 N N -1.590 117.268 118.700 0.263 0.000 4.098 195 N HA -0.122 4.620 4.740 0.003 0.000 0.278 195 N C 0.823 176.424 175.510 0.153 0.000 2.166 195 N CA 0.694 53.849 53.050 0.175 0.000 2.665 195 N CB -1.182 37.468 38.487 0.272 0.000 0.415 195 N HN 0.395 8.775 8.380 -0.000 0.000 0.545 196 L N 2.777 123.919 121.223 -0.135 0.000 2.456 196 L HA -0.053 4.289 4.340 0.003 0.000 0.224 196 L C 1.604 178.299 176.870 -0.291 0.000 1.148 196 L CA 0.662 55.313 54.840 -0.315 0.000 0.825 196 L CB -0.352 41.311 42.059 -0.660 0.000 0.937 196 L HN 0.449 8.679 8.230 -0.000 0.000 0.450 197 F N -0.927 118.883 119.950 -0.235 0.000 2.373 197 F HA -0.202 4.327 4.527 0.003 0.000 0.300 197 F C 1.754 177.440 175.800 -0.189 0.000 1.080 197 F CA 0.753 58.639 58.000 -0.190 0.000 1.417 197 F CB -0.851 37.980 39.000 -0.282 0.000 1.070 197 F HN 0.115 8.415 8.300 -0.000 0.000 0.546 198 Y N -1.553 118.912 120.300 0.275 0.000 2.457 198 Y HA 0.116 4.667 4.550 0.003 0.000 0.263 198 Y C 0.991 177.016 175.900 0.209 0.000 1.164 198 Y CA -0.507 57.778 58.100 0.309 0.000 1.274 198 Y CB -0.432 38.297 38.460 0.448 0.000 1.097 198 Y HN -0.163 8.117 8.280 -0.000 0.000 0.523 199 N N 2.413 121.077 118.700 -0.060 0.000 2.414 199 N HA 0.086 4.828 4.740 0.003 0.000 0.256 199 N C -1.937 173.389 175.510 -0.307 0.000 1.029 199 N CA -2.259 50.347 53.050 -0.740 0.000 0.948 199 N CB 1.471 39.157 38.487 -1.334 0.000 1.102 199 N HN -0.029 8.351 8.380 -0.000 0.000 0.496 200 P HA -0.083 4.337 4.420 -0.000 0.000 0.218 200 P C 1.070 178.229 177.300 -0.235 0.000 1.149 200 P CA 1.060 64.064 63.100 -0.159 0.000 0.817 200 P CB 0.046 31.651 31.700 -0.158 0.000 0.785 201 F N -0.903 118.956 119.950 -0.151 0.000 2.325 201 F HA -0.093 4.435 4.527 0.003 0.000 0.299 201 F C 2.829 178.615 175.800 -0.023 0.000 1.090 201 F CA 0.999 58.968 58.000 -0.051 0.000 1.392 201 F CB -1.181 37.783 39.000 -0.060 0.000 1.053 201 F HN 0.094 8.394 8.300 -0.000 0.000 0.521 202 H N -0.063 118.995 119.070 -0.019 0.000 2.326 202 H HA -0.081 4.477 4.556 0.003 0.000 0.301 202 H C 2.422 177.742 175.328 -0.013 0.000 1.081 202 H CA 1.538 57.574 56.048 -0.021 0.000 1.334 202 H CB -0.475 29.241 29.762 -0.077 0.000 1.385 202 H HN 0.319 8.599 8.280 -0.000 0.000 0.504 203 G N 0.997 109.812 108.800 0.024 0.000 2.442 203 G HA2 -0.200 3.762 3.960 0.003 0.000 0.219 203 G HA3 -0.200 3.762 3.960 0.003 0.000 0.219 203 G C 2.029 176.839 174.900 -0.149 0.000 1.141 203 G CA 0.690 45.747 45.100 -0.071 0.000 0.763 203 G HN 0.334 8.624 8.290 -0.000 0.000 0.554 204 L N 0.340 121.508 121.223 -0.090 0.000 2.027 204 L HA -0.059 4.283 4.340 0.003 0.000 0.206 204 L C 3.097 179.963 176.870 -0.006 0.000 1.074 204 L CA 1.231 56.018 54.840 -0.088 0.000 0.745 204 L CB -0.486 41.638 42.059 0.109 0.000 0.898 204 L HN 0.307 8.537 8.230 -0.000 0.000 0.433 205 S N 0.140 115.887 115.700 0.079 0.000 2.370 205 S HA -0.180 4.292 4.470 0.003 0.000 0.226 205 S C 1.972 176.530 174.600 -0.071 0.000 1.033 205 S CA 1.340 59.604 58.200 0.108 0.000 1.011 205 S CB -0.244 62.975 63.200 0.031 0.000 0.852 205 S HN 0.273 8.583 8.310 -0.000 0.000 0.457 206 I N 1.349 121.746 120.570 -0.288 0.000 2.226 206 I HA -0.172 4.000 4.170 0.003 0.000 0.245 206 I C 2.737 178.533 176.117 -0.536 0.000 1.100 206 I CA 1.070 62.064 61.300 -0.510 0.000 1.374 206 I CB -0.530 37.099 38.000 -0.618 0.000 1.057 206 I HN 0.355 8.565 8.210 -0.000 0.000 0.413 207 A N 0.905 123.481 122.820 -0.405 0.000 1.908 207 A HA -0.229 4.093 4.320 0.003 0.000 0.218 207 A C 2.035 179.452 177.584 -0.279 0.000 1.181 207 A CA 1.777 53.596 52.037 -0.364 0.000 0.627 207 A CB -0.992 17.720 19.000 -0.481 0.000 0.818 207 A HN 0.358 8.508 8.150 -0.000 0.000 0.445 208 F N -0.998 118.949 119.950 -0.007 0.000 2.259 208 F HA -0.025 4.503 4.527 0.003 0.000 0.298 208 F C 1.977 177.815 175.800 0.064 0.000 1.088 208 F CA 0.957 58.991 58.000 0.057 0.000 1.358 208 F CB -0.671 38.377 39.000 0.082 0.000 1.040 208 F HN 0.227 8.527 8.300 -0.000 0.000 0.505 209 L N -0.929 120.385 121.223 0.152 0.000 2.005 209 L HA -0.207 4.135 4.340 0.003 0.000 0.207 209 L C 2.273 179.281 176.870 0.230 0.000 1.072 209 L CA 1.844 56.770 54.840 0.144 0.000 0.744 209 L CB -1.088 41.007 42.059 0.059 0.000 0.895 209 L HN 0.034 8.264 8.230 -0.000 0.000 0.433 210 Y N 0.155 120.492 120.300 0.062 0.000 2.207 210 Y HA -0.086 4.466 4.550 0.003 0.000 0.287 210 Y C 2.551 178.486 175.900 0.058 0.000 1.156 210 Y CA 0.859 58.986 58.100 0.045 0.000 1.182 210 Y CB -1.601 36.865 38.460 0.009 0.000 0.979 210 Y HN 0.276 8.556 8.280 -0.000 0.000 0.521 211 G N -1.396 107.542 108.800 0.230 0.000 2.422 211 G HA2 -0.188 3.774 3.960 0.003 0.000 0.218 211 G HA3 -0.188 3.774 3.960 0.003 0.000 0.218 211 G C 1.951 176.954 174.900 0.171 0.000 1.140 211 G CA 1.056 46.257 45.100 0.168 0.000 0.775 211 G HN 0.373 8.663 8.290 -0.000 0.000 0.545 212 S N 0.886 116.706 115.700 0.201 0.000 2.382 212 S HA 0.017 4.488 4.470 0.003 0.000 0.228 212 S C 2.742 177.460 174.600 0.197 0.000 1.027 212 S CA 1.116 59.425 58.200 0.182 0.000 0.991 212 S CB -0.237 63.074 63.200 0.185 0.000 0.823 212 S HN 0.568 8.878 8.310 -0.000 0.000 0.469 213 A N 1.394 124.329 122.820 0.191 0.000 1.897 213 A HA 0.033 4.355 4.320 0.003 0.000 0.215 213 A C 2.078 179.744 177.584 0.136 0.000 1.181 213 A CA 1.127 53.265 52.037 0.169 0.000 0.620 213 A CB -0.703 18.377 19.000 0.135 0.000 0.821 213 A HN 0.414 8.564 8.150 -0.000 0.000 0.443 214 L N -0.553 120.737 121.223 0.111 0.000 1.990 214 L HA -0.160 4.181 4.340 0.003 0.000 0.213 214 L C 2.219 179.126 176.870 0.060 0.000 1.072 214 L CA 2.346 57.228 54.840 0.070 0.000 0.755 214 L CB -0.760 41.329 42.059 0.050 0.000 0.889 214 L HN 0.321 8.551 8.230 -0.000 0.000 0.432 215 L N -1.762 119.498 121.223 0.061 0.000 2.109 215 L HA -0.126 4.216 4.340 0.003 0.000 0.207 215 L C 2.210 179.162 176.870 0.137 0.000 1.086 215 L CA 1.548 56.397 54.840 0.014 0.000 0.760 215 L CB -0.792 41.255 42.059 -0.020 0.000 0.910 215 L HN 0.300 8.530 8.230 -0.000 0.000 0.437 216 F N -0.080 119.897 119.950 0.045 0.000 2.367 216 F HA 0.082 4.611 4.527 0.003 0.000 0.298 216 F C 2.326 178.160 175.800 0.057 0.000 1.094 216 F CA 0.487 58.532 58.000 0.074 0.000 1.409 216 F CB -0.888 38.158 39.000 0.077 0.000 1.064 216 F HN 0.173 8.473 8.300 -0.000 0.000 0.528 217 A N 0.233 123.183 122.820 0.216 0.000 1.858 217 A HA -0.223 4.098 4.320 0.003 0.000 0.216 217 A C 2.329 179.988 177.584 0.124 0.000 1.190 217 A CA 1.865 53.965 52.037 0.106 0.000 0.617 217 A CB -0.751 18.296 19.000 0.078 0.000 0.827 217 A HN 0.353 8.503 8.150 -0.000 0.000 0.443 218 M N -1.755 117.923 119.600 0.129 0.000 2.082 218 M HA -0.245 4.237 4.480 0.003 0.000 0.258 218 M C 2.328 178.741 176.300 0.187 0.000 1.071 218 M CA 2.344 57.732 55.300 0.148 0.000 1.103 218 M CB -0.634 31.889 32.600 -0.130 0.000 1.307 218 M HN 0.705 8.995 8.290 -0.000 0.000 0.409 219 H N -0.242 118.863 119.070 0.058 0.000 2.357 219 H HA -0.013 4.544 4.556 0.003 0.000 0.301 219 H C 1.976 177.385 175.328 0.135 0.000 1.082 219 H CA 2.044 58.134 56.048 0.069 0.000 1.342 219 H CB -0.603 29.163 29.762 0.008 0.000 1.389 219 H HN 0.329 8.609 8.280 -0.000 0.000 0.511 220 G N -0.013 108.840 108.800 0.088 0.000 2.421 220 G HA2 -0.264 3.698 3.960 0.003 0.000 0.216 220 G HA3 -0.264 3.698 3.960 0.003 0.000 0.216 220 G C 1.926 176.758 174.900 -0.114 0.000 1.171 220 G CA 1.054 46.111 45.100 -0.072 0.000 0.775 220 G HN 0.608 8.898 8.290 -0.000 0.000 0.543 221 A N 0.163 122.950 122.820 -0.055 0.000 1.902 221 A HA -0.016 4.306 4.320 0.003 0.000 0.217 221 A C 2.535 180.056 177.584 -0.106 0.000 1.181 221 A CA 2.484 54.474 52.037 -0.078 0.000 0.623 221 A CB -0.965 18.015 19.000 -0.033 0.000 0.818 221 A HN 0.304 8.454 8.150 -0.000 0.000 0.443 222 T N 0.466 114.991 114.554 -0.049 0.000 2.674 222 T HA -0.098 4.254 4.350 0.003 0.000 0.265 222 T C 1.825 176.479 174.700 -0.076 0.000 1.039 222 T CA 1.462 63.538 62.100 -0.040 0.000 1.150 222 T CB -0.288 68.688 68.868 0.181 0.000 0.864 222 T HN 0.297 8.537 8.240 -0.000 0.000 0.427 223 I N 1.221 121.711 120.570 -0.134 0.000 2.226 223 I HA -0.090 4.082 4.170 0.003 0.000 0.245 223 I C 2.380 178.435 176.117 -0.104 0.000 1.100 223 I CA 1.269 62.495 61.300 -0.123 0.000 1.374 223 I CB -1.261 36.607 38.000 -0.220 0.000 1.057 223 I HN 0.280 8.490 8.210 -0.000 0.000 0.413 224 L N 0.645 121.786 121.223 -0.136 0.000 2.046 224 L HA -0.191 4.151 4.340 0.003 0.000 0.208 224 L C 2.819 179.609 176.870 -0.133 0.000 1.077 224 L CA 1.392 56.144 54.840 -0.146 0.000 0.747 224 L CB -0.779 41.175 42.059 -0.175 0.000 0.896 224 L HN 0.191 8.421 8.230 -0.000 0.000 0.432 225 A N 0.113 122.857 122.820 -0.127 0.000 1.940 225 A HA -0.140 4.181 4.320 0.003 0.000 0.219 225 A C 1.903 179.462 177.584 -0.041 0.000 1.176 225 A CA 1.842 53.810 52.037 -0.114 0.000 0.631 225 A CB -0.682 18.215 19.000 -0.171 0.000 0.814 225 A HN 0.368 8.518 8.150 -0.000 0.000 0.446 226 V N -1.510 118.413 119.914 0.015 0.000 3.249 226 V HA 0.160 4.282 4.120 0.003 0.000 0.338 226 V C 1.468 177.601 176.094 0.065 0.000 1.363 226 V CA 0.849 63.252 62.300 0.172 0.000 1.205 226 V CB -0.826 31.142 31.823 0.241 0.000 1.164 226 V HN 0.556 8.746 8.190 -0.000 0.000 0.458 227 S N 2.046 117.709 115.700 -0.062 0.000 2.453 227 S HA -0.182 4.290 4.470 0.003 0.000 0.231 227 S C 1.947 176.463 174.600 -0.140 0.000 1.005 227 S CA 0.978 59.132 58.200 -0.076 0.000 0.949 227 S CB -0.608 62.538 63.200 -0.089 0.000 0.774 227 S HN 0.855 9.165 8.310 -0.000 0.000 0.510 228 R N 0.482 120.798 120.500 -0.306 0.000 2.285 228 R HA 0.069 4.410 4.340 0.003 0.000 0.213 228 R C 0.364 176.275 176.300 -0.649 0.000 1.068 228 R CA 1.001 56.810 56.100 -0.484 0.000 1.004 228 R CB -0.707 29.208 30.300 -0.641 0.000 0.873 228 R HN 0.560 8.830 8.270 -0.000 0.000 0.467 229 F N 0.178 120.126 119.950 -0.003 0.000 2.698 229 F HA 0.474 5.002 4.527 0.003 0.000 0.304 229 F C 1.092 176.893 175.800 0.001 0.000 1.108 229 F CA -0.201 57.799 58.000 -0.000 0.000 1.263 229 F CB 1.216 40.214 39.000 -0.003 0.000 1.013 229 F HN 0.175 8.475 8.300 -0.000 0.000 0.532 230 G N 0.676 109.525 108.800 0.082 0.000 2.147 230 G HA2 -0.270 3.692 3.960 0.003 0.000 0.244 230 G HA3 -0.270 3.692 3.960 0.003 0.000 0.244 230 G C 1.364 176.306 174.900 0.069 0.000 1.005 230 G CA 0.135 45.272 45.100 0.061 0.000 0.713 230 G HN 0.667 8.957 8.290 -0.000 0.000 0.515 231 G N 1.043 109.893 108.800 0.083 0.000 2.475 231 G HA2 -0.136 3.826 3.960 0.003 0.000 0.220 231 G HA3 -0.136 3.826 3.960 0.003 0.000 0.220 231 G C 1.478 176.410 174.900 0.053 0.000 1.125 231 G CA 1.610 46.758 45.100 0.081 0.000 0.755 231 G HN 0.898 9.188 8.290 -0.000 0.000 0.565 232 E N 0.967 121.181 120.200 0.024 0.000 2.482 232 E HA -0.053 4.299 4.350 0.003 0.000 0.196 232 E C 1.051 177.665 176.600 0.023 0.000 1.047 232 E CA -0.043 56.367 56.400 0.017 0.000 0.869 232 E CB -0.235 29.456 29.700 -0.015 0.000 0.836 232 E HN 0.308 8.668 8.360 -0.000 0.000 0.520 233 R N 1.690 122.205 120.500 0.024 0.000 4.154 233 R HA 0.108 4.449 4.340 0.003 0.000 0.186 233 R C 0.868 177.182 176.300 0.023 0.000 1.750 233 R CA 0.010 56.120 56.100 0.017 0.000 1.431 233 R CB -0.005 30.306 30.300 0.018 0.000 1.383 233 R HN 0.275 8.545 8.270 -0.000 0.000 0.788 234 E N 0.671 120.885 120.200 0.022 0.000 2.106 234 E HA -0.182 4.170 4.350 0.003 0.000 0.192 234 E C 1.377 177.974 176.600 -0.005 0.000 0.984 234 E CA 0.997 57.416 56.400 0.032 0.000 0.806 234 E CB 0.083 29.805 29.700 0.038 0.000 0.750 234 E HN 0.472 8.832 8.360 -0.000 0.000 0.458 235 L N 0.669 121.871 121.223 -0.035 0.000 2.046 235 L HA -0.185 4.157 4.340 0.003 0.000 0.208 235 L C 2.503 179.363 176.870 -0.016 0.000 1.077 235 L CA 1.084 55.899 54.840 -0.043 0.000 0.747 235 L CB -0.155 41.871 42.059 -0.055 0.000 0.896 235 L HN 0.073 8.303 8.230 -0.000 0.000 0.432 236 E N -0.506 119.691 120.200 -0.005 0.000 2.216 236 E HA -0.165 4.187 4.350 0.003 0.000 0.192 236 E C 2.215 178.824 176.600 0.015 0.000 0.988 236 E CA 0.657 57.059 56.400 0.004 0.000 0.834 236 E CB 0.134 29.837 29.700 0.006 0.000 0.772 236 E HN 0.302 8.662 8.360 -0.000 0.000 0.479 237 Q N -0.160 119.654 119.800 0.024 0.000 2.167 237 Q HA -0.088 4.253 4.340 0.003 0.000 0.202 237 Q C 2.214 178.235 176.000 0.035 0.000 0.970 237 Q CA 0.933 56.758 55.803 0.036 0.000 0.855 237 Q CB 0.011 28.782 28.738 0.055 0.000 0.911 237 Q HN 0.444 8.714 8.270 -0.000 0.000 0.438 238 I N 0.409 120.996 120.570 0.028 0.000 2.202 238 I HA -0.220 3.952 4.170 0.003 0.000 0.242 238 I C 2.291 178.419 176.117 0.018 0.000 1.091 238 I CA 1.039 62.355 61.300 0.026 0.000 1.368 238 I CB -0.314 37.691 38.000 0.009 0.000 1.058 238 I HN 0.043 8.253 8.210 -0.000 0.000 0.410 239 A N -0.858 121.968 122.820 0.010 0.000 2.015 239 A HA -0.170 4.151 4.320 0.003 0.000 0.219 239 A C 0.902 178.492 177.584 0.011 0.000 1.163 239 A CA 1.581 53.623 52.037 0.008 0.000 0.646 239 A CB -0.100 18.901 19.000 0.002 0.000 0.806 239 A HN 0.422 8.572 8.150 -0.000 0.000 0.448 240 D N -1.325 119.084 120.400 0.015 0.000 2.934 240 D HA 0.116 4.758 4.640 0.003 0.000 0.249 240 D C -0.370 175.940 176.300 0.018 0.000 1.293 240 D CA -0.447 53.561 54.000 0.015 0.000 0.812 240 D CB -0.131 40.676 40.800 0.013 0.000 1.439 240 D HN 0.265 8.635 8.370 -0.000 0.000 0.555 241 R N 0.770 121.282 120.500 0.019 0.000 2.500 241 R HA 0.315 4.657 4.340 0.003 0.000 0.281 241 R C 0.320 176.627 176.300 0.012 0.000 0.953 241 R CA 0.791 56.902 56.100 0.020 0.000 1.108 241 R CB 0.296 30.607 30.300 0.018 0.000 0.901 241 R HN 0.366 8.636 8.270 -0.000 0.000 0.410 242 G N 0.551 109.358 108.800 0.011 0.000 3.108 242 G HA2 0.113 4.075 3.960 0.003 0.000 0.268 242 G HA3 0.113 4.075 3.960 0.003 0.000 0.268 242 G C 0.290 175.169 174.900 -0.035 0.000 1.361 242 G CA -0.259 44.841 45.100 0.000 0.000 1.047 242 G HN 0.552 8.842 8.290 -0.000 0.000 0.540 243 T N -0.482 114.030 114.554 -0.070 0.000 2.995 243 T HA 0.054 4.405 4.350 0.003 0.000 0.269 243 T C 2.495 177.041 174.700 -0.257 0.000 1.091 243 T CA 2.102 64.087 62.100 -0.191 0.000 1.128 243 T CB -0.517 68.186 68.868 -0.275 0.000 0.891 243 T HN 0.643 8.883 8.240 -0.000 0.000 0.492 244 A N 1.136 123.903 122.820 -0.087 0.000 1.865 244 A HA 0.169 4.491 4.320 0.003 0.000 0.217 244 A C 2.695 180.278 177.584 -0.002 0.000 1.191 244 A CA 1.981 54.033 52.037 0.026 0.000 0.623 244 A CB -1.312 17.779 19.000 0.152 0.000 0.826 244 A HN 0.621 8.771 8.150 -0.000 0.000 0.444 245 A N -0.568 122.257 122.820 0.009 0.000 1.969 245 A HA -0.104 4.218 4.320 0.003 0.000 0.218 245 A C 1.919 179.497 177.584 -0.010 0.000 1.169 245 A CA 1.503 53.557 52.037 0.027 0.000 0.635 245 A CB -0.422 18.603 19.000 0.042 0.000 0.810 245 A HN 0.654 8.804 8.150 -0.000 0.000 0.445 246 E N -0.364 119.800 120.200 -0.059 0.000 2.072 246 E HA -0.133 4.218 4.350 0.003 0.000 0.190 246 E C 2.289 178.798 176.600 -0.152 0.000 0.982 246 E CA 0.854 57.199 56.400 -0.091 0.000 0.803 246 E CB -0.159 29.480 29.700 -0.101 0.000 0.755 246 E HN 0.539 8.899 8.360 -0.000 0.000 0.453 247 R N 0.676 121.060 120.500 -0.193 0.000 2.096 247 R HA -0.064 4.278 4.340 0.003 0.000 0.235 247 R C 2.364 178.583 176.300 -0.135 0.000 1.127 247 R CA 1.004 56.970 56.100 -0.224 0.000 0.968 247 R CB -0.278 29.858 30.300 -0.273 0.000 0.861 247 R HN 0.086 8.356 8.270 -0.000 0.000 0.440 248 A N 1.527 124.320 122.820 -0.045 0.000 1.877 248 A HA -0.116 4.206 4.320 0.003 0.000 0.216 248 A C 2.416 180.075 177.584 0.125 0.000 1.186 248 A CA 1.680 53.750 52.037 0.055 0.000 0.620 248 A CB -0.679 18.384 19.000 0.106 0.000 0.822 248 A HN 0.381 8.531 8.150 -0.000 0.000 0.443 249 A N -0.337 122.516 122.820 0.054 0.000 1.877 249 A HA -0.058 4.264 4.320 0.003 0.000 0.216 249 A C 2.168 179.714 177.584 -0.064 0.000 1.186 249 A CA 1.595 53.661 52.037 0.049 0.000 0.620 249 A CB -0.611 18.395 19.000 0.010 0.000 0.822 249 A HN 0.473 8.623 8.150 -0.000 0.000 0.443 250 L N -2.105 118.958 121.223 -0.267 0.000 2.156 250 L HA -0.070 4.272 4.340 0.003 0.000 0.208 250 L C 2.401 178.796 176.870 -0.791 0.000 1.095 250 L CA 0.990 55.427 54.840 -0.672 0.000 0.770 250 L CB -0.492 40.976 42.059 -0.984 0.000 0.914 250 L HN 0.507 8.737 8.230 -0.000 0.000 0.439 251 F N 0.303 119.898 119.950 -0.591 0.000 2.065 251 F HA -0.279 4.250 4.527 0.003 0.000 0.298 251 F C 1.949 177.449 175.800 -0.500 0.000 1.112 251 F CA 1.783 59.456 58.000 -0.545 0.000 1.212 251 F CB -0.432 38.206 39.000 -0.603 0.000 0.975 251 F HN -0.014 8.286 8.300 -0.000 0.000 0.476 252 W N 0.270 121.553 121.300 -0.027 0.000 2.453 252 W HA 0.030 4.692 4.660 0.003 0.000 0.289 252 W C 2.777 179.180 176.519 -0.193 0.000 1.215 252 W CA 1.036 58.313 57.345 -0.112 0.000 1.297 252 W CB -0.508 28.890 29.460 -0.104 0.000 1.113 252 W HN -0.118 8.062 8.180 -0.000 0.000 0.551 253 R N -0.250 120.252 120.500 0.003 0.000 2.081 253 R HA -0.190 4.152 4.340 0.003 0.000 0.235 253 R C 1.891 178.300 176.300 0.182 0.000 1.131 253 R CA 1.994 58.132 56.100 0.064 0.000 0.960 253 R CB -0.621 29.707 30.300 0.047 0.000 0.856 253 R HN 0.130 8.400 8.270 -0.000 0.000 0.436 254 W N 0.192 121.417 121.300 -0.125 0.000 2.436 254 W HA 0.030 4.692 4.660 0.003 0.000 0.284 254 W C 2.133 178.523 176.519 -0.215 0.000 1.225 254 W CA 0.861 58.107 57.345 -0.165 0.000 1.271 254 W CB -1.042 28.290 29.460 -0.212 0.000 1.114 254 W HN 0.110 8.290 8.180 -0.000 0.000 0.559 255 T N 0.887 115.371 114.554 -0.117 0.000 2.698 255 T HA -0.132 4.220 4.350 0.003 0.000 0.260 255 T C 1.679 176.384 174.700 0.007 0.000 1.044 255 T CA 1.989 63.977 62.100 -0.187 0.000 1.149 255 T CB -0.318 68.253 68.868 -0.495 0.000 0.864 255 T HN 0.195 8.435 8.240 -0.000 0.000 0.419 256 M N -0.813 118.837 119.600 0.083 0.000 2.347 256 M HA 0.600 5.082 4.480 0.003 0.000 0.324 256 M C 1.266 177.711 176.300 0.242 0.000 1.028 256 M CA 0.246 55.638 55.300 0.153 0.000 0.988 256 M CB 1.010 33.706 32.600 0.160 0.000 1.528 256 M HN 0.312 8.602 8.290 -0.000 0.000 0.550 257 G N 2.082 111.006 108.800 0.207 0.000 2.176 257 G HA2 -0.270 3.692 3.960 0.003 0.000 0.253 257 G HA3 -0.270 3.692 3.960 0.003 0.000 0.253 257 G C -0.211 174.915 174.900 0.376 0.000 0.979 257 G CA 0.515 45.772 45.100 0.261 0.000 0.641 257 G HN 0.838 9.128 8.290 -0.000 0.000 0.530 258 F N -0.346 119.666 119.950 0.104 0.000 2.745 258 F HA 0.783 5.312 4.527 0.003 0.000 0.316 258 F C -0.798 175.066 175.800 0.107 0.000 1.155 258 F CA -1.239 56.817 58.000 0.094 0.000 0.937 258 F CB 0.742 39.787 39.000 0.076 0.000 1.361 258 F HN 0.397 8.697 8.300 -0.000 0.000 0.472 259 N N 0.984 119.707 118.700 0.038 0.000 3.106 259 N HA 0.731 5.472 4.740 0.003 0.000 0.253 259 N C -1.794 173.754 175.510 0.062 0.000 1.506 259 N CA -0.626 52.388 53.050 -0.060 0.000 0.876 259 N CB 1.823 40.339 38.487 0.049 0.000 1.452 259 N HN 1.086 9.466 8.380 -0.000 0.000 0.542 260 A N -0.133 122.706 122.820 0.033 0.000 2.452 260 A HA 0.824 5.145 4.320 0.003 0.000 0.285 260 A C 0.103 177.757 177.584 0.117 0.000 1.209 260 A CA -0.152 51.959 52.037 0.122 0.000 0.940 260 A CB 0.547 19.580 19.000 0.055 0.000 1.440 260 A HN 0.878 9.028 8.150 -0.000 0.000 0.480 261 T N -3.562 111.070 114.554 0.130 0.000 2.927 261 T HA 0.449 4.801 4.350 0.003 0.000 0.286 261 T C 0.814 175.586 174.700 0.121 0.000 1.040 261 T CA -0.095 62.071 62.100 0.110 0.000 1.010 261 T CB 0.979 69.907 68.868 0.101 0.000 1.177 261 T HN 0.450 8.690 8.240 -0.000 0.000 0.546 262 M N 0.284 119.960 119.600 0.127 0.000 2.213 262 M HA 0.048 4.529 4.480 0.003 0.000 0.263 262 M C 2.082 178.527 176.300 0.242 0.000 1.062 262 M CA 1.671 57.078 55.300 0.177 0.000 1.105 262 M CB -0.753 31.934 32.600 0.145 0.000 1.385 262 M HN 0.876 9.166 8.290 -0.000 0.000 0.417 263 E N -1.326 118.975 120.200 0.168 0.000 2.060 263 E HA -0.061 4.291 4.350 0.003 0.000 0.189 263 E C 1.907 178.621 176.600 0.191 0.000 0.974 263 E CA 1.000 57.500 56.400 0.167 0.000 0.808 263 E CB -0.399 29.347 29.700 0.077 0.000 0.768 263 E HN 0.590 8.950 8.360 -0.000 0.000 0.453 264 G N 1.266 110.151 108.800 0.141 0.000 2.471 264 G HA2 -0.223 3.739 3.960 0.003 0.000 0.219 264 G HA3 -0.223 3.739 3.960 0.003 0.000 0.219 264 G C 1.486 176.494 174.900 0.181 0.000 1.125 264 G CA 0.454 45.632 45.100 0.129 0.000 0.775 264 G HN 0.288 8.578 8.290 -0.000 0.000 0.548 265 I N 0.634 121.265 120.570 0.101 0.000 2.394 265 I HA -0.067 4.105 4.170 0.003 0.000 0.251 265 I C 2.244 178.196 176.117 -0.275 0.000 1.136 265 I CA 0.938 62.192 61.300 -0.078 0.000 1.425 265 I CB -0.333 37.445 38.000 -0.371 0.000 1.079 265 I HN 0.261 8.471 8.210 -0.000 0.000 0.425 266 H N -0.302 118.725 119.070 -0.071 0.000 2.495 266 H HA 0.067 4.625 4.556 0.003 0.000 0.287 266 H C 2.215 177.532 175.328 -0.018 0.000 1.033 266 H CA 1.076 57.064 56.048 -0.100 0.000 1.307 266 H CB -0.096 29.604 29.762 -0.103 0.000 1.401 266 H HN 0.289 8.569 8.280 -0.000 0.000 0.555 267 R N -0.708 119.859 120.500 0.112 0.000 2.100 267 R HA -0.083 4.259 4.340 0.003 0.000 0.220 267 R C 1.548 177.977 176.300 0.216 0.000 1.091 267 R CA 1.029 57.218 56.100 0.147 0.000 0.986 267 R CB -0.268 30.085 30.300 0.089 0.000 0.888 267 R HN 0.365 8.635 8.270 -0.000 0.000 0.444 268 W N 1.319 122.662 121.300 0.073 0.000 2.335 268 W HA -0.185 4.476 4.660 0.003 0.000 0.311 268 W C 2.591 179.127 176.519 0.029 0.000 1.213 268 W CA 1.286 58.666 57.345 0.058 0.000 1.274 268 W CB -0.326 29.113 29.460 -0.035 0.000 1.148 268 W HN 0.179 8.359 8.180 -0.000 0.000 0.498 269 A N 0.211 123.118 122.820 0.145 0.000 1.865 269 A HA -0.240 4.082 4.320 0.003 0.000 0.217 269 A C 1.937 179.521 177.584 -0.000 0.000 1.191 269 A CA 1.849 53.869 52.037 -0.029 0.000 0.623 269 A CB -1.119 17.731 19.000 -0.249 0.000 0.826 269 A HN 0.356 8.506 8.150 -0.000 0.000 0.444 270 I N -2.147 118.416 120.570 -0.012 0.000 2.286 270 I HA -0.265 3.906 4.170 0.003 0.000 0.248 270 I C 2.260 178.292 176.117 -0.142 0.000 1.115 270 I CA 1.430 62.668 61.300 -0.103 0.000 1.392 270 I CB -0.103 37.801 38.000 -0.160 0.000 1.065 270 I HN 0.621 8.831 8.210 -0.000 0.000 0.418 271 W N -0.213 121.087 121.300 0.000 0.000 2.418 271 W HA -0.180 4.482 4.660 0.003 0.000 0.292 271 W C 2.428 178.908 176.519 -0.064 0.000 1.213 271 W CA 0.673 57.993 57.345 -0.041 0.000 1.283 271 W CB -0.317 29.107 29.460 -0.061 0.000 1.119 271 W HN 0.129 8.309 8.180 -0.000 0.000 0.542 272 M N 1.106 120.863 119.600 0.262 0.000 2.080 272 M HA -0.140 4.342 4.480 0.003 0.000 0.260 272 M C 2.127 178.515 176.300 0.146 0.000 1.068 272 M CA 2.434 57.882 55.300 0.247 0.000 1.109 272 M CB -0.975 31.783 32.600 0.264 0.000 1.342 272 M HN -0.038 8.252 8.290 -0.000 0.000 0.405 273 A N -0.596 122.276 122.820 0.087 0.000 1.845 273 A HA -0.129 4.193 4.320 0.003 0.000 0.215 273 A C 2.196 179.799 177.584 0.030 0.000 1.195 273 A CA 2.635 54.708 52.037 0.060 0.000 0.616 273 A CB -1.774 17.241 19.000 0.025 0.000 0.832 273 A HN 0.717 8.867 8.150 -0.000 0.000 0.443 274 V N -1.784 118.112 119.914 -0.030 0.000 2.594 274 V HA -0.127 3.995 4.120 0.003 0.000 0.253 274 V C 2.128 178.203 176.094 -0.031 0.000 1.069 274 V CA 1.966 64.241 62.300 -0.043 0.000 1.082 274 V CB -0.847 30.884 31.823 -0.154 0.000 0.680 274 V HN 0.425 8.615 8.190 -0.000 0.000 0.469 275 L N -0.321 120.830 121.223 -0.121 0.000 2.376 275 L HA -0.046 4.296 4.340 0.003 0.000 0.219 275 L C 2.577 179.379 176.870 -0.114 0.000 1.133 275 L CA 0.812 55.470 54.840 -0.304 0.000 0.816 275 L CB -0.390 41.042 42.059 -1.045 0.000 0.933 275 L HN 0.259 8.489 8.230 -0.000 0.000 0.449 276 V N 0.067 120.008 119.914 0.045 0.000 2.231 276 V HA -0.346 3.775 4.120 0.003 0.000 0.248 276 V C 2.616 178.809 176.094 0.165 0.000 1.054 276 V CA 2.680 65.087 62.300 0.178 0.000 1.015 276 V CB -1.041 30.877 31.823 0.158 0.000 0.638 276 V HN 0.668 8.858 8.190 -0.000 0.000 0.444 277 T N -2.122 112.524 114.554 0.152 0.000 3.043 277 T HA -0.009 4.342 4.350 0.003 0.000 0.263 277 T C 1.785 176.669 174.700 0.308 0.000 1.094 277 T CA 0.865 63.080 62.100 0.193 0.000 1.127 277 T CB -0.144 68.834 68.868 0.183 0.000 0.905 277 T HN 0.207 8.447 8.240 -0.000 0.000 0.490 278 L N 2.898 124.270 121.223 0.250 0.000 1.988 278 L HA -0.016 4.325 4.340 0.003 0.000 0.207 278 L C 2.893 179.950 176.870 0.312 0.000 1.071 278 L CA 2.562 57.559 54.840 0.262 0.000 0.744 278 L CB -1.330 40.775 42.059 0.077 0.000 0.893 278 L HN 0.527 8.757 8.230 -0.000 0.000 0.433 279 T N -3.536 111.171 114.554 0.256 0.000 2.788 279 T HA -0.095 4.257 4.350 0.003 0.000 0.268 279 T C 1.959 176.817 174.700 0.265 0.000 1.044 279 T CA 0.986 63.292 62.100 0.344 0.000 1.139 279 T CB -1.459 67.694 68.868 0.476 0.000 0.867 279 T HN 0.389 8.629 8.240 -0.000 0.000 0.454 280 G N 1.326 110.259 108.800 0.221 0.000 2.421 280 G HA2 0.069 4.031 3.960 0.003 0.000 0.216 280 G HA3 0.069 4.031 3.960 0.003 0.000 0.216 280 G C 1.752 176.687 174.900 0.058 0.000 1.171 280 G CA 0.663 45.845 45.100 0.136 0.000 0.775 280 G HN 0.664 8.954 8.290 -0.000 0.000 0.543 281 G N 0.888 109.729 108.800 0.067 0.000 2.422 281 G HA2 -0.137 3.825 3.960 0.003 0.000 0.218 281 G HA3 -0.137 3.825 3.960 0.003 0.000 0.218 281 G C 1.776 176.600 174.900 -0.127 0.000 1.146 281 G CA 0.791 45.719 45.100 -0.286 0.000 0.769 281 G HN 0.449 8.739 8.290 -0.000 0.000 0.547 282 I N 1.257 121.925 120.570 0.163 0.000 2.142 282 I HA -0.104 4.068 4.170 0.003 0.000 0.240 282 I C 3.122 179.096 176.117 -0.238 0.000 1.078 282 I CA 1.136 62.384 61.300 -0.087 0.000 1.343 282 I CB -0.564 37.119 38.000 -0.528 0.000 1.046 282 I HN 0.233 8.443 8.210 -0.000 0.000 0.405 283 G N 1.308 109.991 108.800 -0.196 0.000 2.440 283 G HA2 -0.215 3.747 3.960 0.003 0.000 0.218 283 G HA3 -0.215 3.747 3.960 0.003 0.000 0.218 283 G C 1.574 176.499 174.900 0.042 0.000 1.154 283 G CA 0.628 45.702 45.100 -0.043 0.000 0.767 283 G HN 0.200 8.490 8.290 -0.000 0.000 0.552 284 I N 0.307 120.876 120.570 -0.000 0.000 2.286 284 I HA 0.001 4.173 4.170 0.003 0.000 0.245 284 I C 2.572 178.730 176.117 0.068 0.000 1.104 284 I CA 0.511 61.826 61.300 0.025 0.000 1.397 284 I CB -1.047 36.884 38.000 -0.115 0.000 1.072 284 I HN 0.146 8.356 8.210 -0.000 0.000 0.417 285 L N 0.816 122.022 121.223 -0.029 0.000 2.131 285 L HA -0.105 4.237 4.340 0.003 0.000 0.210 285 L C 2.195 179.094 176.870 0.048 0.000 1.092 285 L CA 1.698 56.525 54.840 -0.022 0.000 0.759 285 L CB -0.576 41.439 42.059 -0.072 0.000 0.903 285 L HN 0.123 8.353 8.230 -0.000 0.000 0.435 286 L N -1.145 120.134 121.223 0.094 0.000 2.395 286 L HA 0.004 4.345 4.340 0.003 0.000 0.218 286 L C 0.871 177.804 176.870 0.104 0.000 1.130 286 L CA -0.020 54.890 54.840 0.117 0.000 0.826 286 L CB -0.408 41.782 42.059 0.219 0.000 0.941 286 L HN 0.053 8.283 8.230 -0.000 0.000 0.451 287 S N 0.237 116.046 115.700 0.182 0.000 2.430 287 S HA 0.387 4.859 4.470 0.003 0.000 0.282 287 S C 1.101 175.655 174.600 -0.077 0.000 1.186 287 S CA 0.414 58.649 58.200 0.057 0.000 1.060 287 S CB 0.907 64.132 63.200 0.043 0.000 0.966 287 S HN 0.558 8.868 8.310 -0.000 0.000 0.501 288 G N 3.233 112.026 108.800 -0.012 0.000 2.320 288 G HA2 -0.372 3.590 3.960 0.003 0.000 0.242 288 G HA3 -0.372 3.590 3.960 0.003 0.000 0.242 288 G C 1.126 176.023 174.900 -0.005 0.000 1.033 288 G CA 0.918 46.058 45.100 0.065 0.000 0.620 288 G HN 0.804 9.094 8.290 -0.000 0.000 0.517 289 T N -2.133 112.413 114.554 -0.014 0.000 2.814 289 T HA 0.341 4.693 4.350 0.003 0.000 0.254 289 T C 2.125 176.800 174.700 -0.041 0.000 1.037 289 T CA 2.125 64.213 62.100 -0.021 0.000 1.143 289 T CB -0.013 68.853 68.868 -0.005 0.000 0.866 289 T HN 0.593 8.833 8.240 -0.000 0.000 0.431 290 V N 0.311 120.186 119.914 -0.064 0.000 3.048 290 V HA 0.363 4.485 4.120 0.003 0.000 0.241 290 V C 0.310 176.301 176.094 -0.171 0.000 1.129 290 V CA 0.120 62.370 62.300 -0.084 0.000 1.128 290 V CB 1.067 32.856 31.823 -0.057 0.000 0.849 290 V HN 0.367 8.557 8.190 -0.000 0.000 0.475 291 V N 0.902 120.630 119.914 -0.309 0.000 2.409 291 V HA 0.398 4.519 4.120 0.003 0.000 0.290 291 V C 0.123 175.962 176.094 -0.424 0.000 1.017 291 V CA -0.488 61.485 62.300 -0.545 0.000 0.841 291 V CB 1.526 32.543 31.823 -1.343 0.000 1.003 291 V HN 0.270 8.460 8.190 -0.000 0.000 0.426 292 D N 2.353 122.605 120.400 -0.246 0.000 2.289 292 D HA 0.027 4.669 4.640 0.003 0.000 0.207 292 D C 0.656 176.871 176.300 -0.142 0.000 0.966 292 D CA 1.033 54.948 54.000 -0.142 0.000 0.868 292 D CB 0.334 41.069 40.800 -0.109 0.000 0.943 292 D HN 0.501 8.871 8.370 -0.000 0.000 0.514 293 N N -0.647 117.928 118.700 -0.208 0.000 2.699 293 N HA -0.012 4.730 4.740 0.003 0.000 0.271 293 N C -0.307 175.200 175.510 -0.006 0.000 1.216 293 N CA -0.381 52.640 53.050 -0.049 0.000 0.844 293 N CB 0.166 38.664 38.487 0.019 0.000 1.462 293 N HN -0.123 8.257 8.380 -0.000 0.000 0.555 294 W N 1.757 123.191 121.300 0.224 0.000 2.402 294 W HA -0.094 4.567 4.660 0.003 0.000 0.286 294 W C 1.808 178.516 176.519 0.314 0.000 1.221 294 W CA 0.513 58.035 57.345 0.296 0.000 1.257 294 W CB -0.210 29.421 29.460 0.286 0.000 1.120 294 W HN 0.664 8.844 8.180 -0.000 0.000 0.551 295 Y N 0.739 121.158 120.300 0.197 0.000 2.097 295 Y HA -0.301 4.251 4.550 0.003 0.000 0.282 295 Y C 2.249 178.100 175.900 -0.082 0.000 1.152 295 Y CA 2.134 60.053 58.100 -0.302 0.000 1.136 295 Y CB -0.882 37.321 38.460 -0.428 0.000 0.975 295 Y HN -0.225 8.055 8.280 -0.000 0.000 0.498 296 V N -0.616 119.315 119.914 0.028 0.000 2.332 296 V HA -0.322 3.800 4.120 0.003 0.000 0.248 296 V C 2.091 178.183 176.094 -0.003 0.000 1.055 296 V CA 2.083 64.354 62.300 -0.048 0.000 1.038 296 V CB -1.143 30.709 31.823 0.048 0.000 0.651 296 V HN 0.722 8.912 8.190 -0.000 0.000 0.450 297 W N 1.433 122.715 121.300 -0.029 0.000 2.358 297 W HA -0.058 4.603 4.660 0.003 0.000 0.303 297 W C 2.310 178.949 176.519 0.200 0.000 1.208 297 W CA 1.688 59.100 57.345 0.112 0.000 1.274 297 W CB -0.630 28.852 29.460 0.037 0.000 1.138 297 W HN 0.233 8.413 8.180 -0.000 0.000 0.515 298 G N -0.298 108.684 108.800 0.304 0.000 2.509 298 G HA2 -0.228 3.734 3.960 0.003 0.000 0.218 298 G HA3 -0.228 3.734 3.960 0.003 0.000 0.218 298 G C 1.366 176.144 174.900 -0.203 0.000 1.124 298 G CA 0.657 45.806 45.100 0.082 0.000 0.776 298 G HN 0.271 8.561 8.290 -0.000 0.000 0.547 299 Q N 0.429 120.038 119.800 -0.318 0.000 2.311 299 Q HA 0.037 4.379 4.340 0.003 0.000 0.203 299 Q C 1.459 177.247 176.000 -0.355 0.000 0.954 299 Q CA 0.590 56.185 55.803 -0.346 0.000 0.885 299 Q CB 0.006 28.507 28.738 -0.394 0.000 0.963 299 Q HN 0.527 8.797 8.270 -0.000 0.000 0.471 300 N N -0.516 117.883 118.700 -0.503 0.000 2.205 300 N HA 0.075 4.817 4.740 0.003 0.000 0.201 300 N C 0.117 174.966 175.510 -1.102 0.000 1.128 300 N CA 0.195 52.795 53.050 -0.750 0.000 0.867 300 N CB 0.666 38.644 38.487 -0.848 0.000 0.996 300 N HN 0.350 8.730 8.380 -0.000 0.000 0.503 301 H N -0.615 118.112 119.070 -0.572 0.000 5.205 301 H HA 0.587 5.145 4.556 0.003 0.000 0.189 301 H C 0.657 175.726 175.328 -0.433 0.000 1.304 301 H CA 0.002 55.671 56.048 -0.631 0.000 0.223 301 H CB 0.242 29.276 29.762 -1.212 0.000 1.620 301 H HN 0.083 8.363 8.280 -0.000 0.000 0.316 302 G N 0.000 108.611 108.800 -0.315 0.000 5.446 302 G HA2 0.000 3.962 3.960 0.003 0.000 0.244 302 G HA3 0.000 3.962 3.960 0.003 0.000 0.244 302 G CA 0.000 45.103 45.100 0.005 0.000 0.502 302 G HN 0.000 8.290 8.290 -0.000 0.000 0.925