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 3l65_1_A DATA FIRST_RESID 2 DATA SEQUENCE SALFEPYTLK DVTLRNRIAI PPMAQYMAED GMINDWHHVH LAGLARGGAG DATA SEQUENCE LLVVEATAVA PEGRITPGCA GIWSDAHAQA FVPVVQAIKA AGSVPGIQIA DATA SEQUENCE HAGRKASANR PWEGDDHIAA DDTRGWETIA PSAIAFGAHL PKVPREMTLD DATA SEQUENCE DIARVKQDFV DAARRARDAG FEWIELHFAH GYLGQSFFSE HSNKRTDAYG DATA SEQUENCE GSFDNRSRFL LETLAAVREV WPENLPLTAR FGVLEYDGRD EQTLEESIEL DATA SEQUENCE ARRFKAGGLD LLSVSVGFTI PDTNIPWGPA FMGPIAERVR REAKLPVTSA DATA SEQUENCE WGFGTPQLAE AALQANQLDL VSVGRAHLAD PHWAYFAAKE LGVEKASWTL DATA SEQUENCE PAPYAHWLER Y 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 2 S HA 0.000 4.530 4.470 0.100 0.000 0.327 2 S C 0.000 174.680 174.600 0.133 0.000 1.055 2 S CA 0.000 58.279 58.200 0.131 0.000 1.107 2 S CB 0.000 63.332 63.200 0.221 0.000 0.593 3 A N 7.590 130.463 122.820 0.090 0.000 1.933 3 A HA -0.125 4.231 4.320 0.061 0.000 0.218 3 A C 1.258 178.856 177.584 0.024 0.000 1.175 3 A CA 2.933 55.005 52.037 0.058 0.000 0.628 3 A CB -0.202 18.822 19.000 0.039 0.000 0.814 3 A HN 0.910 9.495 8.150 0.080 -0.386 0.444 4 L N -2.160 119.067 121.223 0.008 0.000 2.191 4 L HA -0.240 4.003 4.340 -0.162 0.000 0.212 4 L C 0.006 176.636 176.870 -0.401 0.000 1.103 4 L CA 2.522 57.258 54.840 -0.174 0.000 0.769 4 L CB 0.009 41.960 42.059 -0.179 0.000 0.908 4 L HN -0.181 8.364 8.230 0.059 -0.279 0.438 5 F N -3.539 116.433 119.950 0.037 0.000 2.639 5 F HA 0.138 4.697 4.527 0.052 0.000 0.300 5 F C -0.029 175.800 175.800 0.049 0.000 1.109 5 F CA -1.048 56.977 58.000 0.042 0.000 1.335 5 F CB 0.305 39.323 39.000 0.029 0.000 1.014 5 F HN -0.832 7.563 8.300 0.207 0.029 0.537 6 E N 0.416 120.687 120.200 0.119 0.000 2.313 6 E HA 0.252 4.676 4.350 0.124 0.000 0.276 6 E C -1.745 174.918 176.600 0.105 0.000 1.031 6 E CA -2.395 54.071 56.400 0.110 0.000 0.857 6 E CB 0.241 29.996 29.700 0.091 0.000 1.040 6 E HN -0.592 7.764 8.360 0.076 0.050 0.408 7 P HA 0.067 4.695 4.420 0.130 -0.129 0.272 7 P C -1.843 175.579 177.300 0.203 0.000 1.240 7 P CA -0.422 62.758 63.100 0.134 0.000 0.791 7 P CB 1.058 32.821 31.700 0.104 0.000 0.978 8 Y N -0.919 119.410 120.300 0.048 0.000 2.386 8 Y HA 0.162 4.746 4.550 0.058 0.000 0.334 8 Y C -2.331 173.620 175.900 0.085 0.000 1.002 8 Y CA -1.105 57.033 58.100 0.063 0.000 1.068 8 Y CB 3.585 42.084 38.460 0.065 0.000 1.203 8 Y HN -0.017 8.406 8.280 0.239 0.000 0.443 9 T N 9.413 123.738 114.554 -0.381 0.000 2.797 9 T HA 0.735 5.181 4.350 -0.170 -0.197 0.279 9 T C -1.624 172.768 174.700 -0.515 0.000 0.991 9 T CA -0.579 61.337 62.100 -0.306 0.000 0.979 9 T CB 1.278 70.062 68.868 -0.141 0.000 0.943 9 T HN 0.176 8.179 8.240 -0.395 0.000 0.444 10 L N 8.157 129.211 121.223 -0.282 0.000 2.438 10 L HA 0.477 4.679 4.340 -0.230 0.000 0.270 10 L C -1.355 175.474 176.870 -0.068 0.000 0.972 10 L CA -1.135 53.590 54.840 -0.191 0.000 0.831 10 L CB 2.500 44.501 42.059 -0.096 0.000 1.273 10 L HN 0.292 8.441 8.230 -0.135 0.000 0.405 11 K N 3.063 123.422 120.400 -0.068 0.000 1.867 11 K HA -0.325 3.970 4.320 -0.041 0.000 0.140 11 K C -0.487 176.096 176.600 -0.028 0.000 1.408 11 K CA 2.035 58.298 56.287 -0.040 0.000 0.461 11 K CB -1.149 31.333 32.500 -0.029 0.000 0.594 11 K HN 0.438 8.641 8.250 -0.078 0.000 0.888 12 D N 1.448 121.840 120.400 -0.012 0.000 2.328 12 D HA 0.151 4.784 4.640 -0.013 0.000 0.226 12 D C -0.433 175.879 176.300 0.020 0.000 1.066 12 D CA 0.536 54.532 54.000 -0.006 0.000 0.861 12 D CB 0.402 41.192 40.800 -0.016 0.000 0.912 12 D HN -0.130 8.233 8.370 -0.011 0.000 0.521 13 V N 1.511 121.455 119.914 0.049 0.000 2.435 13 V HA 0.120 4.292 4.120 0.087 0.000 0.290 13 V C -1.365 174.780 176.094 0.085 0.000 1.030 13 V CA -0.465 61.896 62.300 0.101 0.000 0.881 13 V CB 1.932 33.880 31.823 0.209 0.000 0.983 13 V HN -0.431 7.720 8.190 0.044 0.066 0.445 14 T N 8.435 123.035 114.554 0.077 0.000 2.786 14 T HA 0.445 5.009 4.350 0.056 -0.180 0.283 14 T C -0.913 173.843 174.700 0.093 0.000 0.992 14 T CA -0.800 61.341 62.100 0.067 0.000 0.954 14 T CB 1.220 70.113 68.868 0.042 0.000 0.934 14 T HN 0.154 8.438 8.240 0.074 0.000 0.440 15 L N 5.156 126.454 121.223 0.125 0.000 2.312 15 L HA 0.201 4.586 4.340 0.074 0.000 0.281 15 L C 1.232 178.161 176.870 0.099 0.000 1.070 15 L CA -0.790 54.114 54.840 0.106 0.000 0.805 15 L CB 0.669 42.805 42.059 0.129 0.000 1.174 15 L HN 0.752 9.074 8.230 0.153 0.000 0.434 16 R N 2.561 123.108 120.500 0.078 0.000 2.235 16 R HA -0.312 4.083 4.340 0.093 0.000 0.213 16 R C -1.368 174.996 176.300 0.106 0.000 1.059 16 R CA 1.908 58.064 56.100 0.093 0.000 0.997 16 R CB 0.240 30.598 30.300 0.095 0.000 0.884 16 R HN 0.710 9.018 8.270 0.064 0.000 0.462 17 N N -5.839 112.901 118.700 0.067 0.000 3.277 17 N HA 0.081 5.021 4.740 0.030 -0.182 0.278 17 N C -0.415 175.065 175.510 -0.051 0.000 1.544 17 N CA -1.195 51.855 53.050 -0.000 0.000 0.869 17 N CB 2.250 40.688 38.487 -0.081 0.000 1.584 17 N HN -0.883 7.497 8.380 0.052 0.031 0.564 18 R N -3.624 116.792 120.500 -0.141 0.000 2.388 18 R HA 0.276 4.534 4.340 -0.137 0.000 0.247 18 R C -0.947 175.259 176.300 -0.158 0.000 0.931 18 R CA -1.895 54.113 56.100 -0.153 0.000 1.082 18 R CB -0.680 29.519 30.300 -0.167 0.000 1.135 18 R HN 0.100 8.243 8.270 -0.213 0.000 0.525 19 I N 0.594 121.086 120.570 -0.129 0.000 2.352 19 I HA 0.159 4.450 4.170 -0.028 -0.137 0.290 19 I C -1.865 174.211 176.117 -0.070 0.000 1.036 19 I CA 0.130 61.409 61.300 -0.035 0.000 1.336 19 I CB 0.378 38.446 38.000 0.113 0.000 1.407 19 I HN -0.340 8.018 8.210 -0.144 -0.234 0.497 20 A N 7.564 130.324 122.820 -0.101 0.000 2.330 20 A HA 0.732 5.101 4.320 -0.193 -0.166 0.327 20 A C -1.622 175.884 177.584 -0.130 0.000 1.155 20 A CA -2.459 49.483 52.037 -0.158 0.000 0.803 20 A CB 3.072 21.959 19.000 -0.189 0.000 1.208 20 A HN 0.551 8.643 8.150 -0.095 0.000 0.477 21 I N 3.512 123.969 120.570 -0.188 0.000 2.291 21 I HA 0.556 4.631 4.170 -0.159 0.000 0.292 21 I C -1.596 174.457 176.117 -0.106 0.000 1.064 21 I CA -2.945 58.238 61.300 -0.195 0.000 1.269 21 I CB 0.855 38.653 38.000 -0.338 0.000 1.418 21 I HN 0.272 8.355 8.210 -0.212 0.000 0.485 22 P HA 0.176 4.587 4.420 -0.016 0.000 0.274 22 P C -2.182 175.138 177.300 0.034 0.000 1.246 22 P CA -2.016 61.089 63.100 0.008 0.000 0.795 22 P CB -0.835 30.905 31.700 0.068 0.000 1.006 23 P HA -0.053 4.593 4.420 0.062 -0.189 0.264 23 P C -0.871 176.497 177.300 0.115 0.000 1.193 23 P CA 0.238 63.373 63.100 0.059 0.000 0.763 23 P CB 0.685 32.390 31.700 0.008 0.000 0.810 24 M N 2.996 122.683 119.600 0.145 0.000 2.060 24 M HA 0.182 4.765 4.480 0.172 0.000 0.275 24 M C -1.024 175.365 176.300 0.148 0.000 0.919 24 M CA -1.320 54.084 55.300 0.173 0.000 0.970 24 M CB 2.649 35.372 32.600 0.204 0.000 1.670 24 M HN 0.221 8.604 8.290 0.155 0.000 0.440 25 A N 4.422 127.278 122.820 0.060 0.000 2.587 25 A HA -0.258 4.140 4.320 -0.127 -0.154 0.235 25 A C 0.042 177.540 177.584 -0.142 0.000 1.044 25 A CA 0.813 52.745 52.037 -0.176 0.000 0.754 25 A CB 0.205 18.901 19.000 -0.505 0.000 0.968 25 A HN 0.193 8.393 8.150 0.083 0.000 0.509 26 Q N 1.770 121.499 119.800 -0.118 0.000 2.378 26 Q HA 0.004 4.463 4.340 0.198 0.000 0.229 26 Q C -0.128 175.994 176.000 0.203 0.000 0.882 26 Q CA -0.438 55.417 55.803 0.088 0.000 0.936 26 Q CB 1.231 30.034 28.738 0.108 0.000 1.092 26 Q HN 0.047 8.543 8.270 -0.108 -0.291 0.535 27 Y N -6.428 113.954 120.300 0.136 0.000 3.825 27 Y HA -0.395 4.221 4.550 0.055 -0.033 0.221 27 Y C -0.699 175.235 175.900 0.057 0.000 1.195 27 Y CA 1.051 59.183 58.100 0.052 0.000 1.699 27 Y CB -3.319 35.045 38.460 -0.161 0.000 1.531 27 Y HN -0.341 7.736 8.280 -0.338 0.000 0.640 28 M N -4.156 115.536 119.600 0.154 0.000 2.306 28 M HA 0.183 4.686 4.480 0.038 0.000 0.292 28 M C -0.759 175.707 176.300 0.278 0.000 1.018 28 M CA -1.273 54.065 55.300 0.062 0.000 1.007 28 M CB 0.369 32.755 32.600 -0.356 0.000 1.510 28 M HN -0.173 8.236 8.290 0.212 0.009 0.537 29 A N 0.247 123.261 122.820 0.323 0.000 2.287 29 A HA 0.076 4.642 4.320 0.261 -0.090 0.273 29 A C -1.253 176.417 177.584 0.144 0.000 1.091 29 A CA -0.964 51.202 52.037 0.216 0.000 0.817 29 A CB 2.268 21.312 19.000 0.073 0.000 1.069 29 A HN -0.164 8.162 8.150 0.294 0.000 0.492 30 E N -0.670 119.587 120.200 0.095 0.000 2.216 30 E HA 0.311 4.727 4.350 0.110 0.000 0.260 30 E C -0.433 176.221 176.600 0.090 0.000 0.880 30 E CA -1.562 54.893 56.400 0.092 0.000 0.765 30 E CB 2.619 32.360 29.700 0.069 0.000 1.174 30 E HN -0.390 8.007 8.360 0.061 0.000 0.417 31 D N 6.374 126.863 120.400 0.149 0.000 2.701 31 D HA -0.394 4.417 4.640 0.285 0.000 0.235 31 D C 0.281 176.756 176.300 0.292 0.000 1.155 31 D CA 1.197 55.343 54.000 0.243 0.000 0.649 31 D CB -0.269 40.655 40.800 0.207 0.000 1.050 31 D HN 1.075 9.536 8.370 0.152 0.000 0.425 32 G N -5.338 103.581 108.800 0.198 0.000 2.245 32 G HA2 -0.519 3.674 3.960 0.034 0.000 0.264 32 G HA3 -0.519 3.229 3.960 -0.353 0.000 0.264 32 G C -0.219 174.649 174.900 -0.053 0.000 0.985 32 G CA 0.476 45.566 45.100 -0.016 0.000 0.625 32 G HN 0.317 8.717 8.290 0.197 0.009 0.536 33 M N 2.780 122.315 119.600 -0.109 0.000 2.146 33 M HA 0.209 4.488 4.480 -0.335 0.000 0.352 33 M C -0.080 176.077 176.300 -0.238 0.000 1.343 33 M CA -0.884 54.263 55.300 -0.255 0.000 1.115 33 M CB -1.135 31.302 32.600 -0.272 0.000 1.657 33 M HN -0.363 7.718 8.290 -0.060 0.173 0.471 34 I N 1.312 121.626 120.570 -0.428 0.000 3.138 34 I HA -0.085 3.710 4.170 -0.626 0.000 0.288 34 I C -1.076 174.945 176.117 -0.161 0.000 1.148 34 I CA -0.011 60.959 61.300 -0.551 0.000 1.315 34 I CB 0.795 38.240 38.000 -0.924 0.000 1.426 34 I HN 0.289 8.183 8.210 -0.527 0.000 0.615 35 N N -0.047 118.755 118.700 0.171 0.000 3.439 35 N HA 0.161 4.941 4.740 0.066 0.000 0.313 35 N C -0.695 174.976 175.510 0.270 0.000 1.598 35 N CA -0.486 52.677 53.050 0.188 0.000 0.830 35 N CB 1.334 39.930 38.487 0.181 0.000 1.849 35 N HN -0.308 8.384 8.380 0.521 0.000 0.598 36 D N 0.684 121.194 120.400 0.182 0.000 2.310 36 D HA -0.183 4.552 4.640 0.157 0.000 0.212 36 D C 1.080 177.474 176.300 0.157 0.000 0.965 36 D CA 2.546 56.637 54.000 0.152 0.000 0.879 36 D CB -0.180 40.668 40.800 0.080 0.000 0.921 36 D HN 0.199 8.656 8.370 0.145 0.000 0.510 37 W N 0.502 121.840 121.300 0.063 0.000 2.315 37 W HA -0.497 4.146 4.660 -0.029 0.000 0.323 37 W C 1.140 177.628 176.519 -0.053 0.000 1.233 37 W CA 4.273 61.577 57.345 -0.069 0.000 1.267 37 W CB -0.056 29.252 29.460 -0.254 0.000 1.160 37 W HN -0.115 8.535 8.180 0.360 -0.254 0.474 38 H N -2.986 116.163 119.070 0.132 0.000 2.357 38 H HA -0.348 4.279 4.556 0.118 0.000 0.301 38 H C 2.254 177.611 175.328 0.049 0.000 1.082 38 H CA 4.521 60.640 56.048 0.118 0.000 1.342 38 H CB -0.245 29.632 29.762 0.192 0.000 1.389 38 H HN -0.654 7.803 8.280 0.296 0.000 0.511 39 H N 0.513 119.647 119.070 0.106 0.000 2.290 39 H HA -0.365 4.228 4.556 0.061 0.000 0.298 39 H C 2.182 177.491 175.328 -0.031 0.000 1.087 39 H CA 4.354 60.425 56.048 0.038 0.000 1.291 39 H CB 0.481 30.254 29.762 0.018 0.000 1.369 39 H HN -0.492 7.979 8.280 0.317 0.000 0.492 40 V N -1.856 118.044 119.914 -0.023 0.000 2.358 40 V HA -0.515 3.560 4.120 -0.075 0.000 0.246 40 V C 1.557 177.525 176.094 -0.211 0.000 1.047 40 V CA 4.233 66.464 62.300 -0.115 0.000 1.035 40 V CB 0.056 31.811 31.823 -0.114 0.000 0.658 40 V HN -0.572 7.631 8.190 0.021 0.000 0.452 41 H N 0.821 119.624 119.070 -0.445 0.000 2.319 41 H HA -0.324 3.989 4.556 -0.404 0.000 0.299 41 H C 2.077 177.296 175.328 -0.181 0.000 1.092 41 H CA 4.085 59.888 56.048 -0.408 0.000 1.302 41 H CB 0.164 29.579 29.762 -0.578 0.000 1.373 41 H HN -0.474 7.591 8.280 -0.359 0.000 0.497 42 L N -2.254 118.834 121.223 -0.225 0.000 2.044 42 L HA -0.315 3.823 4.340 -0.336 0.000 0.205 42 L C 2.089 178.838 176.870 -0.201 0.000 1.075 42 L CA 2.775 57.484 54.840 -0.219 0.000 0.747 42 L CB -0.282 41.764 42.059 -0.022 0.000 0.903 42 L HN -0.135 8.039 8.230 -0.093 0.000 0.435 43 A N -1.360 121.318 122.820 -0.237 0.000 1.933 43 A HA -0.325 3.890 4.320 -0.175 0.000 0.218 43 A C 2.049 179.566 177.584 -0.112 0.000 1.175 43 A CA 3.004 54.917 52.037 -0.206 0.000 0.628 43 A CB -0.827 17.988 19.000 -0.309 0.000 0.814 43 A HN 0.050 8.023 8.150 -0.294 0.000 0.444 44 G N -2.013 106.723 108.800 -0.106 0.000 2.402 44 G HA2 -0.294 3.695 3.960 0.048 0.000 0.216 44 G HA3 -0.294 3.651 3.960 -0.025 0.000 0.216 44 G C 1.330 176.245 174.900 0.025 0.000 1.162 44 G CA 1.584 46.677 45.100 -0.012 0.000 0.777 44 G HN -0.265 7.937 8.290 -0.147 0.000 0.539 45 L N 1.393 122.566 121.223 -0.084 0.000 2.046 45 L HA -0.328 4.034 4.340 0.036 0.000 0.208 45 L C 3.047 179.901 176.870 -0.027 0.000 1.077 45 L CA 2.592 57.394 54.840 -0.064 0.000 0.747 45 L CB -0.192 41.730 42.059 -0.229 0.000 0.896 45 L HN -0.566 7.556 8.230 -0.180 0.000 0.432 46 A N -0.554 122.230 122.820 -0.060 0.000 1.940 46 A HA -0.335 3.959 4.320 -0.044 0.000 0.219 46 A C 1.443 179.027 177.584 0.000 0.000 1.176 46 A CA 2.928 54.942 52.037 -0.039 0.000 0.631 46 A CB -0.724 18.243 19.000 -0.055 0.000 0.814 46 A HN -0.058 8.038 8.150 -0.090 0.000 0.446 47 R N -4.097 116.412 120.500 0.016 0.000 2.235 47 R HA -0.216 4.117 4.340 -0.012 0.000 0.213 47 R C 1.898 178.207 176.300 0.014 0.000 1.059 47 R CA 2.413 58.523 56.100 0.017 0.000 0.997 47 R CB -0.084 30.240 30.300 0.041 0.000 0.884 47 R HN -0.407 7.872 8.270 0.015 0.000 0.462 48 G N -5.678 103.181 108.800 0.098 0.000 2.598 48 G HA2 -0.066 3.829 3.960 -0.108 0.000 0.215 48 G HA3 -0.066 4.281 3.960 0.318 -0.197 0.215 48 G C -0.560 174.428 174.900 0.148 0.000 1.131 48 G CA 0.347 45.525 45.100 0.129 0.000 0.785 48 G HN -0.500 7.710 8.290 0.132 0.159 0.539 49 G N -2.406 106.473 108.800 0.131 0.000 2.255 49 G HA2 -0.301 3.732 3.960 0.123 0.000 0.196 49 G HA3 -0.301 3.784 3.960 0.208 0.000 0.196 49 G C -0.875 174.130 174.900 0.176 0.000 0.998 49 G CA -0.436 44.761 45.100 0.163 0.000 0.656 49 G HN -0.744 7.575 8.290 0.098 0.030 0.490 50 A N 1.215 124.129 122.820 0.158 0.000 2.483 50 A HA -0.082 4.320 4.320 0.138 0.000 0.238 50 A C 0.738 178.337 177.584 0.024 0.000 1.070 50 A CA 0.127 52.221 52.037 0.095 0.000 0.770 50 A CB 0.427 19.425 19.000 -0.002 0.000 1.008 50 A HN -0.454 7.792 8.150 0.160 0.000 0.497 51 G N -0.021 108.777 108.800 -0.002 0.000 2.421 51 G HA2 -0.110 3.857 3.960 0.011 0.000 0.217 51 G HA3 -0.110 3.839 3.960 -0.018 0.000 0.217 51 G C -1.491 173.359 174.900 -0.083 0.000 1.143 51 G CA 1.360 46.448 45.100 -0.020 0.000 0.784 51 G HN 0.225 8.703 8.290 -0.007 -0.191 0.541 52 L N -1.035 120.094 121.223 -0.157 0.000 2.436 52 L HA 0.610 4.946 4.340 -0.242 -0.140 0.268 52 L C -2.841 173.883 176.870 -0.243 0.000 0.974 52 L CA -0.262 54.414 54.840 -0.274 0.000 0.826 52 L CB 4.125 45.871 42.059 -0.522 0.000 1.291 52 L HN -0.759 7.383 8.230 -0.147 0.000 0.406 53 L N 7.090 128.193 121.223 -0.200 0.000 2.342 53 L HA 0.504 4.740 4.340 -0.174 0.000 0.276 53 L C -2.558 174.248 176.870 -0.106 0.000 0.997 53 L CA -1.291 53.460 54.840 -0.148 0.000 0.838 53 L CB 2.964 44.964 42.059 -0.099 0.000 1.224 53 L HN 0.419 8.544 8.230 -0.176 0.000 0.416 54 V N 8.374 128.218 119.914 -0.116 0.000 2.364 54 V HA 0.060 4.194 4.120 -0.047 -0.043 0.272 54 V C -1.044 175.054 176.094 0.006 0.000 1.036 54 V CA -0.887 61.374 62.300 -0.065 0.000 0.880 54 V CB 0.485 32.260 31.823 -0.080 0.000 0.991 54 V HN 0.424 8.535 8.190 -0.133 0.000 0.460 55 V N 8.091 128.031 119.914 0.043 0.000 2.788 55 V HA -0.202 4.014 4.120 0.160 0.000 0.307 55 V C 0.214 176.336 176.094 0.047 0.000 1.069 55 V CA 0.936 63.294 62.300 0.097 0.000 1.173 55 V CB 0.495 32.400 31.823 0.135 0.000 0.925 55 V HN 0.221 8.336 8.190 0.049 0.104 0.492 56 E N 6.536 126.807 120.200 0.119 0.000 2.485 56 E HA -0.272 4.190 4.350 0.083 -0.062 0.266 56 E C -0.513 176.109 176.600 0.037 0.000 1.090 56 E CA 0.789 57.244 56.400 0.092 0.000 0.987 56 E CB 0.074 29.851 29.700 0.128 0.000 0.974 56 E HN 0.253 8.724 8.360 0.185 0.000 0.455 57 A N 2.580 125.424 122.820 0.040 0.000 2.572 57 A HA -0.251 4.276 4.320 0.046 -0.179 0.256 57 A C -0.587 177.005 177.584 0.013 0.000 1.041 57 A CA 1.258 53.324 52.037 0.049 0.000 0.790 57 A CB -0.319 18.748 19.000 0.112 0.000 0.947 57 A HN 0.279 8.463 8.150 0.057 0.000 0.518 58 T N 7.164 121.704 114.554 -0.023 0.000 2.791 58 T HA 0.126 4.649 4.350 0.028 -0.156 0.288 58 T C -1.112 173.559 174.700 -0.048 0.000 0.999 58 T CA -0.225 61.863 62.100 -0.021 0.000 0.952 58 T CB 1.596 70.415 68.868 -0.081 0.000 0.938 58 T HN -0.162 8.050 8.240 -0.048 0.000 0.444 59 A N 7.116 129.940 122.820 0.007 0.000 2.477 59 A HA 0.252 4.709 4.320 -0.091 -0.192 0.246 59 A C 0.783 178.366 177.584 -0.002 0.000 1.078 59 A CA -0.727 51.301 52.037 -0.014 0.000 0.770 59 A CB 0.727 19.759 19.000 0.053 0.000 1.011 59 A HN 0.606 8.787 8.150 0.052 0.000 0.494 60 V N -2.752 117.067 119.914 -0.159 0.000 3.461 60 V HA -0.088 3.962 4.120 -0.117 0.000 0.267 60 V C -1.597 174.486 176.094 -0.018 0.000 1.186 60 V CA 1.042 63.241 62.300 -0.169 0.000 1.154 60 V CB 0.026 31.539 31.823 -0.516 0.000 0.802 60 V HN -0.093 7.952 8.190 -0.242 0.000 0.474 61 A N -2.471 120.300 122.820 -0.083 0.000 2.604 61 A HA 0.355 4.478 4.320 -0.329 0.000 0.295 61 A C -2.613 174.521 177.584 -0.749 0.000 1.067 61 A CA -1.327 50.518 52.037 -0.321 0.000 0.683 61 A CB 1.192 20.087 19.000 -0.175 0.000 1.281 61 A HN -0.682 7.339 8.150 -0.125 0.054 0.407 62 P HA -0.234 2.917 4.420 -2.115 0.000 0.215 62 P C 0.291 176.896 177.300 -1.158 0.000 1.153 62 P CA 2.460 64.575 63.100 -1.641 0.000 0.853 62 P CB 0.119 30.909 31.700 -1.516 0.000 0.788 63 E N -3.332 116.330 120.200 -0.896 0.000 2.482 63 E HA -0.175 3.267 4.350 -1.512 0.000 0.196 63 E C 0.732 177.149 176.600 -0.305 0.000 1.047 63 E CA 1.388 57.341 56.400 -0.746 0.000 0.869 63 E CB -2.225 27.309 29.700 -0.276 0.000 0.836 63 E HN 0.475 8.399 8.360 -0.727 0.000 0.520 64 G N -0.569 107.841 108.800 -0.649 0.000 3.042 64 G HA2 -0.040 3.272 3.960 -1.080 0.000 0.212 64 G HA3 -0.040 3.046 3.960 -1.457 0.000 0.212 64 G C -0.728 173.969 174.900 -0.338 0.000 1.166 64 G CA -0.858 43.666 45.100 -0.961 0.000 0.767 64 G HN -0.289 7.440 8.290 -0.664 0.163 0.546 65 R N 0.376 120.790 120.500 -0.144 0.000 2.679 65 R HA -0.154 4.197 4.340 0.019 0.000 0.268 65 R C 0.164 176.598 176.300 0.223 0.000 1.044 65 R CA 0.828 56.973 56.100 0.074 0.000 1.105 65 R CB 0.413 30.796 30.300 0.139 0.000 0.989 65 R HN -0.841 7.235 8.270 -0.265 0.036 0.447 66 I N 0.136 120.774 120.570 0.114 0.000 2.252 66 I HA -0.235 3.998 4.170 0.106 0.000 0.245 66 I C 0.043 176.276 176.117 0.193 0.000 1.102 66 I CA 2.957 64.332 61.300 0.124 0.000 1.385 66 I CB 0.522 38.578 38.000 0.094 0.000 1.064 66 I HN 0.280 8.520 8.210 0.049 0.000 0.414 67 T N -5.702 109.013 114.554 0.268 0.000 2.812 67 T HA 0.718 5.305 4.350 0.134 -0.157 0.294 67 T C -1.562 173.361 174.700 0.371 0.000 1.159 67 T CA -3.309 58.935 62.100 0.240 0.000 1.008 67 T CB 1.141 70.127 68.868 0.198 0.000 1.289 67 T HN -0.721 7.679 8.240 0.268 0.000 0.514 68 P HA 0.006 4.652 4.420 0.377 0.000 0.230 68 P C -0.273 177.153 177.300 0.210 0.000 1.158 68 P CA 1.318 64.595 63.100 0.295 0.000 0.769 68 P CB -0.081 31.750 31.700 0.218 0.000 0.807 69 G N -4.010 104.906 108.800 0.194 0.000 3.088 69 G HA2 0.118 4.373 3.960 0.165 0.000 0.217 69 G HA3 0.118 4.332 3.960 0.188 -0.142 0.217 69 G C -0.916 174.082 174.900 0.163 0.000 1.159 69 G CA -0.745 44.463 45.100 0.180 0.000 0.760 69 G HN -0.441 7.921 8.290 0.201 0.049 0.550 70 C N 1.547 120.940 119.300 0.155 0.000 2.601 70 C HA -0.081 4.390 4.460 0.019 0.000 0.409 70 C C -0.509 174.544 174.990 0.106 0.000 1.293 70 C CA 0.636 59.708 59.018 0.090 0.000 2.101 70 C CB 1.180 28.974 27.740 0.089 0.000 2.639 70 C HN -0.644 7.654 8.230 0.193 0.049 0.592 71 A N 3.399 126.262 122.820 0.070 0.000 2.425 71 A HA -0.083 4.355 4.320 -0.012 -0.125 0.242 71 A C -0.790 176.832 177.584 0.064 0.000 1.077 71 A CA 0.432 52.496 52.037 0.045 0.000 0.781 71 A CB 0.670 19.725 19.000 0.093 0.000 1.020 71 A HN 0.672 8.859 8.150 0.062 0.000 0.494 72 G N -0.378 108.396 108.800 -0.043 0.000 2.642 72 G HA2 0.806 4.977 3.960 0.002 0.000 0.293 72 G HA3 0.806 4.366 3.960 -0.665 0.000 0.293 72 G C -2.281 172.474 174.900 -0.242 0.000 1.341 72 G CA -0.443 44.521 45.100 -0.227 0.000 0.916 72 G HN -0.119 8.056 8.290 -0.068 0.075 0.474 73 I N -0.795 119.638 120.570 -0.228 0.000 3.114 73 I HA 0.514 4.657 4.170 -0.046 0.000 0.326 73 I C -1.735 174.310 176.117 -0.121 0.000 1.510 73 I CA -1.225 60.009 61.300 -0.110 0.000 0.918 73 I CB 2.101 40.079 38.000 -0.037 0.000 1.561 73 I HN 0.010 8.152 8.210 -0.114 0.000 0.565 74 W N -1.012 120.124 121.300 -0.274 0.000 3.353 74 W HA 0.256 4.827 4.660 -0.149 0.000 0.304 74 W C -1.358 175.096 176.519 -0.109 0.000 1.273 74 W CA -1.723 55.492 57.345 -0.216 0.000 1.773 74 W CB -0.512 28.779 29.460 -0.282 0.000 1.095 74 W HN -0.195 7.431 8.180 -0.923 0.000 0.676 75 S N -1.603 114.067 115.700 -0.050 0.000 2.607 75 S HA 0.137 4.688 4.470 0.136 0.000 0.273 75 S C -0.371 174.290 174.600 0.102 0.000 1.148 75 S CA -1.668 56.602 58.200 0.118 0.000 0.833 75 S CB 2.215 65.548 63.200 0.221 0.000 1.130 75 S HN -0.928 7.206 8.310 -0.203 0.054 0.470 76 D N 1.447 121.900 120.400 0.090 0.000 2.178 76 D HA -0.246 4.442 4.640 0.080 0.000 0.201 76 D C 1.627 177.957 176.300 0.051 0.000 0.980 76 D CA 3.564 57.606 54.000 0.072 0.000 0.842 76 D CB -0.402 40.433 40.800 0.057 0.000 0.948 76 D HN 0.485 8.908 8.370 0.090 0.000 0.472 77 A N -0.543 122.290 122.820 0.021 0.000 1.930 77 A HA -0.227 4.065 4.320 -0.047 0.000 0.217 77 A C 1.732 179.236 177.584 -0.133 0.000 1.175 77 A CA 2.515 54.515 52.037 -0.063 0.000 0.627 77 A CB -0.565 18.369 19.000 -0.111 0.000 0.815 77 A HN -0.417 7.756 8.150 0.039 0.000 0.443 78 H N -0.531 118.447 119.070 -0.154 0.000 2.352 78 H HA -0.226 4.182 4.556 -0.248 0.000 0.299 78 H C 2.272 177.605 175.328 0.009 0.000 1.097 78 H CA 4.118 60.047 56.048 -0.199 0.000 1.311 78 H CB -0.205 29.319 29.762 -0.397 0.000 1.377 78 H HN -0.607 7.693 8.280 0.034 0.000 0.504 79 A N -2.441 120.506 122.820 0.211 0.000 1.898 79 A HA -0.320 4.298 4.320 0.496 0.000 0.216 79 A C 1.853 179.596 177.584 0.265 0.000 1.181 79 A CA 2.863 55.085 52.037 0.308 0.000 0.620 79 A CB -0.580 18.533 19.000 0.188 0.000 0.819 79 A HN -0.540 7.706 8.150 0.159 0.000 0.442 80 Q N 0.191 120.060 119.800 0.115 0.000 2.135 80 Q HA -0.389 3.997 4.340 0.076 0.000 0.204 80 Q C 2.111 178.129 176.000 0.030 0.000 0.981 80 Q CA 3.013 58.852 55.803 0.060 0.000 0.856 80 Q CB -0.235 28.507 28.738 0.006 0.000 0.902 80 Q HN -0.117 8.201 8.270 0.079 0.000 0.425 81 A N -1.064 121.730 122.820 -0.043 0.000 2.019 81 A HA -0.184 4.061 4.320 -0.126 0.000 0.219 81 A C 1.470 178.954 177.584 -0.166 0.000 1.164 81 A CA 2.478 54.417 52.037 -0.162 0.000 0.644 81 A CB -0.793 18.019 19.000 -0.314 0.000 0.805 81 A HN -0.554 7.547 8.150 -0.053 0.017 0.449 82 F N -3.867 116.108 119.950 0.042 0.000 2.558 82 F HA -0.105 4.477 4.527 0.092 0.000 0.298 82 F C 1.053 176.852 175.800 -0.001 0.000 1.119 82 F CA 2.548 60.594 58.000 0.078 0.000 1.451 82 F CB 0.119 39.254 39.000 0.226 0.000 1.091 82 F HN -0.655 7.660 8.300 0.235 0.126 0.563 83 V N 1.475 121.472 119.914 0.139 0.000 2.287 83 V HA -0.311 3.816 4.120 0.012 0.000 0.248 83 V C -0.856 175.256 176.094 0.030 0.000 1.053 83 V CA 6.102 68.430 62.300 0.048 0.000 1.027 83 V CB -2.148 29.696 31.823 0.035 0.000 0.646 83 V HN -0.612 7.512 8.190 0.131 0.145 0.447 84 P HA -0.122 4.332 4.420 0.058 0.000 0.218 84 P C 1.558 178.958 177.300 0.167 0.000 1.149 84 P CA 3.009 66.160 63.100 0.085 0.000 0.817 84 P CB -0.370 31.355 31.700 0.042 0.000 0.785 85 V N -1.823 118.198 119.914 0.178 0.000 2.323 85 V HA -0.373 3.773 4.120 0.043 0.000 0.244 85 V C 2.181 178.267 176.094 -0.012 0.000 1.041 85 V CA 3.661 66.026 62.300 0.107 0.000 1.025 85 V CB -0.109 31.816 31.823 0.170 0.000 0.656 85 V HN -0.942 7.335 8.190 0.166 0.013 0.451 86 V N 0.406 120.274 119.914 -0.077 0.000 2.287 86 V HA -0.647 3.316 4.120 -0.262 0.000 0.248 86 V C 1.894 177.914 176.094 -0.124 0.000 1.053 86 V CA 4.805 66.965 62.300 -0.232 0.000 1.027 86 V CB -0.410 31.133 31.823 -0.468 0.000 0.646 86 V HN -0.148 8.011 8.190 -0.051 0.000 0.447 87 Q N -1.547 118.214 119.800 -0.065 0.000 2.124 87 Q HA -0.378 3.934 4.340 -0.047 0.000 0.202 87 Q C 2.420 178.407 176.000 -0.021 0.000 0.977 87 Q CA 3.286 59.068 55.803 -0.034 0.000 0.850 87 Q CB -0.302 28.430 28.738 -0.010 0.000 0.901 87 Q HN -0.334 7.908 8.270 -0.047 0.000 0.429 88 A N 0.002 122.814 122.820 -0.013 0.000 1.930 88 A HA -0.209 4.103 4.320 -0.013 0.000 0.217 88 A C 2.085 179.629 177.584 -0.066 0.000 1.175 88 A CA 2.881 54.895 52.037 -0.038 0.000 0.627 88 A CB -0.757 18.184 19.000 -0.099 0.000 0.815 88 A HN -0.405 7.666 8.150 0.003 0.082 0.443 89 I N -1.581 118.945 120.570 -0.074 0.000 2.202 89 I HA -0.630 3.502 4.170 -0.065 0.000 0.242 89 I C 1.783 177.876 176.117 -0.040 0.000 1.091 89 I CA 4.166 65.430 61.300 -0.059 0.000 1.368 89 I CB -0.131 37.840 38.000 -0.048 0.000 1.058 89 I HN -0.288 7.875 8.210 -0.078 0.000 0.410 90 K N -0.683 119.694 120.400 -0.039 0.000 2.057 90 K HA -0.251 4.197 4.320 -0.015 -0.136 0.207 90 K C 3.233 179.823 176.600 -0.018 0.000 1.049 90 K CA 3.150 59.422 56.287 -0.024 0.000 0.931 90 K CB -0.188 32.296 32.500 -0.027 0.000 0.714 90 K HN -0.405 7.815 8.250 -0.050 0.000 0.440 91 A N -0.434 122.374 122.820 -0.021 0.000 1.978 91 A HA -0.157 4.155 4.320 -0.013 0.000 0.220 91 A C 1.269 178.842 177.584 -0.018 0.000 1.170 91 A CA 2.638 54.665 52.037 -0.017 0.000 0.636 91 A CB -0.834 18.156 19.000 -0.015 0.000 0.810 91 A HN -0.217 7.918 8.150 -0.025 0.000 0.448 92 A N -4.673 118.133 122.820 -0.024 0.000 2.238 92 A HA 0.067 4.371 4.320 -0.027 0.000 0.208 92 A C -0.282 177.297 177.584 -0.007 0.000 1.177 92 A CA -0.256 51.767 52.037 -0.023 0.000 0.804 92 A CB 0.377 19.358 19.000 -0.031 0.000 0.823 92 A HN -0.441 7.576 8.150 -0.028 0.116 0.482 93 G N -3.526 105.273 108.800 -0.001 0.000 2.157 93 G HA2 -0.444 3.524 3.960 0.013 0.000 0.248 93 G HA3 -0.444 3.528 3.960 0.020 0.000 0.248 93 G C -0.578 174.331 174.900 0.015 0.000 0.979 93 G CA 0.022 45.130 45.100 0.013 0.000 0.650 93 G HN -0.173 7.943 8.290 -0.006 0.171 0.529 94 S N -0.116 115.585 115.700 0.001 0.000 2.646 94 S HA 0.111 4.579 4.470 -0.002 0.000 0.276 94 S C -0.491 174.105 174.600 -0.006 0.000 1.222 94 S CA -0.764 57.431 58.200 -0.008 0.000 1.014 94 S CB 1.480 64.664 63.200 -0.027 0.000 0.991 94 S HN -0.830 7.430 8.310 -0.006 0.046 0.533 95 V N 3.842 123.746 119.914 -0.016 0.000 2.461 95 V HA 0.263 4.408 4.120 0.042 0.000 0.275 95 V C -1.868 174.236 176.094 0.016 0.000 1.047 95 V CA -2.538 59.771 62.300 0.015 0.000 0.955 95 V CB 0.566 32.403 31.823 0.022 0.000 0.988 95 V HN -0.141 8.027 8.190 -0.038 0.000 0.471 96 P HA 0.373 4.867 4.420 0.124 0.000 0.287 96 P C -1.075 176.451 177.300 0.377 0.000 1.294 96 P CA -0.921 62.276 63.100 0.162 0.000 0.776 96 P CB 0.346 32.068 31.700 0.037 0.000 0.889 97 G N 1.728 110.711 108.800 0.305 0.000 2.600 97 G HA2 0.929 5.344 3.960 0.454 0.000 0.303 97 G HA3 0.929 4.985 3.960 0.160 0.000 0.303 97 G C -2.847 172.082 174.900 0.048 0.000 1.253 97 G CA -1.982 43.293 45.100 0.291 0.000 0.974 97 G HN 0.513 8.910 8.290 0.178 0.000 0.483 98 I N -1.560 118.861 120.570 -0.248 0.000 2.692 98 I HA 0.279 4.233 4.170 -0.360 0.000 0.293 98 I C -2.986 172.933 176.117 -0.329 0.000 1.200 98 I CA -1.220 59.767 61.300 -0.520 0.000 1.036 98 I CB 4.088 41.295 38.000 -1.321 0.000 1.258 98 I HN -0.133 7.992 8.210 -0.143 0.000 0.421 99 Q N 8.751 128.410 119.800 -0.235 0.000 2.303 99 Q HA 0.649 5.098 4.340 -0.186 -0.221 0.257 99 Q C -0.882 175.017 176.000 -0.168 0.000 0.941 99 Q CA -1.785 53.913 55.803 -0.175 0.000 0.931 99 Q CB 2.117 30.779 28.738 -0.126 0.000 1.215 99 Q HN -0.084 8.064 8.270 -0.204 0.000 0.437 100 I N 1.341 121.818 120.570 -0.155 0.000 2.437 100 I HA 0.892 5.146 4.170 -0.153 -0.175 0.298 100 I C -2.261 173.882 176.117 0.043 0.000 0.984 100 I CA -2.336 58.889 61.300 -0.125 0.000 1.214 100 I CB 2.366 40.249 38.000 -0.195 0.000 1.365 100 I HN 0.106 8.214 8.210 -0.171 0.000 0.469 101 A N 2.525 125.322 122.820 -0.038 0.000 2.587 101 A HA 0.459 5.000 4.320 0.367 0.000 0.293 101 A C -2.797 174.822 177.584 0.058 0.000 1.087 101 A CA -0.939 51.184 52.037 0.143 0.000 0.692 101 A CB 3.722 22.803 19.000 0.136 0.000 1.291 101 A HN 0.068 8.116 8.150 -0.169 0.000 0.407 102 H N 0.086 119.251 119.070 0.158 0.000 3.096 102 H HA 0.354 5.073 4.556 0.037 -0.141 0.335 102 H C -1.274 174.132 175.328 0.130 0.000 0.990 102 H CA -0.204 55.925 56.048 0.134 0.000 1.393 102 H CB 3.307 33.240 29.762 0.284 0.000 1.742 102 H HN 0.515 9.043 8.280 0.413 0.000 0.501 103 A N 7.244 130.103 122.820 0.064 0.000 2.206 103 A HA -0.099 4.162 4.320 -0.099 0.000 0.211 103 A C -0.218 177.616 177.584 0.415 0.000 1.158 103 A CA 0.217 52.305 52.037 0.085 0.000 0.761 103 A CB 0.583 19.541 19.000 -0.070 0.000 0.801 103 A HN 0.168 8.110 8.150 -0.147 0.120 0.473 104 G N -1.158 107.979 108.800 0.560 0.000 2.611 104 G HA2 -0.513 3.817 3.960 0.391 0.000 0.301 104 G HA3 -0.513 3.651 3.960 0.339 0.000 0.301 104 G C 0.822 175.895 174.900 0.288 0.000 1.233 104 G CA 1.215 46.555 45.100 0.400 0.000 0.993 104 G HN -0.543 8.242 8.290 0.882 0.034 0.553 105 R N 2.154 122.782 120.500 0.213 0.000 2.280 105 R HA -0.197 4.238 4.340 0.158 0.000 0.207 105 R C 1.309 177.747 176.300 0.230 0.000 1.043 105 R CA 2.225 58.434 56.100 0.181 0.000 1.006 105 R CB -0.489 29.897 30.300 0.143 0.000 0.885 105 R HN 0.445 8.831 8.270 0.194 0.000 0.467 106 K N -1.793 118.737 120.400 0.216 0.000 2.458 106 K HA -0.059 4.242 4.320 -0.032 0.000 0.194 106 K C -0.256 176.450 176.600 0.177 0.000 1.024 106 K CA -0.018 56.341 56.287 0.119 0.000 1.108 106 K CB -0.456 32.108 32.500 0.108 0.000 0.846 106 K HN -0.570 7.802 8.250 0.267 0.038 0.518 107 A N -0.713 122.241 122.820 0.223 0.000 2.310 107 A HA 0.017 4.624 4.320 0.154 -0.194 0.260 107 A C -0.611 176.916 177.584 -0.094 0.000 1.112 107 A CA -0.633 51.495 52.037 0.152 0.000 0.804 107 A CB 1.848 21.038 19.000 0.316 0.000 1.081 107 A HN -0.663 7.577 8.150 0.249 0.060 0.499 108 S N -4.542 110.810 115.700 -0.581 0.000 3.706 108 S HA -0.487 2.778 4.470 -2.009 0.000 0.363 108 S C -1.655 172.698 174.600 -0.412 0.000 0.999 108 S CA 0.118 57.572 58.200 -1.243 0.000 1.143 108 S CB -1.011 61.295 63.200 -1.491 0.000 0.902 108 S HN 0.354 8.424 8.310 -0.400 0.000 0.476 109 A N -1.136 121.553 122.820 -0.218 0.000 2.330 109 A HA 0.591 4.986 4.320 -0.078 -0.121 0.329 109 A C -1.172 176.335 177.584 -0.128 0.000 1.135 109 A CA -2.020 49.947 52.037 -0.117 0.000 0.817 109 A CB 3.188 22.113 19.000 -0.124 0.000 1.269 109 A HN -0.135 7.894 8.150 -0.202 0.000 0.469 110 N N 0.344 118.964 118.700 -0.134 0.000 2.415 110 N HA -0.055 4.592 4.740 -0.155 0.000 0.248 110 N C 0.497 175.839 175.510 -0.280 0.000 1.271 110 N CA 1.586 54.531 53.050 -0.174 0.000 0.913 110 N CB 1.054 39.445 38.487 -0.160 0.000 1.129 110 N HN 0.080 8.388 8.380 -0.119 0.000 0.444 111 R N 1.353 121.598 120.500 -0.424 0.000 2.756 111 R HA -0.076 3.725 4.340 -0.899 0.000 0.264 111 R C -0.330 175.445 176.300 -0.876 0.000 1.026 111 R CA 0.827 56.411 56.100 -0.860 0.000 1.121 111 R CB -1.119 28.468 30.300 -1.188 0.000 0.999 111 R HN 0.362 8.412 8.270 -0.366 0.000 0.449 112 P HA -0.083 4.309 4.420 -0.366 -0.192 0.220 112 P C 0.136 177.295 177.300 -0.236 0.000 1.148 112 P CA 2.343 65.145 63.100 -0.497 0.000 0.803 112 P CB 0.242 31.721 31.700 -0.368 0.000 0.782 113 W N -5.514 115.654 121.300 -0.219 0.000 3.316 113 W HA 0.284 4.867 4.660 -0.129 0.000 0.327 113 W C -0.446 176.004 176.519 -0.116 0.000 1.232 113 W CA -0.613 56.644 57.345 -0.147 0.000 1.805 113 W CB -0.660 28.719 29.460 -0.135 0.000 1.090 113 W HN -0.043 7.600 8.180 -0.866 0.018 0.654 114 E N -0.055 119.988 120.200 -0.261 0.000 2.869 114 E HA 0.203 4.511 4.350 -0.069 0.000 0.207 114 E C -0.412 176.103 176.600 -0.142 0.000 0.986 114 E CA -1.225 55.070 56.400 -0.175 0.000 1.131 114 E CB -0.023 29.526 29.700 -0.253 0.000 1.098 114 E HN -0.536 7.381 8.360 -0.431 0.184 0.459 115 G N -1.873 106.857 108.800 -0.116 0.000 2.391 115 G HA2 -0.273 3.652 3.960 -0.059 0.000 0.204 115 G HA3 -0.273 3.642 3.960 -0.074 0.000 0.204 115 G C -0.497 174.349 174.900 -0.090 0.000 1.012 115 G CA -0.213 44.838 45.100 -0.083 0.000 0.651 115 G HN -0.425 7.799 8.290 -0.110 0.000 0.494 116 D N -2.480 117.834 120.400 -0.142 0.000 3.077 116 D HA -0.386 4.281 4.640 -0.182 -0.136 0.217 116 D C -1.532 174.765 176.300 -0.004 0.000 1.162 116 D CA 1.405 55.332 54.000 -0.122 0.000 0.943 116 D CB -0.642 40.080 40.800 -0.129 0.000 1.122 116 D HN -0.331 7.922 8.370 -0.194 0.000 0.413 117 D N -5.620 114.766 120.400 -0.024 0.000 2.414 117 D HA 0.108 4.865 4.640 0.035 -0.096 0.241 117 D C -0.591 175.669 176.300 -0.066 0.000 1.008 117 D CA -1.505 52.493 54.000 -0.003 0.000 1.001 117 D CB 1.687 42.511 40.800 0.039 0.000 1.277 117 D HN -0.652 7.637 8.370 -0.056 0.047 0.538 118 H N -1.393 117.623 119.070 -0.091 0.000 2.972 118 H HA -0.209 4.356 4.556 -0.175 -0.114 0.343 118 H C 0.697 175.946 175.328 -0.131 0.000 1.054 118 H CA 1.387 57.352 56.048 -0.139 0.000 1.412 118 H CB 0.691 30.373 29.762 -0.133 0.000 1.385 118 H HN -0.390 7.840 8.280 -0.083 0.000 0.600 119 I N 3.141 123.697 120.570 -0.023 0.000 2.648 119 I HA -0.213 3.919 4.170 -0.063 0.000 0.284 119 I C 0.114 176.185 176.117 -0.075 0.000 1.153 119 I CA 0.560 61.810 61.300 -0.083 0.000 1.426 119 I CB 0.775 38.681 38.000 -0.156 0.000 1.381 119 I HN -0.320 7.860 8.210 -0.049 0.000 0.571 120 A N 6.853 129.643 122.820 -0.050 0.000 2.507 120 A HA -0.135 4.163 4.320 -0.037 0.000 0.235 120 A C 0.864 178.417 177.584 -0.052 0.000 1.070 120 A CA 0.301 52.314 52.037 -0.041 0.000 0.768 120 A CB 0.792 19.776 19.000 -0.025 0.000 1.011 120 A HN 0.266 8.390 8.150 -0.043 0.000 0.502 121 A N 0.586 123.378 122.820 -0.047 0.000 1.972 121 A HA -0.195 4.087 4.320 -0.063 0.000 0.219 121 A C -0.009 177.558 177.584 -0.028 0.000 1.169 121 A CA 2.263 54.272 52.037 -0.047 0.000 0.635 121 A CB -0.136 18.841 19.000 -0.039 0.000 0.810 121 A HN 0.466 8.591 8.150 -0.041 0.000 0.446 122 D N -6.145 114.243 120.400 -0.020 0.000 2.368 122 D HA 0.012 4.649 4.640 -0.006 0.000 0.218 122 D C -0.923 175.375 176.300 -0.004 0.000 1.112 122 D CA -1.176 52.818 54.000 -0.009 0.000 0.834 122 D CB -0.687 40.109 40.800 -0.006 0.000 0.953 122 D HN -0.279 8.055 8.370 -0.021 0.023 0.505 123 D N 1.221 121.615 120.400 -0.010 0.000 2.317 123 D HA 0.059 4.701 4.640 0.002 0.000 0.252 123 D C 1.358 177.666 176.300 0.013 0.000 1.174 123 D CA -0.154 53.845 54.000 -0.002 0.000 0.866 123 D CB 1.629 42.419 40.800 -0.016 0.000 1.127 123 D HN -0.652 7.651 8.370 -0.019 0.056 0.467 124 T N 3.601 118.171 114.554 0.026 0.000 3.098 124 T HA -0.100 4.275 4.350 0.041 0.000 0.266 124 T C 1.003 175.747 174.700 0.072 0.000 1.145 124 T CA 2.021 64.147 62.100 0.043 0.000 1.092 124 T CB -0.323 68.569 68.868 0.039 0.000 0.908 124 T HN 0.427 8.681 8.240 0.023 0.000 0.526 125 R N 1.224 121.769 120.500 0.075 0.000 2.240 125 R HA 0.042 4.474 4.340 0.153 0.000 0.203 125 R C 0.750 177.173 176.300 0.205 0.000 1.011 125 R CA 1.008 57.188 56.100 0.132 0.000 1.007 125 R CB 0.613 30.974 30.300 0.103 0.000 0.911 125 R HN -0.345 8.209 8.270 0.050 -0.253 0.468 126 G N -1.976 106.877 108.800 0.088 0.000 2.580 126 G HA2 0.121 3.971 3.960 -0.183 0.000 0.278 126 G HA3 0.121 4.009 3.960 -0.119 0.000 0.278 126 G C -1.521 173.487 174.900 0.180 0.000 1.212 126 G CA -0.666 44.420 45.100 -0.023 0.000 0.939 126 G HN -0.607 7.678 8.290 0.049 0.035 0.513 127 W N -3.406 117.868 121.300 -0.044 0.000 3.066 127 W HA 0.314 4.944 4.660 -0.049 0.000 0.330 127 W C -2.277 174.205 176.519 -0.063 0.000 1.253 127 W CA -2.166 55.148 57.345 -0.053 0.000 1.187 127 W CB 0.965 30.387 29.460 -0.062 0.000 1.434 127 W HN -0.228 7.657 8.180 -0.492 0.000 0.572 128 E N 2.180 122.506 120.200 0.209 0.000 2.344 128 E HA -0.074 4.269 4.350 -0.010 0.000 0.270 128 E C -0.700 176.016 176.600 0.193 0.000 1.021 128 E CA 0.040 56.499 56.400 0.098 0.000 0.887 128 E CB 1.460 31.205 29.700 0.075 0.000 0.997 128 E HN 0.043 8.546 8.360 0.239 0.000 0.429 129 T N 0.208 114.798 114.554 0.060 0.000 2.918 129 T HA 0.169 4.667 4.350 0.247 0.000 0.283 129 T C -0.933 173.833 174.700 0.111 0.000 1.001 129 T CA -1.473 60.700 62.100 0.123 0.000 1.041 129 T CB 1.649 70.535 68.868 0.031 0.000 1.028 129 T HN -0.076 8.144 8.240 -0.033 0.000 0.511 130 I N -5.841 114.824 120.570 0.157 0.000 2.740 130 I HA 0.943 5.308 4.170 0.048 -0.166 0.303 130 I C -2.399 173.747 176.117 0.049 0.000 1.044 130 I CA -2.359 58.993 61.300 0.086 0.000 1.064 130 I CB 4.115 42.164 38.000 0.081 0.000 1.249 130 I HN 0.165 8.515 8.210 0.232 0.000 0.433 131 A N 1.027 123.821 122.820 -0.043 0.000 2.564 131 A HA 0.539 4.768 4.320 -0.151 0.000 0.291 131 A C -3.162 174.239 177.584 -0.306 0.000 1.102 131 A CA -0.969 50.981 52.037 -0.144 0.000 0.660 131 A CB 1.416 20.367 19.000 -0.082 0.000 1.283 131 A HN 0.085 8.204 8.150 -0.053 0.000 0.430 132 P HA -0.111 3.866 4.420 -0.739 0.000 0.218 132 P C -0.524 176.585 177.300 -0.318 0.000 1.149 132 P CA 1.922 64.570 63.100 -0.753 0.000 0.817 132 P CB 0.665 31.618 31.700 -1.246 0.000 0.785 133 S N -2.194 113.371 115.700 -0.224 0.000 2.564 133 S HA 0.220 4.631 4.470 -0.099 0.000 0.274 133 S C -1.465 173.089 174.600 -0.077 0.000 1.124 133 S CA -1.680 56.448 58.200 -0.119 0.000 0.869 133 S CB 3.141 66.283 63.200 -0.098 0.000 1.105 133 S HN -0.425 7.729 8.310 -0.234 0.016 0.472 134 A N 4.365 127.156 122.820 -0.049 0.000 3.037 134 A HA 0.086 4.552 4.320 -0.029 -0.163 0.272 134 A C -0.995 176.577 177.584 -0.019 0.000 1.723 134 A CA -0.300 51.719 52.037 -0.030 0.000 1.413 134 A CB -1.005 17.981 19.000 -0.024 0.000 1.112 134 A HN 0.670 8.793 8.150 -0.045 0.000 0.606 135 I N -0.028 120.535 120.570 -0.013 0.000 2.571 135 I HA 0.203 4.373 4.170 -0.000 0.000 0.289 135 I C -2.434 173.700 176.117 0.028 0.000 1.115 135 I CA -0.767 60.533 61.300 0.001 0.000 1.045 135 I CB 3.549 41.546 38.000 -0.005 0.000 1.238 135 I HN -0.408 7.754 8.210 -0.015 0.040 0.424 136 A N 7.517 130.360 122.820 0.038 0.000 2.371 136 A HA 0.082 4.469 4.320 0.112 0.000 0.257 136 A C -0.695 176.954 177.584 0.108 0.000 1.089 136 A CA -0.195 51.893 52.037 0.086 0.000 0.794 136 A CB 0.735 19.781 19.000 0.076 0.000 1.029 136 A HN -0.059 8.105 8.150 0.023 0.000 0.488 137 F N 3.861 123.816 119.950 0.007 0.000 2.095 137 F HA -0.397 4.121 4.527 -0.016 0.000 0.298 137 F C 0.727 176.508 175.800 -0.032 0.000 1.104 137 F CA 2.320 60.306 58.000 -0.022 0.000 1.232 137 F CB 0.983 39.947 39.000 -0.060 0.000 0.987 137 F HN 0.366 8.859 8.300 0.322 0.000 0.475 138 G N -3.823 105.053 108.800 0.127 0.000 2.526 138 G HA2 -0.296 3.692 3.960 0.046 0.000 0.250 138 G HA3 -0.296 3.618 3.960 -0.077 0.000 0.250 138 G C -1.835 173.144 174.900 0.132 0.000 1.289 138 G CA -1.128 43.992 45.100 0.033 0.000 0.947 138 G HN -0.760 7.662 8.290 0.221 0.000 0.517 139 A N -0.825 122.048 122.820 0.088 0.000 5.395 139 A HA -0.292 4.108 4.320 0.133 0.000 0.324 139 A C -0.599 177.096 177.584 0.184 0.000 1.813 139 A CA 2.203 54.346 52.037 0.177 0.000 0.714 139 A CB -1.809 17.385 19.000 0.324 0.000 1.374 139 A HN 0.367 8.541 8.150 0.039 0.000 0.390 140 H N -1.880 117.253 119.070 0.106 0.000 2.556 140 H HA -0.046 4.525 4.556 0.025 0.000 0.268 140 H C -0.871 174.435 175.328 -0.035 0.000 0.996 140 H CA 0.973 57.037 56.048 0.026 0.000 1.157 140 H CB -0.076 29.677 29.762 -0.014 0.000 1.355 140 H HN 0.044 8.711 8.280 0.645 0.000 0.597 141 L N 0.743 121.744 121.223 -0.371 0.000 2.679 141 L HA 0.631 4.625 4.340 -0.577 0.000 0.238 141 L C -2.098 174.855 176.870 0.138 0.000 1.330 141 L CA -2.841 51.754 54.840 -0.410 0.000 0.935 141 L CB 0.184 41.776 42.059 -0.778 0.000 1.243 141 L HN -0.123 7.905 8.230 -0.234 0.062 0.484 142 P HA -0.011 4.485 4.420 0.126 0.000 0.245 142 P C -0.488 176.889 177.300 0.128 0.000 1.206 142 P CA -0.240 62.953 63.100 0.154 0.000 0.781 142 P CB -0.035 31.720 31.700 0.091 0.000 0.994 143 K N 0.408 120.888 120.400 0.132 0.000 2.412 143 K HA -0.153 4.103 4.320 -0.106 0.000 0.281 143 K C -0.330 176.236 176.600 -0.056 0.000 1.027 143 K CA 0.540 56.741 56.287 -0.143 0.000 0.989 143 K CB 0.148 32.296 32.500 -0.587 0.000 0.935 143 K HN -0.557 7.900 8.250 0.412 0.040 0.475 144 V N 4.823 124.707 119.914 -0.050 0.000 2.455 144 V HA -0.007 4.114 4.120 0.002 0.000 0.273 144 V C -0.971 175.100 176.094 -0.040 0.000 1.045 144 V CA -1.969 60.317 62.300 -0.023 0.000 0.976 144 V CB 0.026 31.837 31.823 -0.019 0.000 0.993 144 V HN 0.142 8.297 8.190 -0.057 0.000 0.475 145 P HA 0.184 4.673 4.420 -0.024 -0.083 0.274 145 P C -1.406 175.885 177.300 -0.015 0.000 1.246 145 P CA -1.171 61.921 63.100 -0.014 0.000 0.795 145 P CB 1.199 32.906 31.700 0.011 0.000 1.006 146 R N 0.115 120.612 120.500 -0.006 0.000 2.340 146 R HA 0.051 4.384 4.340 -0.012 0.000 0.300 146 R C -0.956 175.333 176.300 -0.019 0.000 1.069 146 R CA -0.798 55.297 56.100 -0.008 0.000 0.984 146 R CB 1.441 31.744 30.300 0.005 0.000 1.003 146 R HN 0.026 8.299 8.270 0.005 0.000 0.459 147 E N 6.529 126.713 120.200 -0.027 0.000 2.366 147 E HA -0.122 4.336 4.350 -0.065 -0.147 0.266 147 E C -0.268 176.315 176.600 -0.028 0.000 1.015 147 E CA 0.450 56.825 56.400 -0.041 0.000 0.906 147 E CB 0.440 30.120 29.700 -0.034 0.000 0.979 147 E HN 0.295 8.641 8.360 -0.022 0.000 0.443 148 M N 8.632 128.209 119.600 -0.039 0.000 2.239 148 M HA -0.091 4.542 4.480 -0.009 -0.158 0.348 148 M C 1.024 177.322 176.300 -0.004 0.000 1.239 148 M CA 1.681 56.972 55.300 -0.015 0.000 1.114 148 M CB 0.634 33.233 32.600 -0.001 0.000 1.641 148 M HN -0.036 8.214 8.290 -0.068 0.000 0.453 149 T N 2.424 116.978 114.554 -0.001 0.000 2.816 149 T HA 0.143 4.500 4.350 0.012 0.000 0.282 149 T C 0.902 175.597 174.700 -0.008 0.000 0.993 149 T CA -1.120 60.983 62.100 0.005 0.000 0.994 149 T CB 1.797 70.670 68.868 0.008 0.000 1.025 149 T HN 0.418 8.983 8.240 -0.000 -0.325 0.529 150 L N -0.008 121.218 121.223 0.005 0.000 2.079 150 L HA -0.376 3.932 4.340 -0.054 0.000 0.210 150 L C 1.923 178.786 176.870 -0.013 0.000 1.081 150 L CA 3.713 58.549 54.840 -0.007 0.000 0.752 150 L CB -0.482 41.606 42.059 0.048 0.000 0.896 150 L HN 0.240 8.482 8.230 0.021 0.000 0.433 151 D N -1.784 118.618 120.400 0.004 0.000 2.144 151 D HA -0.282 4.365 4.640 0.011 0.000 0.200 151 D C 2.000 178.302 176.300 0.004 0.000 0.978 151 D CA 3.445 57.450 54.000 0.007 0.000 0.833 151 D CB -0.307 40.500 40.800 0.012 0.000 0.961 151 D HN -0.265 8.111 8.370 0.009 0.000 0.470 152 D N -0.001 120.398 120.400 -0.002 0.000 2.117 152 D HA -0.263 4.384 4.640 0.011 0.000 0.197 152 D C 2.604 178.903 176.300 -0.002 0.000 0.987 152 D CA 3.536 57.537 54.000 0.002 0.000 0.829 152 D CB -0.176 40.623 40.800 -0.001 0.000 0.961 152 D HN -0.368 7.921 8.370 -0.003 0.080 0.460 153 I N -0.234 120.310 120.570 -0.044 0.000 2.179 153 I HA -0.480 3.668 4.170 -0.036 0.000 0.242 153 I C 1.730 177.841 176.117 -0.010 0.000 1.088 153 I CA 4.204 65.455 61.300 -0.081 0.000 1.357 153 I CB -0.194 37.601 38.000 -0.341 0.000 1.051 153 I HN -0.373 7.801 8.210 -0.062 0.000 0.409 154 A N -0.692 122.119 122.820 -0.015 0.000 1.902 154 A HA -0.396 3.932 4.320 0.013 0.000 0.217 154 A C 1.656 179.265 177.584 0.042 0.000 1.181 154 A CA 3.371 55.417 52.037 0.016 0.000 0.623 154 A CB -0.854 18.157 19.000 0.019 0.000 0.818 154 A HN -0.021 8.114 8.150 -0.026 0.000 0.443 155 R N -1.359 119.167 120.500 0.043 0.000 2.081 155 R HA -0.244 4.127 4.340 0.051 0.000 0.235 155 R C 2.375 178.733 176.300 0.096 0.000 1.131 155 R CA 2.414 58.547 56.100 0.056 0.000 0.960 155 R CB -0.515 29.808 30.300 0.038 0.000 0.856 155 R HN -0.342 7.947 8.270 0.031 0.000 0.436 156 V N -0.387 119.604 119.914 0.128 0.000 2.358 156 V HA -0.476 3.770 4.120 0.210 0.000 0.246 156 V C 1.921 178.219 176.094 0.340 0.000 1.047 156 V CA 3.939 66.378 62.300 0.232 0.000 1.035 156 V CB -0.315 31.643 31.823 0.225 0.000 0.658 156 V HN -0.039 8.213 8.190 0.104 0.000 0.452 157 K N -0.624 119.907 120.400 0.218 0.000 2.032 157 K HA -0.398 3.981 4.320 0.097 0.000 0.209 157 K C 2.444 179.135 176.600 0.151 0.000 1.048 157 K CA 3.768 60.122 56.287 0.113 0.000 0.927 157 K CB -0.409 32.068 32.500 -0.038 0.000 0.712 157 K HN -0.430 7.923 8.250 0.172 0.000 0.441 158 Q N -1.181 118.686 119.800 0.113 0.000 2.167 158 Q HA -0.283 4.108 4.340 0.084 0.000 0.202 158 Q C 1.967 178.035 176.000 0.112 0.000 0.970 158 Q CA 2.693 58.553 55.803 0.095 0.000 0.855 158 Q CB -0.702 28.076 28.738 0.066 0.000 0.911 158 Q HN -0.446 7.883 8.270 0.099 0.000 0.438 159 D N 0.558 121.035 120.400 0.129 0.000 2.117 159 D HA -0.238 4.442 4.640 0.067 0.000 0.197 159 D C 2.420 178.754 176.300 0.056 0.000 0.987 159 D CA 3.417 57.467 54.000 0.083 0.000 0.829 159 D CB -0.542 40.296 40.800 0.063 0.000 0.961 159 D HN -0.295 8.074 8.370 0.145 0.088 0.460 160 F N 0.046 120.032 119.950 0.060 0.000 2.134 160 F HA -0.476 4.069 4.527 0.030 0.000 0.299 160 F C 1.993 177.793 175.800 -0.000 0.000 1.097 160 F CA 4.534 62.549 58.000 0.025 0.000 1.264 160 F CB -0.092 38.913 39.000 0.008 0.000 1.001 160 F HN -0.348 8.195 8.300 0.405 0.000 0.479 161 V N 0.131 120.156 119.914 0.185 0.000 2.295 161 V HA -0.681 3.506 4.120 0.112 0.000 0.246 161 V C 1.727 177.878 176.094 0.095 0.000 1.049 161 V CA 4.806 67.175 62.300 0.115 0.000 1.024 161 V CB -0.415 31.460 31.823 0.086 0.000 0.648 161 V HN -0.341 7.964 8.190 0.192 0.000 0.447 162 D N -0.615 119.834 120.400 0.082 0.000 2.144 162 D HA -0.312 4.372 4.640 0.073 0.000 0.199 162 D C 2.273 178.608 176.300 0.058 0.000 0.984 162 D CA 3.483 57.525 54.000 0.070 0.000 0.834 162 D CB -0.701 40.139 40.800 0.067 0.000 0.955 162 D HN -0.095 8.326 8.370 0.085 0.000 0.465 163 A N 0.119 122.955 122.820 0.026 0.000 1.902 163 A HA -0.207 4.104 4.320 -0.015 0.000 0.217 163 A C 1.746 179.330 177.584 -0.001 0.000 1.181 163 A CA 2.999 55.023 52.037 -0.022 0.000 0.623 163 A CB -0.480 18.450 19.000 -0.116 0.000 0.818 163 A HN -0.148 8.014 8.150 0.020 0.000 0.443 164 A N -1.531 121.311 122.820 0.037 0.000 1.930 164 A HA -0.282 4.051 4.320 0.021 0.000 0.217 164 A C 1.865 179.592 177.584 0.238 0.000 1.175 164 A CA 2.971 55.066 52.037 0.096 0.000 0.627 164 A CB -0.934 18.119 19.000 0.088 0.000 0.815 164 A HN -0.147 8.033 8.150 0.049 0.000 0.443 165 R N -1.578 119.023 120.500 0.168 0.000 2.081 165 R HA -0.287 4.153 4.340 0.166 0.000 0.235 165 R C 2.284 178.668 176.300 0.140 0.000 1.131 165 R CA 2.902 59.091 56.100 0.149 0.000 0.960 165 R CB -0.274 30.086 30.300 0.100 0.000 0.856 165 R HN -0.101 8.248 8.270 0.131 0.000 0.436 166 R N -1.718 118.853 120.500 0.119 0.000 2.081 166 R HA -0.294 4.114 4.340 0.114 0.000 0.235 166 R C 2.253 178.654 176.300 0.169 0.000 1.131 166 R CA 3.146 59.317 56.100 0.119 0.000 0.960 166 R CB -0.244 30.110 30.300 0.091 0.000 0.856 166 R HN -0.138 8.193 8.270 0.101 0.000 0.436 167 A N -0.932 121.993 122.820 0.176 0.000 1.902 167 A HA -0.362 4.157 4.320 0.332 0.000 0.217 167 A C 1.362 179.231 177.584 0.475 0.000 1.181 167 A CA 3.195 55.407 52.037 0.291 0.000 0.623 167 A CB -0.713 18.322 19.000 0.058 0.000 0.818 167 A HN 0.020 8.247 8.150 0.129 0.000 0.443 168 R N -1.172 119.588 120.500 0.433 0.000 2.080 168 R HA -0.315 4.107 4.340 0.136 0.000 0.236 168 R C 2.569 178.932 176.300 0.105 0.000 1.137 168 R CA 3.152 59.367 56.100 0.192 0.000 0.943 168 R CB -0.108 30.212 30.300 0.034 0.000 0.846 168 R HN -0.214 8.322 8.270 0.444 0.000 0.431 169 D N -0.358 120.107 120.400 0.109 0.000 2.312 169 D HA -0.117 4.544 4.640 0.034 0.000 0.211 169 D C 1.268 177.613 176.300 0.076 0.000 0.964 169 D CA 2.429 56.469 54.000 0.067 0.000 0.877 169 D CB -0.511 40.326 40.800 0.062 0.000 0.924 169 D HN -0.360 8.088 8.370 0.130 0.000 0.515 170 A N -3.274 119.624 122.820 0.129 0.000 2.169 170 A HA 0.086 4.450 4.320 0.073 0.000 0.212 170 A C 0.128 177.693 177.584 -0.031 0.000 1.153 170 A CA 0.468 52.561 52.037 0.093 0.000 0.756 170 A CB 0.425 19.547 19.000 0.204 0.000 0.813 170 A HN -0.230 8.008 8.150 0.187 0.024 0.471 171 G N -4.836 103.965 108.800 0.003 0.000 2.168 171 G HA2 -0.289 3.658 3.960 -0.023 0.000 0.197 171 G HA3 -0.289 3.610 3.960 -0.102 0.000 0.197 171 G C -0.342 174.527 174.900 -0.052 0.000 0.997 171 G CA -0.420 44.647 45.100 -0.055 0.000 0.658 171 G HN -0.544 7.645 8.290 0.082 0.150 0.513 172 F N 0.983 121.006 119.950 0.121 0.000 2.553 172 F HA -0.317 4.303 4.527 0.154 0.000 0.356 172 F C -0.006 175.956 175.800 0.269 0.000 1.142 172 F CA 2.229 60.348 58.000 0.197 0.000 1.322 172 F CB 0.249 39.384 39.000 0.225 0.000 1.126 172 F HN -0.746 7.697 8.300 0.237 0.000 0.599 173 E N -0.208 120.287 120.200 0.492 0.000 2.538 173 E HA 0.130 4.653 4.350 0.288 0.000 0.207 173 E C -1.567 175.410 176.600 0.629 0.000 1.002 173 E CA -0.286 56.359 56.400 0.408 0.000 0.952 173 E CB 1.945 31.802 29.700 0.260 0.000 1.031 173 E HN 0.220 8.882 8.360 0.503 0.000 0.476 174 W N -2.042 119.543 121.300 0.476 0.000 3.624 174 W HA 0.148 5.154 4.660 0.326 -0.151 0.312 174 W C -2.946 173.573 176.519 0.000 0.000 1.203 174 W CA -0.267 57.240 57.345 0.271 0.000 1.225 174 W CB 2.366 31.917 29.460 0.151 0.000 1.321 174 W HN -0.830 7.822 8.180 0.788 0.000 0.506 175 I N 5.749 126.119 120.570 -0.334 0.000 2.608 175 I HA 0.628 4.721 4.170 -0.406 -0.167 0.295 175 I C -2.895 172.931 176.117 -0.484 0.000 1.049 175 I CA -2.371 58.550 61.300 -0.631 0.000 1.063 175 I CB 4.237 41.349 38.000 -1.479 0.000 1.248 175 I HN 0.011 7.909 8.210 -0.520 0.000 0.424 176 E N 7.694 127.699 120.200 -0.326 0.000 2.216 176 E HA 0.448 4.696 4.350 -0.326 -0.094 0.260 176 E C -1.784 174.626 176.600 -0.317 0.000 0.880 176 E CA -2.184 54.054 56.400 -0.269 0.000 0.765 176 E CB 3.767 33.417 29.700 -0.083 0.000 1.174 176 E HN 0.245 8.420 8.360 -0.309 0.000 0.417 177 L N 6.146 127.094 121.223 -0.458 0.000 2.319 177 L HA 0.074 4.224 4.340 -0.317 0.000 0.280 177 L C -0.949 175.634 176.870 -0.479 0.000 1.099 177 L CA -0.490 54.002 54.840 -0.579 0.000 0.828 177 L CB 0.393 41.748 42.059 -1.175 0.000 1.150 177 L HN 0.355 8.268 8.230 -0.529 0.000 0.442 178 H N 6.170 125.124 119.070 -0.193 0.000 3.014 178 H HA 0.111 4.672 4.556 0.009 0.000 0.266 178 H C -1.218 174.294 175.328 0.307 0.000 1.455 178 H CA -1.360 54.721 56.048 0.054 0.000 1.402 178 H CB -0.527 29.337 29.762 0.170 0.000 1.626 178 H HN 0.118 8.491 8.280 0.155 0.000 0.520 179 F N 5.098 125.305 119.950 0.427 0.000 2.750 179 F HA 0.094 4.842 4.527 0.367 0.000 0.297 179 F C -1.472 174.624 175.800 0.494 0.000 1.138 179 F CA -2.846 55.385 58.000 0.385 0.000 1.346 179 F CB -1.734 37.406 39.000 0.232 0.000 0.965 179 F HN -0.269 8.245 8.300 0.357 0.000 0.514 180 A N -1.769 121.436 122.820 0.641 0.000 2.389 180 A HA 0.769 5.593 4.320 0.413 -0.256 0.293 180 A C -0.899 176.889 177.584 0.340 0.000 1.186 180 A CA -2.364 49.911 52.037 0.396 0.000 0.828 180 A CB 2.927 21.975 19.000 0.080 0.000 1.369 180 A HN -0.635 7.946 8.150 0.830 0.067 0.446 181 H N -4.336 114.958 119.070 0.373 0.000 2.992 181 H HA -0.398 4.527 4.556 0.491 -0.074 0.266 181 H C 0.270 175.455 175.328 -0.239 0.000 1.200 181 H CA 0.287 56.453 56.048 0.197 0.000 1.135 181 H CB -1.472 28.390 29.762 0.167 0.000 1.282 181 H HN 0.529 9.151 8.280 0.571 0.000 0.351 182 G N -5.930 102.930 108.800 0.100 0.000 2.159 182 G HA2 -0.510 3.561 3.960 0.185 0.000 0.256 182 G HA3 -0.510 3.625 3.960 0.054 -0.142 0.256 182 G C -0.662 174.237 174.900 -0.002 0.000 0.977 182 G CA 0.384 45.522 45.100 0.063 0.000 0.652 182 G HN 0.444 8.830 8.290 0.232 0.044 0.531 183 Y N -2.761 117.649 120.300 0.184 0.000 2.330 183 Y HA -0.024 4.762 4.550 0.142 -0.151 0.387 183 Y C 1.036 177.066 175.900 0.217 0.000 1.365 183 Y CA -1.225 56.963 58.100 0.147 0.000 1.828 183 Y CB 0.018 38.487 38.460 0.015 0.000 1.696 183 Y HN -0.947 7.249 8.280 -0.046 0.056 0.616 184 L N 0.079 121.577 121.223 0.458 0.000 1.989 184 L HA -0.190 4.291 4.340 0.235 0.000 0.211 184 L C 2.451 179.538 176.870 0.361 0.000 1.071 184 L CA 3.173 58.212 54.840 0.332 0.000 0.749 184 L CB 0.095 42.322 42.059 0.281 0.000 0.890 184 L HN -0.085 8.456 8.230 0.518 0.000 0.431 185 G N -4.852 104.235 108.800 0.479 0.000 2.446 185 G HA2 -0.511 3.687 3.960 0.397 0.000 0.217 185 G HA3 -0.511 3.687 3.960 0.396 0.000 0.217 185 G C 0.937 176.075 174.900 0.398 0.000 1.168 185 G CA 2.178 47.524 45.100 0.410 0.000 0.771 185 G HN 0.286 8.917 8.290 0.569 0.000 0.551 186 Q N 1.239 121.313 119.800 0.457 0.000 2.135 186 Q HA -0.348 4.337 4.340 0.576 0.000 0.204 186 Q C 2.152 178.387 176.000 0.391 0.000 0.981 186 Q CA 2.743 58.827 55.803 0.469 0.000 0.856 186 Q CB -0.402 28.573 28.738 0.396 0.000 0.902 186 Q HN 0.149 8.705 8.270 0.476 0.000 0.425 187 S N -1.740 114.132 115.700 0.285 0.000 2.453 187 S HA -0.136 4.437 4.470 0.173 0.000 0.231 187 S C 1.164 175.798 174.600 0.057 0.000 1.005 187 S CA 2.454 60.746 58.200 0.153 0.000 0.949 187 S CB 0.013 63.256 63.200 0.072 0.000 0.774 187 S HN -0.437 8.035 8.310 0.288 0.011 0.510 188 F N 0.029 120.027 119.950 0.079 0.000 2.206 188 F HA -0.297 4.233 4.527 0.006 0.000 0.298 188 F C 1.494 177.379 175.800 0.141 0.000 1.090 188 F CA 3.546 61.576 58.000 0.050 0.000 1.323 188 F CB 0.383 39.378 39.000 -0.007 0.000 1.028 188 F HN -0.762 7.664 8.300 0.365 0.093 0.492 189 F N -1.116 118.987 119.950 0.256 0.000 2.206 189 F HA -0.242 4.513 4.527 0.160 -0.132 0.298 189 F C -0.154 175.746 175.800 0.167 0.000 1.090 189 F CA 1.286 59.413 58.000 0.211 0.000 1.323 189 F CB 1.141 40.335 39.000 0.323 0.000 1.028 189 F HN -0.969 7.580 8.300 0.563 0.089 0.492 190 S N -1.448 114.346 115.700 0.156 0.000 2.499 190 S HA -0.041 4.407 4.470 -0.036 0.000 0.275 190 S C 0.862 175.431 174.600 -0.052 0.000 1.257 190 S CA -1.025 57.202 58.200 0.045 0.000 1.050 190 S CB 0.688 64.003 63.200 0.193 0.000 0.937 190 S HN -0.598 7.872 8.310 0.267 0.000 0.490 191 E N 9.112 129.215 120.200 -0.160 0.000 2.265 191 E HA -0.324 3.946 4.350 -0.133 0.000 0.196 191 E C 2.031 178.547 176.600 -0.139 0.000 0.996 191 E CA 3.071 59.368 56.400 -0.172 0.000 0.832 191 E CB -0.312 29.252 29.700 -0.228 0.000 0.756 191 E HN 0.751 8.984 8.360 -0.211 0.000 0.491 192 H N -1.806 117.242 119.070 -0.036 0.000 2.387 192 H HA -0.176 4.356 4.556 -0.039 0.000 0.299 192 H C 1.774 177.082 175.328 -0.033 0.000 1.090 192 H CA 3.078 59.106 56.048 -0.033 0.000 1.332 192 H CB 0.096 29.844 29.762 -0.024 0.000 1.386 192 H HN -0.356 7.838 8.280 -0.098 0.027 0.516 193 S N -4.538 111.221 115.700 0.097 0.000 2.505 193 S HA -0.043 4.447 4.470 0.033 0.000 0.216 193 S C 0.049 174.617 174.600 -0.053 0.000 1.018 193 S CA 0.045 58.263 58.200 0.031 0.000 0.911 193 S CB 1.625 64.857 63.200 0.053 0.000 0.818 193 S HN -0.652 7.695 8.310 0.095 0.019 0.497 194 N N 1.842 120.504 118.700 -0.063 0.000 2.511 194 N HA 0.089 4.734 4.740 -0.157 0.000 0.249 194 N C -1.195 174.274 175.510 -0.069 0.000 0.971 194 N CA -0.630 52.356 53.050 -0.107 0.000 0.938 194 N CB 0.700 39.130 38.487 -0.095 0.000 1.131 194 N HN -0.601 7.755 8.380 -0.040 0.000 0.505 195 K N 4.581 124.942 120.400 -0.064 0.000 2.455 195 K HA 0.328 4.623 4.320 -0.041 0.000 0.206 195 K C 0.470 177.053 176.600 -0.028 0.000 1.027 195 K CA -2.181 54.080 56.287 -0.042 0.000 1.113 195 K CB -0.319 32.159 32.500 -0.036 0.000 0.850 195 K HN 0.354 8.557 8.250 -0.078 0.000 0.503 196 R N 0.260 120.747 120.500 -0.021 0.000 2.694 196 R HA -0.060 4.283 4.340 0.006 0.000 0.268 196 R C 0.586 176.899 176.300 0.022 0.000 1.061 196 R CA 1.158 57.266 56.100 0.013 0.000 1.133 196 R CB 0.459 30.795 30.300 0.061 0.000 1.020 196 R HN -0.198 8.322 8.270 -0.031 -0.269 0.475 197 T N -2.510 112.061 114.554 0.029 0.000 3.145 197 T HA 0.179 4.537 4.350 0.014 0.000 0.281 197 T C -0.963 173.757 174.700 0.033 0.000 1.003 197 T CA -0.864 61.249 62.100 0.021 0.000 0.901 197 T CB 0.155 69.029 68.868 0.011 0.000 1.112 197 T HN 0.393 8.653 8.240 0.034 0.000 0.535 198 D N 1.194 121.632 120.400 0.063 0.000 2.560 198 D HA 0.060 4.729 4.640 0.048 0.000 0.277 198 D C 0.767 177.097 176.300 0.050 0.000 1.194 198 D CA -1.399 52.646 54.000 0.074 0.000 1.092 198 D CB 0.512 41.387 40.800 0.126 0.000 1.169 198 D HN -0.810 7.609 8.370 0.082 0.000 0.607 199 A N -3.461 119.370 122.820 0.019 0.000 2.172 199 A HA -0.105 4.131 4.320 -0.141 0.000 0.216 199 A C 0.384 177.767 177.584 -0.336 0.000 1.154 199 A CA 2.065 53.998 52.037 -0.175 0.000 0.701 199 A CB -0.235 18.597 19.000 -0.279 0.000 0.789 199 A HN 0.393 8.581 8.150 0.063 0.000 0.465 200 Y N -4.308 116.032 120.300 0.067 0.000 2.507 200 Y HA 0.361 5.107 4.550 0.093 -0.140 0.254 200 Y C -0.676 175.309 175.900 0.143 0.000 1.171 200 Y CA -0.194 57.982 58.100 0.127 0.000 1.238 200 Y CB 0.575 39.167 38.460 0.221 0.000 1.148 200 Y HN -0.508 8.149 8.280 0.248 -0.228 0.525 201 G N -4.073 104.812 108.800 0.141 0.000 2.695 201 G HA2 0.230 4.236 3.960 0.076 0.000 0.290 201 G HA3 0.230 4.443 3.960 0.068 -0.212 0.290 201 G C -1.521 173.386 174.900 0.012 0.000 1.410 201 G CA -1.094 44.050 45.100 0.073 0.000 0.844 201 G HN -0.832 7.517 8.290 0.097 0.000 0.478 202 G N -0.052 108.741 108.800 -0.013 0.000 3.355 202 G HA2 -0.343 3.601 3.960 -0.027 0.000 0.247 202 G HA3 -0.343 3.607 3.960 -0.017 0.000 0.247 202 G C -0.764 174.119 174.900 -0.029 0.000 1.818 202 G CA -0.030 45.057 45.100 -0.023 0.000 1.309 202 G HN 0.250 8.527 8.290 -0.021 0.000 0.546 203 S N 2.270 117.959 115.700 -0.018 0.000 2.608 203 S HA 0.083 4.565 4.470 0.020 0.000 0.261 203 S C 0.771 175.381 174.600 0.017 0.000 1.314 203 S CA -1.193 57.014 58.200 0.010 0.000 0.992 203 S CB 1.629 64.839 63.200 0.016 0.000 0.935 203 S HN -0.329 7.969 8.310 -0.020 0.000 0.564 204 F N 2.422 122.329 119.950 -0.071 0.000 2.126 204 F HA -0.344 4.110 4.527 -0.122 0.000 0.299 204 F C 1.007 176.801 175.800 -0.010 0.000 1.096 204 F CA 3.498 61.461 58.000 -0.061 0.000 1.255 204 F CB -0.149 38.834 39.000 -0.027 0.000 0.997 204 F HN 0.609 9.045 8.300 0.227 0.000 0.479 205 D N -2.725 117.597 120.400 -0.129 0.000 2.117 205 D HA -0.280 4.121 4.640 -0.398 0.000 0.197 205 D C 2.498 178.662 176.300 -0.227 0.000 0.987 205 D CA 3.698 57.558 54.000 -0.234 0.000 0.829 205 D CB -0.818 39.944 40.800 -0.063 0.000 0.961 205 D HN 0.175 8.590 8.370 0.075 0.000 0.460 206 N N -0.767 117.844 118.700 -0.148 0.000 2.171 206 N HA -0.155 4.567 4.740 -0.189 -0.095 0.184 206 N C 2.562 178.032 175.510 -0.066 0.000 1.021 206 N CA 2.068 55.039 53.050 -0.132 0.000 0.854 206 N CB 0.189 38.626 38.487 -0.083 0.000 0.994 206 N HN -0.401 7.916 8.380 -0.105 0.000 0.426 207 R N 0.265 120.724 120.500 -0.068 0.000 2.115 207 R HA -0.164 4.251 4.340 0.126 0.000 0.230 207 R C 2.165 178.518 176.300 0.088 0.000 1.111 207 R CA 2.901 59.008 56.100 0.012 0.000 0.976 207 R CB -0.030 30.180 30.300 -0.151 0.000 0.870 207 R HN -0.082 8.123 8.270 -0.109 0.000 0.445 208 S N -1.122 114.523 115.700 -0.092 0.000 2.453 208 S HA -0.245 4.260 4.470 0.058 0.000 0.231 208 S C 0.335 174.868 174.600 -0.111 0.000 1.005 208 S CA 2.552 60.681 58.200 -0.118 0.000 0.949 208 S CB -0.035 62.869 63.200 -0.493 0.000 0.774 208 S HN -0.113 8.038 8.310 -0.264 0.000 0.510 209 R N 1.449 121.892 120.500 -0.095 0.000 2.083 209 R HA -0.329 3.923 4.340 -0.147 0.000 0.237 209 R C 1.364 177.659 176.300 -0.009 0.000 1.137 209 R CA 3.622 59.657 56.100 -0.108 0.000 0.951 209 R CB -0.242 29.897 30.300 -0.269 0.000 0.851 209 R HN -0.696 7.353 8.270 -0.091 0.167 0.434 210 F N -1.878 118.022 119.950 -0.083 0.000 2.134 210 F HA -0.222 4.195 4.527 -0.184 0.000 0.299 210 F C 1.381 176.951 175.800 -0.382 0.000 1.097 210 F CA 3.266 61.077 58.000 -0.314 0.000 1.264 210 F CB -0.250 38.177 39.000 -0.956 0.000 1.001 210 F HN -0.032 8.410 8.300 0.236 0.000 0.479 211 L N -1.577 119.409 121.223 -0.395 0.000 2.027 211 L HA -0.360 3.264 4.340 -1.194 0.000 0.206 211 L C 1.857 178.542 176.870 -0.308 0.000 1.074 211 L CA 3.676 58.103 54.840 -0.688 0.000 0.745 211 L CB -0.486 41.214 42.059 -0.598 0.000 0.898 211 L HN -0.807 7.322 8.230 -0.169 0.000 0.433 212 L N -1.800 119.339 121.223 -0.139 0.000 2.056 212 L HA -0.475 3.912 4.340 0.078 0.000 0.207 212 L C 2.439 179.240 176.870 -0.115 0.000 1.078 212 L CA 3.533 58.346 54.840 -0.044 0.000 0.749 212 L CB -0.602 41.417 42.059 -0.066 0.000 0.901 212 L HN -0.180 7.958 8.230 -0.154 0.000 0.433 213 E N -1.336 118.757 120.200 -0.178 0.000 2.106 213 E HA -0.343 3.940 4.350 -0.111 0.000 0.192 213 E C 2.715 179.170 176.600 -0.241 0.000 0.984 213 E CA 3.251 59.551 56.400 -0.167 0.000 0.806 213 E CB -0.137 29.492 29.700 -0.118 0.000 0.750 213 E HN 0.062 8.307 8.360 -0.191 0.000 0.458 214 T N 2.510 116.802 114.554 -0.437 0.000 2.737 214 T HA -0.285 3.831 4.350 -0.390 0.000 0.265 214 T C 1.850 176.409 174.700 -0.235 0.000 1.038 214 T CA 4.473 66.300 62.100 -0.455 0.000 1.144 214 T CB -0.095 68.262 68.868 -0.852 0.000 0.866 214 T HN -0.340 7.554 8.240 -0.576 0.000 0.434 215 L N 1.511 122.639 121.223 -0.159 0.000 2.012 215 L HA -0.423 3.814 4.340 -0.172 0.000 0.210 215 L C 0.807 177.619 176.870 -0.097 0.000 1.073 215 L CA 3.381 58.142 54.840 -0.131 0.000 0.748 215 L CB -0.649 41.344 42.059 -0.109 0.000 0.891 215 L HN -0.286 7.855 8.230 -0.148 0.000 0.431 216 A N -2.241 120.533 122.820 -0.076 0.000 1.933 216 A HA -0.375 3.926 4.320 -0.032 0.000 0.218 216 A C 1.814 179.377 177.584 -0.035 0.000 1.175 216 A CA 2.809 54.819 52.037 -0.045 0.000 0.628 216 A CB -0.697 18.280 19.000 -0.039 0.000 0.814 216 A HN -0.207 7.893 8.150 -0.084 0.000 0.444 217 A N -1.678 121.111 122.820 -0.052 0.000 1.898 217 A HA -0.236 4.077 4.320 -0.011 0.000 0.216 217 A C 2.617 180.203 177.584 0.004 0.000 1.181 217 A CA 2.653 54.675 52.037 -0.024 0.000 0.620 217 A CB -0.629 18.349 19.000 -0.036 0.000 0.819 217 A HN -0.398 7.703 8.150 -0.081 0.000 0.442 218 V N -0.292 119.615 119.914 -0.012 0.000 2.407 218 V HA -0.555 3.598 4.120 0.055 0.000 0.248 218 V C 1.435 177.569 176.094 0.066 0.000 1.055 218 V CA 4.007 66.319 62.300 0.020 0.000 1.049 218 V CB -0.311 31.481 31.823 -0.051 0.000 0.662 218 V HN -0.188 7.973 8.190 -0.048 0.000 0.455 219 R N -2.740 117.779 120.500 0.032 0.000 2.152 219 R HA -0.333 4.079 4.340 0.120 0.000 0.232 219 R C 1.086 177.431 176.300 0.075 0.000 1.117 219 R CA 2.740 58.880 56.100 0.068 0.000 0.981 219 R CB -0.106 30.207 30.300 0.022 0.000 0.870 219 R HN -0.417 7.763 8.270 -0.005 0.087 0.451 220 E N -3.199 117.032 120.200 0.051 0.000 2.204 220 E HA -0.154 4.214 4.350 0.031 0.000 0.194 220 E C 1.182 177.813 176.600 0.052 0.000 0.989 220 E CA 1.746 58.171 56.400 0.041 0.000 0.824 220 E CB 0.267 29.984 29.700 0.028 0.000 0.756 220 E HN -0.561 7.701 8.360 0.040 0.122 0.477 221 V N -9.672 110.295 119.914 0.089 0.000 3.523 221 V HA 0.258 4.411 4.120 0.054 0.000 0.255 221 V C -0.351 175.821 176.094 0.129 0.000 1.226 221 V CA -0.509 61.847 62.300 0.093 0.000 1.092 221 V CB 1.333 33.217 31.823 0.102 0.000 0.817 221 V HN -0.588 7.644 8.190 0.108 0.022 0.458 222 W N 3.119 124.404 121.300 -0.024 0.000 2.287 222 W HA 0.252 4.901 4.660 -0.020 0.000 0.313 222 W C -2.227 174.273 176.519 -0.032 0.000 1.267 222 W CA -0.999 56.328 57.345 -0.030 0.000 1.201 222 W CB 1.158 30.586 29.460 -0.054 0.000 1.196 222 W HN -0.496 7.865 8.180 0.302 0.000 0.536 223 P HA 0.028 4.283 4.420 -0.275 0.000 0.268 223 P C -0.616 176.500 177.300 -0.307 0.000 1.204 223 P CA -0.287 62.539 63.100 -0.456 0.000 0.768 223 P CB 0.891 32.269 31.700 -0.537 0.000 0.842 224 E N 2.964 123.080 120.200 -0.141 0.000 2.265 224 E HA -0.374 3.965 4.350 -0.019 0.000 0.196 224 E C 0.359 176.918 176.600 -0.068 0.000 0.996 224 E CA 2.991 59.353 56.400 -0.062 0.000 0.832 224 E CB -0.223 29.454 29.700 -0.038 0.000 0.756 224 E HN 0.524 8.809 8.360 -0.125 0.000 0.491 225 N N -5.992 112.641 118.700 -0.110 0.000 2.383 225 N HA -0.142 4.564 4.740 -0.056 0.000 0.192 225 N C -1.294 174.172 175.510 -0.073 0.000 1.141 225 N CA -0.063 52.938 53.050 -0.082 0.000 0.851 225 N CB -0.474 37.966 38.487 -0.080 0.000 0.976 225 N HN -0.178 8.081 8.380 -0.147 0.033 0.465 226 L N -0.016 121.150 121.223 -0.095 0.000 2.346 226 L HA 0.481 4.850 4.340 0.050 0.000 0.276 226 L C -2.171 174.819 176.870 0.200 0.000 1.006 226 L CA -2.856 51.999 54.840 0.024 0.000 0.817 226 L CB 1.642 43.627 42.059 -0.124 0.000 1.272 226 L HN -0.786 7.295 8.230 -0.152 0.058 0.421 227 P HA -0.141 4.356 4.420 -0.188 -0.190 0.262 227 P C -1.749 175.425 177.300 -0.209 0.000 1.182 227 P CA 0.363 63.333 63.100 -0.216 0.000 0.761 227 P CB 0.121 31.380 31.700 -0.735 0.000 0.795 228 L N 6.140 127.213 121.223 -0.251 0.000 2.294 228 L HA 0.388 4.386 4.340 -0.570 0.000 0.283 228 L C -1.859 174.747 176.870 -0.440 0.000 1.015 228 L CA -1.071 53.545 54.840 -0.374 0.000 0.831 228 L CB 2.649 44.610 42.059 -0.164 0.000 1.217 228 L HN 0.351 8.778 8.230 -0.210 -0.323 0.420 229 T N 3.540 117.774 114.554 -0.534 0.000 2.907 229 T HA 0.838 5.095 4.350 -0.349 -0.116 0.290 229 T C -1.933 172.521 174.700 -0.410 0.000 1.066 229 T CA -2.778 59.072 62.100 -0.417 0.000 1.012 229 T CB 3.334 71.972 68.868 -0.383 0.000 1.184 229 T HN 0.347 8.226 8.240 -0.603 0.000 0.522 230 A N -1.876 120.750 122.820 -0.323 0.000 2.572 230 A HA 0.508 4.784 4.320 -0.440 -0.220 0.295 230 A C -2.838 174.671 177.584 -0.125 0.000 1.072 230 A CA -1.019 50.794 52.037 -0.373 0.000 0.691 230 A CB 3.567 22.204 19.000 -0.604 0.000 1.291 230 A HN -0.080 7.931 8.150 -0.232 0.000 0.404 231 R N 0.755 121.215 120.500 -0.068 0.000 2.393 231 R HA 0.971 5.585 4.340 0.110 -0.207 0.310 231 R C -2.091 174.398 176.300 0.315 0.000 0.968 231 R CA -1.785 54.365 56.100 0.084 0.000 0.867 231 R CB 3.145 33.417 30.300 -0.047 0.000 1.124 231 R HN 0.225 8.410 8.270 -0.142 0.000 0.450 232 F N 6.457 126.497 119.950 0.150 0.000 2.588 232 F HA 0.393 5.289 4.527 0.282 -0.199 0.314 232 F C -2.131 173.783 175.800 0.190 0.000 1.134 232 F CA -2.124 56.011 58.000 0.226 0.000 0.961 232 F CB 4.677 43.846 39.000 0.282 0.000 1.239 232 F HN 0.217 8.717 8.300 0.334 0.000 0.448 233 G N 5.810 114.485 108.800 -0.208 0.000 2.351 233 G HA2 0.179 4.167 3.960 -0.087 0.000 0.287 233 G HA3 0.179 4.272 3.960 -0.073 -0.176 0.287 233 G C -0.492 174.012 174.900 -0.662 0.000 1.159 233 G CA -0.588 44.363 45.100 -0.248 0.000 0.929 233 G HN 0.099 8.611 8.290 -0.034 -0.243 0.435 234 V N 0.102 119.756 119.914 -0.433 0.000 3.590 234 V HA 0.165 3.915 4.120 -0.616 0.000 0.265 234 V C -0.720 175.239 176.094 -0.226 0.000 1.239 234 V CA -0.208 61.856 62.300 -0.394 0.000 1.117 234 V CB 0.780 32.492 31.823 -0.186 0.000 0.818 234 V HN -0.069 7.966 8.190 -0.258 0.000 0.451 235 L N -7.932 113.154 121.223 -0.229 0.000 2.568 235 L HA 0.481 4.715 4.340 -0.177 0.000 0.257 235 L C -1.708 175.009 176.870 -0.255 0.000 1.024 235 L CA -0.599 54.090 54.840 -0.253 0.000 0.854 235 L CB 2.528 44.346 42.059 -0.402 0.000 1.460 235 L HN -1.098 6.997 8.230 -0.226 0.000 0.409 236 E N -1.779 118.283 120.200 -0.231 0.000 2.465 236 E HA 0.136 4.393 4.350 -0.154 0.000 0.209 236 E C -0.424 176.120 176.600 -0.092 0.000 0.951 236 E CA -0.690 55.624 56.400 -0.143 0.000 0.997 236 E CB 1.405 31.087 29.700 -0.030 0.000 1.025 236 E HN 0.546 8.769 8.360 -0.229 0.000 0.500 237 Y N -5.499 114.719 120.300 -0.137 0.000 3.234 237 Y HA -0.372 4.405 4.550 -0.116 -0.297 0.207 237 Y C -1.492 174.340 175.900 -0.113 0.000 1.316 237 Y CA 0.628 58.641 58.100 -0.145 0.000 1.309 237 Y CB -2.816 35.507 38.460 -0.229 0.000 1.408 237 Y HN -0.342 7.832 8.280 -0.499 -0.194 0.544 238 D N -3.538 116.865 120.400 0.005 0.000 2.501 238 D HA 0.173 4.813 4.640 0.000 0.000 0.224 238 D C 0.429 176.743 176.300 0.024 0.000 1.202 238 D CA -2.206 51.803 54.000 0.014 0.000 0.829 238 D CB 0.391 41.218 40.800 0.046 0.000 1.023 238 D HN -0.716 7.769 8.370 -0.033 -0.134 0.499 239 G N -1.544 107.261 108.800 0.008 0.000 2.179 239 G HA2 -0.319 3.641 3.960 0.001 0.000 0.260 239 G HA3 -0.319 3.645 3.960 0.007 0.000 0.260 239 G C 0.359 175.254 174.900 -0.009 0.000 0.977 239 G CA 0.528 45.629 45.100 0.002 0.000 0.641 239 G HN 0.328 8.621 8.290 0.005 0.000 0.533 240 R N -1.372 119.118 120.500 -0.016 0.000 2.700 240 R HA 0.369 4.787 4.340 -0.031 -0.096 0.399 240 R C -1.202 175.064 176.300 -0.056 0.000 1.115 240 R CA -1.399 54.683 56.100 -0.030 0.000 1.058 240 R CB 0.747 31.034 30.300 -0.022 0.000 1.389 240 R HN -0.329 8.134 8.270 -0.014 -0.202 0.582 241 D N 1.192 121.542 120.400 -0.083 0.000 2.117 241 D HA -0.271 4.272 4.640 -0.162 0.000 0.198 241 D C 1.884 178.124 176.300 -0.099 0.000 0.982 241 D CA 3.776 57.693 54.000 -0.137 0.000 0.828 241 D CB -0.183 40.494 40.800 -0.206 0.000 0.967 241 D HN 0.405 8.731 8.370 -0.073 0.000 0.464 242 E N -0.506 119.653 120.200 -0.068 0.000 2.051 242 E HA -0.227 4.091 4.350 -0.054 0.000 0.192 242 E C 2.132 178.705 176.600 -0.046 0.000 0.991 242 E CA 3.117 59.486 56.400 -0.052 0.000 0.799 242 E CB -0.502 29.175 29.700 -0.039 0.000 0.748 242 E HN 0.033 8.357 8.360 -0.060 0.000 0.449 243 Q N -2.410 117.363 119.800 -0.044 0.000 2.172 243 Q HA -0.178 4.136 4.340 -0.044 0.000 0.200 243 Q C 2.250 178.236 176.000 -0.024 0.000 0.964 243 Q CA 2.635 58.413 55.803 -0.042 0.000 0.855 243 Q CB -0.750 27.959 28.738 -0.048 0.000 0.918 243 Q HN 0.127 8.370 8.270 -0.046 0.000 0.444 244 T N 3.544 118.086 114.554 -0.020 0.000 2.777 244 T HA -0.344 4.044 4.350 0.063 0.000 0.266 244 T C 2.045 176.773 174.700 0.045 0.000 1.040 244 T CA 4.887 67.002 62.100 0.025 0.000 1.141 244 T CB -0.305 68.562 68.868 -0.002 0.000 0.868 244 T HN -0.288 7.930 8.240 -0.037 0.000 0.444 245 L N 0.906 122.118 121.223 -0.018 0.000 2.046 245 L HA -0.266 4.212 4.340 -0.020 -0.150 0.208 245 L C 2.323 179.201 176.870 0.013 0.000 1.077 245 L CA 3.190 58.019 54.840 -0.018 0.000 0.747 245 L CB -0.214 41.814 42.059 -0.052 0.000 0.896 245 L HN 0.208 8.409 8.230 -0.047 0.000 0.432 246 E N -0.133 120.064 120.200 -0.005 0.000 2.058 246 E HA -0.486 3.850 4.350 -0.023 0.000 0.194 246 E C 2.366 178.955 176.600 -0.019 0.000 0.997 246 E CA 3.455 59.841 56.400 -0.024 0.000 0.801 246 E CB -0.174 29.494 29.700 -0.053 0.000 0.746 246 E HN -0.411 7.939 8.360 -0.017 0.000 0.450 247 E N -1.076 119.141 120.200 0.027 0.000 2.077 247 E HA -0.312 3.944 4.350 -0.157 0.000 0.193 247 E C 2.568 179.388 176.600 0.367 0.000 0.989 247 E CA 2.953 59.421 56.400 0.113 0.000 0.800 247 E CB -0.106 29.761 29.700 0.279 0.000 0.746 247 E HN -0.555 7.828 8.360 0.038 0.000 0.452 248 S N 0.362 116.264 115.700 0.336 0.000 2.382 248 S HA -0.347 4.342 4.470 0.365 0.000 0.228 248 S C 2.162 176.889 174.600 0.213 0.000 1.027 248 S CA 3.756 62.141 58.200 0.308 0.000 0.991 248 S CB -0.037 63.243 63.200 0.134 0.000 0.823 248 S HN -0.194 8.277 8.310 0.269 0.000 0.469 249 I N 1.694 122.335 120.570 0.118 0.000 2.315 249 I HA -0.503 3.720 4.170 0.088 0.000 0.248 249 I C 1.372 177.514 176.117 0.042 0.000 1.117 249 I CA 4.050 65.393 61.300 0.071 0.000 1.404 249 I CB -0.122 37.900 38.000 0.037 0.000 1.071 249 I HN -0.048 8.219 8.210 0.096 0.000 0.419 250 E N 0.149 120.366 120.200 0.028 0.000 2.077 250 E HA -0.371 3.977 4.350 -0.004 0.000 0.193 250 E C 2.120 178.779 176.600 0.098 0.000 0.989 250 E CA 2.977 59.387 56.400 0.016 0.000 0.800 250 E CB -0.381 29.215 29.700 -0.173 0.000 0.746 250 E HN -0.570 7.801 8.360 0.019 0.000 0.452 251 L N -0.970 120.330 121.223 0.129 0.000 2.083 251 L HA -0.299 3.917 4.340 -0.207 0.000 0.209 251 L C 1.514 178.023 176.870 -0.603 0.000 1.083 251 L CA 2.905 57.570 54.840 -0.292 0.000 0.752 251 L CB -0.593 41.088 42.059 -0.631 0.000 0.899 251 L HN -0.228 8.135 8.230 0.222 0.000 0.433 252 A N -1.167 121.492 122.820 -0.268 0.000 1.933 252 A HA -0.381 3.914 4.320 -0.042 0.000 0.218 252 A C 2.145 179.726 177.584 -0.005 0.000 1.175 252 A CA 3.218 55.216 52.037 -0.065 0.000 0.628 252 A CB -0.902 18.167 19.000 0.115 0.000 0.814 252 A HN 0.023 8.110 8.150 -0.105 0.000 0.444 253 R N -2.299 118.192 120.500 -0.014 0.000 2.081 253 R HA -0.331 4.030 4.340 0.034 0.000 0.235 253 R C 2.725 179.029 176.300 0.007 0.000 1.131 253 R CA 3.556 59.664 56.100 0.013 0.000 0.960 253 R CB -0.147 30.161 30.300 0.014 0.000 0.856 253 R HN -0.292 7.968 8.270 -0.017 0.000 0.436 254 R N -0.876 119.594 120.500 -0.050 0.000 2.092 254 R HA -0.281 4.059 4.340 0.001 0.000 0.231 254 R C 2.787 179.115 176.300 0.046 0.000 1.119 254 R CA 3.227 59.304 56.100 -0.039 0.000 0.970 254 R CB -0.324 29.914 30.300 -0.103 0.000 0.864 254 R HN -0.604 7.528 8.270 -0.093 0.082 0.440 255 F N -0.826 119.094 119.950 -0.050 0.000 2.095 255 F HA -0.319 4.164 4.527 -0.074 0.000 0.298 255 F C 2.082 177.857 175.800 -0.041 0.000 1.104 255 F CA 1.269 59.230 58.000 -0.064 0.000 1.232 255 F CB -0.950 38.001 39.000 -0.081 0.000 0.987 255 F HN 0.162 8.367 8.300 -0.157 0.000 0.475 256 K N 0.629 121.138 120.400 0.182 0.000 2.032 256 K HA -0.372 4.161 4.320 0.083 -0.163 0.209 256 K C 2.661 179.299 176.600 0.063 0.000 1.048 256 K CA 3.206 59.550 56.287 0.096 0.000 0.927 256 K CB -0.061 32.484 32.500 0.075 0.000 0.712 256 K HN -0.138 8.219 8.250 0.178 0.000 0.441 257 A N -2.594 120.261 122.820 0.058 0.000 2.019 257 A HA -0.109 4.230 4.320 0.031 0.000 0.219 257 A C 1.807 179.413 177.584 0.036 0.000 1.164 257 A CA 2.297 54.357 52.037 0.038 0.000 0.644 257 A CB -0.457 18.561 19.000 0.030 0.000 0.805 257 A HN -0.330 7.856 8.150 0.061 0.000 0.449 258 G N -5.789 103.043 108.800 0.054 0.000 3.314 258 G HA2 0.003 3.979 3.960 0.026 0.000 0.238 258 G HA3 0.003 3.996 3.960 0.055 0.000 0.238 258 G C -0.274 174.639 174.900 0.020 0.000 1.184 258 G CA -0.633 44.491 45.100 0.040 0.000 0.806 258 G HN -0.547 7.662 8.290 0.079 0.129 0.536 259 G N -1.156 107.654 108.800 0.017 0.000 2.159 259 G HA2 -0.363 3.597 3.960 0.000 0.000 0.227 259 G HA3 -0.363 3.594 3.960 -0.005 0.000 0.227 259 G C -0.432 174.450 174.900 -0.030 0.000 0.986 259 G CA -0.108 44.990 45.100 -0.003 0.000 0.651 259 G HN -0.475 7.669 8.290 0.026 0.162 0.523 260 L N -0.208 120.996 121.223 -0.032 0.000 2.410 260 L HA -0.115 4.269 4.340 -0.144 -0.130 0.273 260 L C 0.096 176.931 176.870 -0.058 0.000 1.152 260 L CA 1.002 55.791 54.840 -0.085 0.000 0.855 260 L CB 0.802 42.813 42.059 -0.080 0.000 1.129 260 L HN -0.564 7.669 8.230 0.004 0.000 0.463 261 D N 6.401 126.735 120.400 -0.110 0.000 2.301 261 D HA 0.086 4.698 4.640 -0.046 0.000 0.206 261 D C -0.489 175.783 176.300 -0.046 0.000 0.979 261 D CA 2.095 56.043 54.000 -0.087 0.000 0.874 261 D CB 1.519 42.228 40.800 -0.151 0.000 0.968 261 D HN 0.546 8.816 8.370 -0.167 0.000 0.510 262 L N -3.873 117.309 121.223 -0.069 0.000 2.591 262 L HA 0.286 4.822 4.340 0.060 -0.161 0.257 262 L C -3.129 173.746 176.870 0.008 0.000 0.935 262 L CA -0.367 54.482 54.840 0.016 0.000 0.873 262 L CB 3.802 45.908 42.059 0.077 0.000 1.397 262 L HN -0.881 7.276 8.230 -0.121 0.000 0.414 263 L N 3.058 124.324 121.223 0.071 0.000 2.333 263 L HA 0.649 5.175 4.340 0.060 -0.150 0.280 263 L C -2.005 174.934 176.870 0.115 0.000 1.004 263 L CA -1.626 53.272 54.840 0.098 0.000 0.820 263 L CB 3.657 45.816 42.059 0.167 0.000 1.247 263 L HN 0.186 8.469 8.230 0.089 0.000 0.416 264 S N 6.105 121.874 115.700 0.114 0.000 2.416 264 S HA 0.238 4.929 4.470 0.113 -0.153 0.287 264 S C -0.873 173.816 174.600 0.148 0.000 1.139 264 S CA -1.006 57.266 58.200 0.120 0.000 1.058 264 S CB 0.275 63.537 63.200 0.104 0.000 0.967 264 S HN 0.467 8.832 8.310 0.093 0.000 0.495 265 V N 9.307 129.303 119.914 0.136 0.000 2.432 265 V HA 0.209 4.419 4.120 0.150 0.000 0.275 265 V C -1.349 174.829 176.094 0.140 0.000 1.043 265 V CA 0.136 62.514 62.300 0.130 0.000 0.925 265 V CB 0.681 32.559 31.823 0.093 0.000 0.985 265 V HN 0.239 8.499 8.190 0.117 0.000 0.466 266 S N 4.920 120.707 115.700 0.145 0.000 2.851 266 S HA 0.441 5.054 4.470 0.239 0.000 0.313 266 S C -1.689 172.998 174.600 0.144 0.000 1.163 266 S CA -2.490 55.852 58.200 0.237 0.000 0.850 266 S CB 2.376 65.842 63.200 0.442 0.000 1.245 266 S HN 0.023 8.398 8.310 0.108 0.000 0.558 267 V N -0.414 119.634 119.914 0.223 0.000 2.716 267 V HA 0.264 4.460 4.120 -0.079 -0.124 0.304 267 V C 0.713 176.841 176.094 0.056 0.000 1.053 267 V CA -0.770 61.509 62.300 -0.035 0.000 0.984 267 V CB 2.247 33.867 31.823 -0.339 0.000 1.021 267 V HN 0.351 8.786 8.190 0.408 0.000 0.467 268 G N 2.162 110.917 108.800 -0.076 0.000 2.394 268 G HA2 -0.220 4.025 3.960 0.175 0.000 0.215 268 G HA3 -0.220 4.101 3.960 0.056 -0.327 0.215 268 G C -0.306 174.759 174.900 0.276 0.000 1.165 268 G CA 1.210 46.371 45.100 0.101 0.000 0.784 268 G HN 0.075 8.270 8.290 -0.159 0.000 0.535 269 F N -4.363 115.695 119.950 0.180 0.000 3.079 269 F HA -0.402 4.243 4.527 0.197 0.000 0.274 269 F C 0.110 176.055 175.800 0.241 0.000 0.940 269 F CA 0.503 58.618 58.000 0.193 0.000 0.932 269 F CB -3.281 35.809 39.000 0.149 0.000 0.891 269 F HN -0.544 7.529 8.300 -0.379 0.000 0.722 270 T N -1.115 113.611 114.554 0.287 0.000 2.904 270 T HA -0.190 4.348 4.350 0.313 0.000 0.267 270 T C -0.219 174.631 174.700 0.251 0.000 1.059 270 T CA 4.242 66.505 62.100 0.273 0.000 1.137 270 T CB 0.906 69.896 68.868 0.203 0.000 0.879 270 T HN -0.103 8.575 8.240 0.185 -0.326 0.467 271 I N -6.641 113.935 120.570 0.009 0.000 2.934 271 I HA 0.643 4.341 4.170 -0.787 0.000 0.306 271 I C -2.710 173.168 176.117 -0.398 0.000 1.110 271 I CA -3.527 57.509 61.300 -0.440 0.000 1.019 271 I CB 1.921 39.616 38.000 -0.508 0.000 1.227 271 I HN -0.947 7.274 8.210 0.017 0.000 0.434 272 P HA -0.010 4.443 4.420 0.055 0.000 0.230 272 P C -1.013 176.225 177.300 -0.103 0.000 1.168 272 P CA 1.246 64.213 63.100 -0.222 0.000 0.793 272 P CB 0.357 31.897 31.700 -0.266 0.000 0.851 273 D N -0.136 120.159 120.400 -0.174 0.000 2.563 273 D HA 0.129 4.729 4.640 -0.067 0.000 0.222 273 D C -0.937 175.311 176.300 -0.087 0.000 1.145 273 D CA -0.817 53.119 54.000 -0.107 0.000 1.001 273 D CB -1.057 39.672 40.800 -0.117 0.000 1.049 273 D HN -0.142 8.076 8.370 -0.255 0.000 0.515 274 T N -0.350 114.177 114.554 -0.046 0.000 2.838 274 T HA 0.356 4.751 4.350 -0.040 -0.068 0.292 274 T C -1.051 173.625 174.700 -0.041 0.000 1.113 274 T CA -1.753 60.324 62.100 -0.040 0.000 1.008 274 T CB 2.892 71.734 68.868 -0.043 0.000 1.259 274 T HN -0.533 7.694 8.240 -0.022 0.000 0.520 275 N N 1.345 120.006 118.700 -0.065 0.000 2.727 275 N HA 0.227 4.896 4.740 -0.119 0.000 0.252 275 N C -1.330 173.978 175.510 -0.337 0.000 1.283 275 N CA 0.132 53.102 53.050 -0.133 0.000 0.782 275 N CB 1.576 40.013 38.487 -0.083 0.000 1.199 275 N HN 0.160 8.520 8.380 -0.032 0.000 0.520 276 I N 2.373 122.605 120.570 -0.563 0.000 2.416 276 I HA 0.143 3.433 4.170 -1.467 0.000 0.288 276 I C -0.520 174.778 176.117 -1.364 0.000 1.051 276 I CA -2.803 57.758 61.300 -1.231 0.000 1.375 276 I CB 0.756 37.842 38.000 -1.524 0.000 1.407 276 I HN 0.050 8.005 8.210 -0.425 0.000 0.516 277 P HA 0.111 4.156 4.420 -0.625 0.000 0.219 277 P C -1.461 175.168 177.300 -1.119 0.000 1.832 277 P CA -1.067 61.496 63.100 -0.895 0.000 1.014 277 P CB -1.583 29.768 31.700 -0.581 0.000 1.939 278 W N 1.720 122.422 121.300 -0.998 0.000 2.314 278 W HA -0.249 3.248 4.660 -1.938 0.000 0.339 278 W C 0.218 176.422 176.519 -0.526 0.000 1.293 278 W CA 0.819 57.504 57.345 -1.100 0.000 1.288 278 W CB 0.309 29.396 29.460 -0.621 0.000 1.186 278 W HN -0.577 6.942 8.180 -1.028 0.044 0.566 279 G N 1.573 110.359 108.800 -0.023 0.000 2.466 279 G HA2 -0.012 4.091 3.960 0.238 0.000 0.291 279 G HA3 -0.012 4.031 3.960 0.139 0.000 0.291 279 G C -3.103 172.058 174.900 0.436 0.000 1.460 279 G CA -1.096 44.138 45.100 0.224 0.000 0.791 279 G HN -0.287 7.966 8.290 -0.062 0.000 0.505 280 P HA -0.194 4.341 4.420 0.191 0.000 0.267 280 P C -0.771 176.570 177.300 0.068 0.000 1.209 280 P CA 0.401 63.601 63.100 0.167 0.000 0.763 280 P CB -0.390 31.353 31.700 0.071 0.000 0.816 281 A N 3.046 125.765 122.820 -0.168 0.000 2.826 281 A HA -0.435 3.318 4.320 -0.945 0.000 0.274 281 A C 0.215 177.806 177.584 0.012 0.000 1.443 281 A CA 1.181 52.958 52.037 -0.433 0.000 0.833 281 A CB -2.278 16.479 19.000 -0.406 0.000 1.023 281 A HN 0.144 8.164 8.150 -0.216 0.000 0.600 282 F N -3.877 116.100 119.950 0.045 0.000 2.333 282 F HA -0.284 4.265 4.527 0.037 0.000 0.300 282 F C 0.207 176.056 175.800 0.082 0.000 1.083 282 F CA 2.302 60.325 58.000 0.039 0.000 1.395 282 F CB -0.177 38.800 39.000 -0.039 0.000 1.056 282 F HN -0.674 7.928 8.300 0.529 0.015 0.529 283 M N -2.251 117.001 119.600 -0.580 0.000 2.595 283 M HA 0.037 4.248 4.480 -0.448 0.000 0.248 283 M C 1.864 178.152 176.300 -0.021 0.000 1.119 283 M CA 0.651 55.713 55.300 -0.397 0.000 1.079 283 M CB -0.752 31.626 32.600 -0.370 0.000 1.472 283 M HN -0.310 7.617 8.290 -0.558 0.028 0.501 284 G N 0.708 109.578 108.800 0.116 0.000 2.529 284 G HA2 -0.260 3.832 3.960 0.220 0.000 0.219 284 G HA3 -0.260 3.834 3.960 0.223 0.000 0.219 284 G C -1.683 173.279 174.900 0.103 0.000 1.177 284 G CA 3.456 48.666 45.100 0.183 0.000 0.773 284 G HN 0.114 8.326 8.290 0.123 0.151 0.573 285 P HA -0.115 4.346 4.420 0.069 0.000 0.217 285 P C 1.120 178.450 177.300 0.049 0.000 1.150 285 P CA 2.424 65.566 63.100 0.069 0.000 0.832 285 P CB -0.039 31.705 31.700 0.075 0.000 0.787 286 I N -3.540 117.053 120.570 0.037 0.000 2.286 286 I HA -0.387 3.792 4.170 0.015 0.000 0.245 286 I C 1.740 177.870 176.117 0.022 0.000 1.104 286 I CA 1.827 63.136 61.300 0.016 0.000 1.397 286 I CB -1.191 36.804 38.000 -0.007 0.000 1.072 286 I HN -0.850 7.382 8.210 0.036 0.000 0.417 287 A N -0.197 122.642 122.820 0.031 0.000 1.940 287 A HA -0.426 3.920 4.320 0.044 0.000 0.219 287 A C 1.470 179.080 177.584 0.044 0.000 1.176 287 A CA 3.604 55.666 52.037 0.042 0.000 0.631 287 A CB -0.916 18.113 19.000 0.048 0.000 0.814 287 A HN 0.110 8.278 8.150 0.030 0.000 0.446 288 E N -0.728 119.499 120.200 0.045 0.000 2.106 288 E HA -0.358 4.108 4.350 0.041 -0.092 0.192 288 E C 1.942 178.566 176.600 0.039 0.000 0.984 288 E CA 2.791 59.217 56.400 0.043 0.000 0.806 288 E CB 0.021 29.750 29.700 0.048 0.000 0.750 288 E HN -0.278 8.106 8.360 0.050 0.006 0.458 289 R N -0.505 120.016 120.500 0.035 0.000 2.081 289 R HA -0.280 4.077 4.340 0.028 0.000 0.235 289 R C 2.319 178.639 176.300 0.033 0.000 1.131 289 R CA 3.309 59.426 56.100 0.029 0.000 0.960 289 R CB -0.149 30.164 30.300 0.021 0.000 0.856 289 R HN -0.660 7.630 8.270 0.035 0.000 0.436 290 V N -0.540 119.398 119.914 0.040 0.000 2.295 290 V HA -0.507 3.644 4.120 0.052 0.000 0.246 290 V C 1.505 177.634 176.094 0.058 0.000 1.049 290 V CA 4.399 66.731 62.300 0.054 0.000 1.024 290 V CB -0.285 31.580 31.823 0.071 0.000 0.648 290 V HN -0.396 7.817 8.190 0.038 0.000 0.447 291 R N -0.294 120.239 120.500 0.055 0.000 2.096 291 R HA -0.362 4.204 4.340 0.062 -0.188 0.240 291 R C 1.893 178.222 176.300 0.048 0.000 1.139 291 R CA 3.465 59.598 56.100 0.054 0.000 0.952 291 R CB -0.137 30.191 30.300 0.047 0.000 0.854 291 R HN -0.155 8.146 8.270 0.052 0.000 0.436 292 R N -2.525 118.000 120.500 0.041 0.000 2.073 292 R HA -0.302 4.060 4.340 0.036 0.000 0.229 292 R C 2.369 178.688 176.300 0.032 0.000 1.120 292 R CA 3.253 59.374 56.100 0.035 0.000 0.967 292 R CB -0.005 30.314 30.300 0.031 0.000 0.862 292 R HN -0.349 7.945 8.270 0.040 0.000 0.436 293 E N -2.164 118.054 120.200 0.031 0.000 2.299 293 E HA -0.146 4.216 4.350 0.020 0.000 0.193 293 E C 1.934 178.551 176.600 0.028 0.000 0.998 293 E CA 2.203 58.618 56.400 0.025 0.000 0.851 293 E CB 0.315 30.027 29.700 0.019 0.000 0.795 293 E HN -0.207 8.172 8.360 0.033 0.000 0.492 294 A N -3.270 119.574 122.820 0.040 0.000 2.303 294 A HA 0.107 4.449 4.320 0.037 0.000 0.217 294 A C -0.736 176.876 177.584 0.047 0.000 1.205 294 A CA -0.851 51.213 52.037 0.045 0.000 0.875 294 A CB 0.476 19.513 19.000 0.062 0.000 0.910 294 A HN -0.262 7.915 8.150 0.045 0.000 0.501 295 K N -4.134 116.293 120.400 0.045 0.000 3.257 295 K HA -0.368 4.070 4.320 0.046 -0.090 0.270 295 K C -1.845 174.787 176.600 0.055 0.000 0.984 295 K CA 0.530 56.844 56.287 0.046 0.000 0.739 295 K CB -2.408 30.114 32.500 0.037 0.000 1.351 295 K HN -0.463 7.813 8.250 0.043 0.000 0.463 296 L N -1.542 119.720 121.223 0.064 0.000 2.408 296 L HA 0.574 4.956 4.340 0.071 0.000 0.268 296 L C -3.158 173.761 176.870 0.082 0.000 0.986 296 L CA -3.498 51.387 54.840 0.075 0.000 0.820 296 L CB 3.241 45.351 42.059 0.086 0.000 1.303 296 L HN -0.789 7.480 8.230 0.064 0.000 0.411 297 P HA 0.124 4.767 4.420 0.097 -0.164 0.269 297 P C -1.243 176.111 177.300 0.091 0.000 1.209 297 P CA -0.009 63.157 63.100 0.111 0.000 0.776 297 P CB 0.305 32.120 31.700 0.190 0.000 0.876 298 V N -5.972 113.977 119.914 0.060 0.000 3.078 298 V HA 1.026 5.406 4.120 0.078 -0.213 0.311 298 V C -1.284 174.817 176.094 0.012 0.000 1.138 298 V CA -3.431 58.902 62.300 0.054 0.000 1.007 298 V CB 4.683 36.539 31.823 0.055 0.000 1.045 298 V HN 0.104 8.578 8.190 0.037 -0.262 0.432 299 T N 0.881 115.453 114.554 0.031 0.000 2.916 299 T HA 0.800 5.244 4.350 -0.075 -0.139 0.292 299 T C -1.597 173.112 174.700 0.015 0.000 1.064 299 T CA -2.412 59.678 62.100 -0.017 0.000 1.011 299 T CB 2.158 71.023 68.868 -0.005 0.000 1.152 299 T HN -0.059 8.220 8.240 0.064 0.000 0.510 300 S N 2.139 117.829 115.700 -0.018 0.000 2.688 300 S HA 0.432 4.978 4.470 0.126 0.000 0.275 300 S C -3.009 171.679 174.600 0.146 0.000 1.175 300 S CA -1.230 57.023 58.200 0.090 0.000 0.818 300 S CB 1.069 64.340 63.200 0.118 0.000 1.157 300 S HN 0.082 8.328 8.310 -0.106 0.000 0.482 301 A N -0.857 122.176 122.820 0.355 0.000 2.593 301 A HA 0.397 5.188 4.320 0.571 -0.128 0.290 301 A C -2.305 175.657 177.584 0.631 0.000 1.126 301 A CA -0.797 51.537 52.037 0.495 0.000 0.695 301 A CB 3.493 22.705 19.000 0.353 0.000 1.290 301 A HN 0.330 8.689 8.150 0.348 0.000 0.414 302 W N -1.260 120.237 121.300 0.329 0.000 3.071 302 W HA -0.231 4.566 4.660 0.229 0.000 0.458 302 W C -1.170 175.354 176.519 0.008 0.000 1.805 302 W CA 0.103 57.586 57.345 0.230 0.000 0.462 302 W CB -0.410 29.303 29.460 0.421 0.000 2.861 302 W HN 0.638 9.105 8.180 0.478 0.000 0.424 303 G N 1.810 110.445 108.800 -0.274 0.000 2.141 303 G HA2 -0.445 3.347 3.960 -0.279 0.000 0.242 303 G HA3 -0.445 3.414 3.960 -0.168 0.000 0.242 303 G C -0.547 174.216 174.900 -0.228 0.000 0.982 303 G CA 0.400 45.349 45.100 -0.252 0.000 0.662 303 G HN 0.263 8.330 8.290 -0.371 0.000 0.527 304 F N -1.197 118.755 119.950 0.003 0.000 2.804 304 F HA 0.012 4.590 4.527 0.085 0.000 0.303 304 F C 0.506 176.293 175.800 -0.021 0.000 1.154 304 F CA -0.340 57.673 58.000 0.022 0.000 1.401 304 F CB -1.048 37.962 39.000 0.017 0.000 1.106 304 F HN 0.116 8.478 8.300 0.102 0.000 0.568 305 G N -2.446 106.355 108.800 0.001 0.000 2.625 305 G HA2 -0.187 3.543 3.960 -0.383 0.000 0.214 305 G HA3 -0.187 3.696 3.960 -0.128 0.000 0.214 305 G C -0.395 174.799 174.900 0.490 0.000 1.132 305 G CA 0.354 45.447 45.100 -0.013 0.000 0.782 305 G HN -0.100 8.094 8.290 -0.060 0.060 0.538 306 T N 4.395 119.157 114.554 0.347 0.000 2.723 306 T HA 0.413 5.003 4.350 0.401 0.000 0.297 306 T C -1.697 173.232 174.700 0.381 0.000 0.925 306 T CA -0.925 61.384 62.100 0.348 0.000 1.030 306 T CB 0.683 69.671 68.868 0.200 0.000 0.905 306 T HN -0.888 7.452 8.240 0.231 0.038 0.502 307 P HA -0.163 4.513 4.420 0.427 0.000 0.216 307 P C 1.165 178.574 177.300 0.181 0.000 1.150 307 P CA 2.364 65.609 63.100 0.242 0.000 0.837 307 P CB 0.462 32.091 31.700 -0.119 0.000 0.786 308 Q N -3.520 116.359 119.800 0.132 0.000 2.167 308 Q HA -0.258 4.137 4.340 0.091 0.000 0.202 308 Q C 2.353 178.447 176.000 0.155 0.000 0.970 308 Q CA 3.412 59.283 55.803 0.112 0.000 0.855 308 Q CB -0.999 27.787 28.738 0.080 0.000 0.911 308 Q HN 0.227 8.555 8.270 0.119 0.014 0.438 309 L N -0.392 120.954 121.223 0.204 0.000 2.072 309 L HA -0.243 4.219 4.340 0.204 0.000 0.205 309 L C 1.162 178.262 176.870 0.383 0.000 1.079 309 L CA 2.297 57.287 54.840 0.250 0.000 0.752 309 L CB -0.722 41.455 42.059 0.198 0.000 0.906 309 L HN -0.470 7.870 8.230 0.210 0.016 0.436 310 A N -1.130 121.939 122.820 0.415 0.000 1.883 310 A HA -0.434 4.060 4.320 0.290 0.000 0.217 310 A C 1.986 179.661 177.584 0.152 0.000 1.186 310 A CA 3.461 55.679 52.037 0.303 0.000 0.624 310 A CB -1.071 18.116 19.000 0.312 0.000 0.822 310 A HN -0.583 7.811 8.150 0.406 0.000 0.444 311 E N -0.899 119.390 120.200 0.148 0.000 2.051 311 E HA -0.387 4.006 4.350 0.072 0.000 0.192 311 E C 1.794 178.450 176.600 0.093 0.000 0.991 311 E CA 2.719 59.178 56.400 0.097 0.000 0.799 311 E CB -0.394 29.362 29.700 0.093 0.000 0.748 311 E HN -0.405 8.057 8.360 0.170 0.000 0.449 312 A N -1.095 121.797 122.820 0.120 0.000 1.902 312 A HA -0.255 4.118 4.320 0.089 0.000 0.217 312 A C 1.866 179.517 177.584 0.112 0.000 1.181 312 A CA 3.019 55.122 52.037 0.110 0.000 0.623 312 A CB -0.667 18.407 19.000 0.123 0.000 0.818 312 A HN -0.354 7.881 8.150 0.141 0.000 0.443 313 A N -1.052 121.856 122.820 0.147 0.000 1.902 313 A HA -0.190 4.382 4.320 0.135 -0.171 0.217 313 A C 1.934 179.541 177.584 0.038 0.000 1.181 313 A CA 2.803 54.911 52.037 0.119 0.000 0.623 313 A CB -0.544 18.546 19.000 0.149 0.000 0.818 313 A HN -0.394 7.870 8.150 0.190 0.000 0.443 314 L N -2.069 119.160 121.223 0.010 0.000 2.056 314 L HA -0.311 4.009 4.340 -0.033 0.000 0.207 314 L C 3.394 180.275 176.870 0.018 0.000 1.078 314 L CA 2.625 57.458 54.840 -0.011 0.000 0.749 314 L CB -0.195 41.849 42.059 -0.026 0.000 0.901 314 L HN -0.535 7.706 8.230 0.018 0.000 0.433 315 Q N -1.389 118.433 119.800 0.037 0.000 2.167 315 Q HA -0.285 4.078 4.340 0.038 0.000 0.202 315 Q C 1.748 177.774 176.000 0.043 0.000 0.970 315 Q CA 2.651 58.478 55.803 0.041 0.000 0.855 315 Q CB 0.082 28.849 28.738 0.048 0.000 0.911 315 Q HN -0.203 8.094 8.270 0.044 0.000 0.438 316 A N -3.733 119.116 122.820 0.048 0.000 2.238 316 A HA -0.039 4.309 4.320 0.047 0.000 0.208 316 A C -0.819 176.790 177.584 0.042 0.000 1.177 316 A CA -0.047 52.019 52.037 0.049 0.000 0.804 316 A CB 0.010 19.047 19.000 0.062 0.000 0.823 316 A HN -0.461 7.722 8.150 0.054 0.000 0.482 317 N N -4.630 114.090 118.700 0.034 0.000 2.735 317 N HA -0.422 4.329 4.740 0.019 0.000 0.248 317 N C -0.402 175.125 175.510 0.028 0.000 1.083 317 N CA 1.354 54.420 53.050 0.028 0.000 0.703 317 N CB -2.301 36.206 38.487 0.033 0.000 1.005 317 N HN -0.226 7.989 8.380 0.031 0.184 0.550 318 Q N -4.145 115.673 119.800 0.030 0.000 2.269 318 Q HA -0.223 4.142 4.340 0.041 0.000 0.201 318 Q C -0.529 175.476 176.000 0.010 0.000 0.946 318 Q CA 2.141 57.966 55.803 0.036 0.000 0.877 318 Q CB 1.330 30.108 28.738 0.067 0.000 0.963 318 Q HN -0.334 7.934 8.270 0.033 0.021 0.472 319 L N -5.761 115.445 121.223 -0.027 0.000 2.469 319 L HA 0.155 4.463 4.340 -0.053 0.000 0.256 319 L C -1.606 175.206 176.870 -0.097 0.000 1.006 319 L CA -0.953 53.842 54.840 -0.075 0.000 0.832 319 L CB 3.322 45.282 42.059 -0.164 0.000 1.421 319 L HN -0.943 7.240 8.230 -0.026 0.031 0.410 320 D N -0.972 119.345 120.400 -0.137 0.000 2.379 320 D HA 0.178 4.703 4.640 -0.191 0.000 0.218 320 D C -0.505 175.556 176.300 -0.398 0.000 1.006 320 D CA 2.450 56.301 54.000 -0.248 0.000 0.893 320 D CB 2.749 43.393 40.800 -0.260 0.000 1.019 320 D HN 0.095 8.392 8.370 -0.122 0.000 0.503 321 L N -2.518 118.517 121.223 -0.313 0.000 2.370 321 L HA 0.440 4.704 4.340 -0.295 -0.101 0.266 321 L C -2.119 174.603 176.870 -0.246 0.000 1.002 321 L CA -0.919 53.752 54.840 -0.282 0.000 0.818 321 L CB 4.180 46.096 42.059 -0.239 0.000 1.325 321 L HN -0.861 7.225 8.230 -0.240 0.000 0.418 322 V N 1.309 121.075 119.914 -0.247 0.000 2.370 322 V HA 0.222 4.072 4.120 -0.450 0.000 0.283 322 V C -1.092 174.878 176.094 -0.206 0.000 1.023 322 V CA -0.807 61.296 62.300 -0.328 0.000 0.857 322 V CB 1.242 32.867 31.823 -0.331 0.000 0.985 322 V HN 0.523 8.584 8.190 -0.214 0.000 0.443 323 S N 8.159 123.755 115.700 -0.173 0.000 2.475 323 S HA 0.633 5.308 4.470 -0.070 -0.248 0.281 323 S C -0.912 173.682 174.600 -0.011 0.000 1.198 323 S CA -0.257 57.908 58.200 -0.058 0.000 1.063 323 S CB 0.963 64.169 63.200 0.009 0.000 0.972 323 S HN -0.120 8.060 8.310 -0.216 0.000 0.486 324 V N 6.265 126.152 119.914 -0.045 0.000 2.380 324 V HA 0.214 4.257 4.120 -0.128 0.000 0.286 324 V C -0.840 175.253 176.094 -0.002 0.000 1.015 324 V CA -1.141 61.072 62.300 -0.145 0.000 0.834 324 V CB 1.645 33.138 31.823 -0.551 0.000 1.009 324 V HN 0.167 8.337 8.190 -0.033 0.000 0.428 325 G N 6.860 115.645 108.800 -0.024 0.000 2.600 325 G HA2 0.026 4.032 3.960 0.076 0.000 0.225 325 G HA3 0.026 4.009 3.960 0.038 0.000 0.225 325 G C 0.966 175.870 174.900 0.006 0.000 1.623 325 G CA 1.296 46.416 45.100 0.033 0.000 0.903 325 G HN 0.455 8.711 8.290 -0.056 0.000 0.574 326 R N 0.897 121.357 120.500 -0.067 0.000 2.127 326 R HA -0.352 3.982 4.340 -0.010 0.000 0.238 326 R C 2.490 178.734 176.300 -0.093 0.000 1.134 326 R CA 3.312 59.369 56.100 -0.071 0.000 0.975 326 R CB -0.272 29.946 30.300 -0.137 0.000 0.865 326 R HN 0.283 8.492 8.270 -0.102 0.000 0.447 327 A N -2.254 120.443 122.820 -0.206 0.000 2.019 327 A HA -0.129 4.101 4.320 -0.150 0.000 0.219 327 A C 2.151 179.617 177.584 -0.197 0.000 1.164 327 A CA 2.619 54.500 52.037 -0.260 0.000 0.644 327 A CB -1.018 17.645 19.000 -0.563 0.000 0.805 327 A HN 0.371 8.365 8.150 -0.261 0.000 0.449 328 H N -2.227 116.791 119.070 -0.086 0.000 2.502 328 H HA -0.051 4.776 4.556 0.115 -0.202 0.283 328 H C 2.205 177.574 175.328 0.068 0.000 1.015 328 H CA 2.905 58.976 56.048 0.039 0.000 1.298 328 H CB 0.196 29.970 29.762 0.020 0.000 1.411 328 H HN -0.426 7.795 8.280 -0.074 0.015 0.556 329 L N -1.703 119.616 121.223 0.161 0.000 2.072 329 L HA -0.332 4.127 4.340 0.198 0.000 0.205 329 L C 1.333 178.254 176.870 0.084 0.000 1.079 329 L CA 2.092 57.020 54.840 0.146 0.000 0.752 329 L CB -0.300 41.833 42.059 0.124 0.000 0.906 329 L HN -0.752 7.455 8.230 0.124 0.098 0.436 330 A N -2.927 119.915 122.820 0.036 0.000 1.902 330 A HA -0.188 4.131 4.320 -0.001 0.000 0.217 330 A C 0.056 177.648 177.584 0.013 0.000 1.181 330 A CA 1.953 53.993 52.037 0.005 0.000 0.623 330 A CB 0.570 19.554 19.000 -0.026 0.000 0.818 330 A HN -0.524 7.639 8.150 0.021 0.000 0.443 331 D N -4.947 115.482 120.400 0.048 0.000 2.386 331 D HA 0.435 5.085 4.640 0.017 0.000 0.247 331 D C -2.158 174.240 176.300 0.162 0.000 1.336 331 D CA -2.299 51.741 54.000 0.066 0.000 0.976 331 D CB 1.609 42.452 40.800 0.071 0.000 1.257 331 D HN -0.590 7.817 8.370 0.062 0.000 0.570 332 P HA -0.115 4.615 4.420 0.316 -0.121 0.221 332 P C -0.220 177.374 177.300 0.491 0.000 1.145 332 P CA 1.148 64.399 63.100 0.253 0.000 0.795 332 P CB 0.425 32.173 31.700 0.080 0.000 0.775 333 H N -3.440 115.782 119.070 0.253 0.000 2.568 333 H HA 0.172 4.912 4.556 0.307 0.000 0.302 333 H C 0.524 176.064 175.328 0.353 0.000 1.065 333 H CA -1.668 54.555 56.048 0.291 0.000 1.140 333 H CB -0.928 28.965 29.762 0.217 0.000 1.474 333 H HN -0.222 8.462 8.280 0.277 -0.237 0.545 334 W N 2.367 123.806 121.300 0.230 0.000 2.325 334 W HA -0.407 4.367 4.660 0.190 0.000 0.299 334 W C -0.111 176.561 176.519 0.254 0.000 1.215 334 W CA 4.920 62.332 57.345 0.111 0.000 1.244 334 W CB -0.009 29.235 29.460 -0.359 0.000 1.140 334 W HN -0.201 8.212 8.180 0.511 0.073 0.523 335 A N -2.362 120.749 122.820 0.486 0.000 1.940 335 A HA -0.468 3.990 4.320 0.231 0.000 0.219 335 A C 1.621 179.335 177.584 0.217 0.000 1.176 335 A CA 2.913 55.162 52.037 0.352 0.000 0.631 335 A CB -1.414 17.874 19.000 0.480 0.000 0.814 335 A HN 0.208 8.744 8.150 0.659 0.009 0.446 336 Y N 0.267 120.629 120.300 0.104 0.000 2.200 336 Y HA -0.328 4.209 4.550 -0.021 0.000 0.290 336 Y C 1.228 177.102 175.900 -0.043 0.000 1.137 336 Y CA 1.907 60.019 58.100 0.019 0.000 1.163 336 Y CB -0.188 38.298 38.460 0.043 0.000 0.988 336 Y HN -0.586 7.931 8.280 0.402 0.004 0.518 337 F N 0.640 120.341 119.950 -0.415 0.000 2.126 337 F HA -0.515 3.624 4.527 -0.648 0.000 0.299 337 F C 0.455 175.914 175.800 -0.567 0.000 1.096 337 F CA 2.831 60.497 58.000 -0.557 0.000 1.255 337 F CB -0.186 38.562 39.000 -0.420 0.000 0.997 337 F HN -0.699 7.658 8.300 0.096 0.000 0.479 338 A N -1.349 120.905 122.820 -0.943 0.000 1.902 338 A HA -0.456 3.212 4.320 -1.086 0.000 0.217 338 A C 1.355 178.679 177.584 -0.433 0.000 1.181 338 A CA 3.028 54.530 52.037 -0.892 0.000 0.623 338 A CB -0.871 17.513 19.000 -1.027 0.000 0.818 338 A HN 0.192 7.838 8.150 -0.840 0.000 0.443 339 A N -1.535 121.086 122.820 -0.331 0.000 1.908 339 A HA -0.442 3.453 4.320 -0.708 0.000 0.218 339 A C 1.908 179.232 177.584 -0.434 0.000 1.181 339 A CA 3.089 54.789 52.037 -0.561 0.000 0.627 339 A CB -0.751 17.839 19.000 -0.683 0.000 0.818 339 A HN -0.221 7.782 8.150 -0.244 0.000 0.445 340 K N -2.162 117.954 120.400 -0.473 0.000 2.026 340 K HA -0.328 3.817 4.320 -0.291 0.000 0.208 340 K C 3.316 179.701 176.600 -0.359 0.000 1.048 340 K CA 3.430 59.482 56.287 -0.392 0.000 0.929 340 K CB -0.217 32.010 32.500 -0.455 0.000 0.713 340 K HN -0.433 7.481 8.250 -0.560 0.000 0.439 341 E N -0.416 119.477 120.200 -0.513 0.000 2.110 341 E HA -0.246 3.894 4.350 -0.351 0.000 0.193 341 E C 1.890 178.341 176.600 -0.249 0.000 0.988 341 E CA 2.508 58.649 56.400 -0.432 0.000 0.804 341 E CB -0.200 29.104 29.700 -0.661 0.000 0.745 341 E HN -0.528 7.418 8.360 -0.690 0.000 0.458 342 L N -5.015 116.076 121.223 -0.220 0.000 2.592 342 L HA 0.122 4.414 4.340 -0.081 0.000 0.227 342 L C 0.238 177.049 176.870 -0.098 0.000 1.127 342 L CA -0.212 54.565 54.840 -0.105 0.000 0.884 342 L CB 0.305 42.355 42.059 -0.013 0.000 1.065 342 L HN -0.544 7.507 8.230 -0.266 0.019 0.457 343 G N -1.499 107.216 108.800 -0.140 0.000 2.160 343 G HA2 -0.369 3.524 3.960 -0.112 0.000 0.244 343 G HA3 -0.369 3.543 3.960 -0.080 0.000 0.244 343 G C 0.243 175.076 174.900 -0.111 0.000 1.022 343 G CA 0.262 45.296 45.100 -0.109 0.000 0.741 343 G HN -0.671 7.342 8.290 -0.180 0.169 0.508 344 V N 0.013 119.820 119.914 -0.178 0.000 2.673 344 V HA -0.263 3.769 4.120 -0.146 0.000 0.303 344 V C 0.120 176.136 176.094 -0.130 0.000 1.046 344 V CA 0.789 62.969 62.300 -0.200 0.000 1.126 344 V CB 0.661 32.217 31.823 -0.446 0.000 0.934 344 V HN -0.494 7.558 8.190 -0.230 0.000 0.487 345 E N 6.663 126.814 120.200 -0.081 0.000 2.384 345 E HA -0.125 4.206 4.350 -0.032 0.000 0.266 345 E C -0.452 176.139 176.600 -0.016 0.000 1.012 345 E CA 0.653 57.029 56.400 -0.040 0.000 0.901 345 E CB 0.464 30.147 29.700 -0.028 0.000 0.967 345 E HN 0.112 8.428 8.360 -0.073 0.000 0.435 346 K N -1.109 119.310 120.400 0.031 0.000 3.148 346 K HA -0.307 4.111 4.320 0.162 0.000 0.267 346 K C 0.492 177.179 176.600 0.144 0.000 0.996 346 K CA 0.384 56.747 56.287 0.127 0.000 0.737 346 K CB -2.835 29.735 32.500 0.116 0.000 1.308 346 K HN 0.610 8.876 8.250 0.027 0.000 0.470 347 A N -0.748 122.112 122.820 0.067 0.000 1.940 347 A HA -0.378 3.893 4.320 -0.081 0.000 0.219 347 A C 1.244 178.945 177.584 0.195 0.000 1.176 347 A CA 2.897 54.951 52.037 0.029 0.000 0.631 347 A CB -0.236 18.735 19.000 -0.047 0.000 0.814 347 A HN 0.056 8.232 8.150 0.045 0.000 0.446 348 S N -2.016 113.808 115.700 0.206 0.000 2.447 348 S HA -0.243 4.190 4.470 -0.061 0.000 0.233 348 S C 1.540 175.983 174.600 -0.262 0.000 1.006 348 S CA 2.045 60.216 58.200 -0.048 0.000 0.957 348 S CB -0.505 62.581 63.200 -0.190 0.000 0.773 348 S HN -0.093 8.319 8.310 0.199 0.017 0.507 349 W N -0.490 120.797 121.300 -0.022 0.000 3.204 349 W HA 0.233 4.976 4.660 -0.047 -0.111 0.249 349 W C 0.746 177.255 176.519 -0.016 0.000 1.322 349 W CA 0.533 57.857 57.345 -0.034 0.000 1.593 349 W CB -0.536 28.904 29.460 -0.034 0.000 1.122 349 W HN -0.497 7.816 8.180 0.273 0.030 0.710 350 T N 0.037 114.659 114.554 0.114 0.000 2.881 350 T HA -0.290 4.148 4.350 0.147 0.000 0.270 350 T C -0.268 174.457 174.700 0.042 0.000 1.068 350 T CA 3.870 66.039 62.100 0.115 0.000 1.131 350 T CB 0.069 69.031 68.868 0.157 0.000 0.871 350 T HN -0.487 7.761 8.240 0.104 0.054 0.479 351 L N -1.049 120.115 121.223 -0.098 0.000 2.387 351 L HA 0.516 4.770 4.340 -0.144 0.000 0.266 351 L C -1.939 174.812 176.870 -0.198 0.000 1.059 351 L CA -2.548 52.182 54.840 -0.184 0.000 0.801 351 L CB 0.138 42.020 42.059 -0.296 0.000 1.223 351 L HN -0.697 7.307 8.230 -0.159 0.130 0.456 352 P HA 0.064 4.425 4.420 -0.098 0.000 0.272 352 P C 0.076 177.166 177.300 -0.351 0.000 1.240 352 P CA -0.477 62.489 63.100 -0.223 0.000 0.791 352 P CB 0.449 31.983 31.700 -0.277 0.000 0.978 353 A N 1.216 123.904 122.820 -0.220 0.000 1.927 353 A HA -0.181 3.720 4.320 -0.699 0.000 0.220 353 A C -0.004 177.433 177.584 -0.245 0.000 1.185 353 A CA 4.545 56.418 52.037 -0.274 0.000 0.639 353 A CB -2.384 16.677 19.000 0.102 0.000 0.820 353 A HN 0.613 8.725 8.150 -0.064 0.000 0.451 354 P HA -0.101 4.418 4.420 0.166 0.000 0.228 354 P C -0.320 177.126 177.300 0.244 0.000 1.151 354 P CA 2.089 65.199 63.100 0.017 0.000 0.770 354 P CB -0.250 31.385 31.700 -0.108 0.000 0.786 355 Y N -3.875 116.390 120.300 -0.058 0.000 2.382 355 Y HA 0.002 4.581 4.550 0.048 0.000 0.292 355 Y C 1.929 177.656 175.900 -0.287 0.000 1.151 355 Y CA -0.522 57.520 58.100 -0.097 0.000 1.198 355 Y CB -0.507 37.828 38.460 -0.209 0.000 1.195 355 Y HN -0.407 7.704 8.280 -0.224 0.034 0.530 356 A N 0.613 123.156 122.820 -0.462 0.000 1.908 356 A HA -0.365 3.579 4.320 -0.760 -0.080 0.218 356 A C 1.550 178.621 177.584 -0.855 0.000 1.181 356 A CA 2.742 54.208 52.037 -0.952 0.000 0.627 356 A CB -0.738 17.125 19.000 -1.894 0.000 0.818 356 A HN -0.022 7.829 8.150 -0.499 0.000 0.445 357 H N -1.245 117.326 119.070 -0.831 0.000 2.387 357 H HA -0.237 4.129 4.556 -0.317 0.000 0.299 357 H C 2.008 176.965 175.328 -0.618 0.000 1.099 357 H CA 3.261 58.925 56.048 -0.641 0.000 1.315 357 H CB 0.098 29.367 29.762 -0.822 0.000 1.380 357 H HN -0.485 7.416 8.280 -0.609 0.013 0.513 358 W N -4.049 117.141 121.300 -0.183 0.000 3.003 358 W HA 0.026 4.564 4.660 -0.202 0.000 0.257 358 W C 0.452 176.829 176.519 -0.237 0.000 1.308 358 W CA 1.487 58.717 57.345 -0.193 0.000 1.529 358 W CB 0.325 29.706 29.460 -0.131 0.000 1.115 358 W HN -0.589 7.398 8.180 -0.287 0.022 0.659 359 L N -3.217 117.950 121.223 -0.094 0.000 2.640 359 L HA 0.115 4.425 4.340 -0.050 0.000 0.230 359 L C -0.087 176.822 176.870 0.066 0.000 1.123 359 L CA -0.718 54.088 54.840 -0.057 0.000 0.900 359 L CB 0.016 41.958 42.059 -0.194 0.000 1.146 359 L HN -0.804 7.279 8.230 -0.176 0.041 0.484 360 E N 0.089 120.272 120.200 -0.027 0.000 2.558 360 E HA -0.243 4.158 4.350 0.084 0.000 0.255 360 E C 0.387 177.046 176.600 0.098 0.000 0.968 360 E CA 0.801 57.229 56.400 0.047 0.000 0.939 360 E CB 0.077 29.789 29.700 0.020 0.000 0.921 360 E HN -0.547 7.737 8.360 -0.126 0.000 0.477 361 R N 3.214 123.784 120.500 0.117 0.000 3.251 361 R HA -0.176 4.216 4.340 0.088 0.000 0.249 361 R C -1.598 174.797 176.300 0.159 0.000 0.949 361 R CA -0.012 56.151 56.100 0.104 0.000 0.645 361 R CB -1.682 28.656 30.300 0.063 0.000 1.065 361 R HN 0.261 nan 8.270 nan 0.000 0.452 362 Y N 0.000 120.340 120.300 0.066 0.000 2.660 362 Y HA 0.000 4.551 4.550 0.002 0.000 0.201 362 Y CA 0.000 58.145 58.100 0.075 0.000 1.940 362 Y CB 0.000 38.516 38.460 0.094 0.000 1.050 362 Y HN 0.000 nan 8.280 nan 0.000 0.758