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 3jpz_1_B DATA FIRST_RESID 3 DATA SEQUENCE FQNDAKANFP DYANHGCVVG RHLNFEMYQR LFGKKTAHGV TVDKVIQPSV DATA SEQUENCE DNFGNCIGLI AGDEESYEVF KELFDAVINE KHKGFGPNDS QPAPDLDASK DATA SEQUENCE LVGGQFDEKY VKSCRIRTGR GIRGLCYPPS CTRGERREVE RVITTALAGL DATA SEQUENCE SGDLSGTYYP LSKMTPEQEN QLIADHFLFQ KPTGHLMVNS ASVRDWPDAR DATA SEQUENCE GIWHNNEKTF LIWINEEDHM RVISMQKGGN VKAVFERFGR GLNAIAEQMK DATA SEQUENCE KNGREYMWNQ RLGYLCACPS NLGTGLRASV HVQLHQLSKH PKFEDIVVAL DATA SEQUENCE QLQKRGTGGE HTAAVDDVYD ISNAARLKKS EREFVQLLID GVKKLIDMEQ DATA SEQUENCE ALEAGKSIDD LI 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 3 F HA 0.000 4.540 4.527 0.022 0.000 0.279 3 F C 0.000 175.820 175.800 0.033 0.000 0.967 3 F CA 0.000 58.016 58.000 0.026 0.000 1.383 3 F CB 0.000 39.017 39.000 0.027 0.000 1.145 4 Q N 4.989 124.298 119.800 -0.819 0.000 2.322 4 Q HA 0.141 4.099 4.340 -0.636 0.000 0.265 4 Q C -0.647 174.720 176.000 -1.056 0.000 0.985 4 Q CA -0.242 55.109 55.803 -0.754 0.000 0.849 4 Q CB 1.733 30.283 28.738 -0.312 0.000 1.274 4 Q HN 0.190 8.123 8.270 -0.561 0.000 0.449 5 N N 5.048 123.269 118.700 -0.798 0.000 3.111 5 N HA -0.081 4.517 4.740 -0.237 0.000 0.302 5 N C -0.932 174.567 175.510 -0.020 0.000 1.317 5 N CA -0.397 52.491 53.050 -0.270 0.000 1.151 5 N CB -0.405 38.111 38.487 0.047 0.000 1.456 5 N HN 0.334 8.344 8.380 -0.618 0.000 0.547 6 D N -0.568 119.709 120.400 -0.205 0.000 2.539 6 D HA 0.059 4.467 4.640 -0.387 0.000 0.276 6 D C 0.023 175.856 176.300 -0.779 0.000 1.206 6 D CA -1.431 52.328 54.000 -0.402 0.000 1.081 6 D CB 0.857 41.509 40.800 -0.245 0.000 1.142 6 D HN -0.654 7.476 8.370 -0.260 0.084 0.595 7 A N -2.000 120.196 122.820 -1.040 0.000 1.933 7 A HA -0.287 3.400 4.320 -1.056 0.000 0.218 7 A C 1.730 179.461 177.584 0.245 0.000 1.175 7 A CA 3.430 55.057 52.037 -0.682 0.000 0.628 7 A CB -0.389 18.273 19.000 -0.563 0.000 0.814 7 A HN 0.254 7.876 8.150 -0.880 0.000 0.444 8 K N -1.444 119.122 120.400 0.277 0.000 2.057 8 K HA -0.229 4.290 4.320 0.332 0.000 0.207 8 K C 1.649 178.337 176.600 0.146 0.000 1.049 8 K CA 2.615 59.062 56.287 0.266 0.000 0.931 8 K CB -0.298 32.253 32.500 0.085 0.000 0.714 8 K HN -0.086 8.319 8.250 0.123 -0.082 0.440 9 A N -3.742 119.133 122.820 0.092 0.000 2.119 9 A HA -0.064 4.330 4.320 0.122 0.000 0.217 9 A C 0.514 178.204 177.584 0.177 0.000 1.153 9 A CA 2.017 54.131 52.037 0.128 0.000 0.692 9 A CB 0.152 19.231 19.000 0.132 0.000 0.799 9 A HN -0.402 8.004 8.150 0.029 -0.238 0.458 10 N N -4.322 114.511 118.700 0.223 0.000 2.197 10 N HA 0.143 5.013 4.740 0.216 0.000 0.201 10 N C -0.998 174.615 175.510 0.171 0.000 1.148 10 N CA -0.106 53.116 53.050 0.287 0.000 0.883 10 N CB 2.237 41.043 38.487 0.532 0.000 1.012 10 N HN -0.746 7.604 8.380 0.225 0.165 0.507 11 F N 5.548 125.502 119.950 0.006 0.000 2.578 11 F HA -0.155 3.742 4.527 -1.049 0.000 0.381 11 F C -2.116 173.467 175.800 -0.363 0.000 1.069 11 F CA -2.126 55.662 58.000 -0.352 0.000 1.231 11 F CB 0.121 39.171 39.000 0.083 0.000 1.086 11 F HN -0.713 7.837 8.300 0.417 0.000 0.564 12 P HA -0.062 3.841 4.420 -0.861 0.000 0.268 12 P C -1.805 174.731 177.300 -1.274 0.000 1.208 12 P CA -0.413 61.942 63.100 -1.243 0.000 0.777 12 P CB 0.748 31.478 31.700 -1.617 0.000 0.875 13 D N 0.546 120.442 120.400 -0.840 0.000 2.456 13 D HA 0.056 4.430 4.640 -0.444 0.000 0.219 13 D C -0.699 175.242 176.300 -0.599 0.000 1.126 13 D CA -0.977 52.708 54.000 -0.524 0.000 0.890 13 D CB -0.180 40.481 40.800 -0.232 0.000 1.025 13 D HN 0.134 8.074 8.370 -0.716 0.000 0.511 14 Y N 3.526 123.588 120.300 -0.396 0.000 2.495 14 Y HA -0.049 3.939 4.550 -0.937 0.000 0.293 14 Y C -0.129 175.817 175.900 0.077 0.000 1.186 14 Y CA -0.722 57.137 58.100 -0.402 0.000 1.266 14 Y CB -0.629 37.622 38.460 -0.348 0.000 1.101 14 Y HN 0.018 8.128 8.280 -0.283 0.000 0.517 15 A N 0.135 123.098 122.820 0.237 0.000 2.520 15 A HA -0.125 4.307 4.320 0.186 0.000 0.245 15 A C -0.157 177.630 177.584 0.338 0.000 1.072 15 A CA 1.449 53.626 52.037 0.233 0.000 0.761 15 A CB -0.365 18.724 19.000 0.148 0.000 1.004 15 A HN -0.329 8.101 8.150 0.126 -0.203 0.499 16 N N -1.417 117.415 118.700 0.220 0.000 2.782 16 N HA -0.420 4.389 4.740 0.114 0.000 0.251 16 N C -1.596 174.020 175.510 0.176 0.000 1.101 16 N CA 1.510 54.664 53.050 0.173 0.000 0.764 16 N CB -1.513 37.056 38.487 0.138 0.000 1.122 16 N HN 0.466 8.948 8.380 0.170 0.000 0.561 17 H N -1.371 117.788 119.070 0.149 0.000 2.459 17 H HA 0.154 4.924 4.556 0.088 -0.161 0.332 17 H C 0.256 175.600 175.328 0.027 0.000 1.094 17 H CA 0.430 56.517 56.048 0.065 0.000 1.224 17 H CB 1.259 31.032 29.762 0.018 0.000 1.449 17 H HN -0.638 7.805 8.280 0.339 0.041 0.484 18 G N 1.806 110.667 108.800 0.102 0.000 3.088 18 G HA2 0.134 4.116 3.960 0.037 0.000 0.217 18 G HA3 0.134 4.275 3.960 0.034 -0.161 0.217 18 G C -0.778 174.131 174.900 0.014 0.000 1.159 18 G CA -0.680 44.447 45.100 0.044 0.000 0.760 18 G HN 0.122 8.464 8.290 0.086 0.000 0.550 19 C N 0.183 119.493 119.300 0.017 0.000 2.634 19 C HA -0.023 4.673 4.460 -0.022 -0.249 0.417 19 C C 1.520 176.458 174.990 -0.086 0.000 1.334 19 C CA -0.504 58.492 59.018 -0.037 0.000 1.829 19 C CB 1.021 28.734 27.740 -0.045 0.000 2.665 19 C HN -0.663 7.556 8.230 0.068 0.052 0.614 20 V N 4.209 124.090 119.914 -0.056 0.000 2.392 20 V HA -0.459 3.672 4.120 0.019 0.000 0.249 20 V C 2.225 178.315 176.094 -0.006 0.000 1.059 20 V CA 3.814 66.111 62.300 -0.005 0.000 1.051 20 V CB -0.169 31.654 31.823 0.000 0.000 0.658 20 V HN 0.152 8.314 8.190 -0.046 0.000 0.455 21 V N -0.256 119.575 119.914 -0.139 0.000 2.287 21 V HA -0.545 3.504 4.120 -0.119 0.000 0.248 21 V C 1.386 177.238 176.094 -0.403 0.000 1.053 21 V CA 4.455 66.624 62.300 -0.219 0.000 1.027 21 V CB -0.450 31.213 31.823 -0.265 0.000 0.646 21 V HN -0.439 7.638 8.190 -0.152 0.022 0.447 22 G N -4.017 104.307 108.800 -0.793 0.000 2.448 22 G HA2 -0.282 2.750 3.960 -1.546 0.000 0.219 22 G HA3 -0.282 2.938 3.960 -1.233 0.000 0.219 22 G C 0.108 174.760 174.900 -0.415 0.000 1.127 22 G CA 1.470 45.912 45.100 -1.097 0.000 0.766 22 G HN -0.567 7.279 8.290 -0.741 0.000 0.552 23 R N -2.478 117.847 120.500 -0.292 0.000 2.189 23 R HA -0.171 4.020 4.340 -0.248 0.000 0.218 23 R C 1.181 177.208 176.300 -0.456 0.000 1.074 23 R CA 1.672 57.577 56.100 -0.325 0.000 0.991 23 R CB 0.098 30.182 30.300 -0.360 0.000 0.883 23 R HN -0.681 7.304 8.270 -0.255 0.132 0.457 24 H N -4.067 114.944 119.070 -0.098 0.000 2.927 24 H HA 0.130 4.677 4.556 -0.015 0.000 0.255 24 H C 0.017 175.342 175.328 -0.005 0.000 0.974 24 H CA 0.464 56.489 56.048 -0.040 0.000 1.199 24 H CB 2.504 32.242 29.762 -0.040 0.000 1.447 24 H HN -0.399 7.687 8.280 -0.062 0.157 0.467 25 L N 3.173 124.444 121.223 0.079 0.000 2.391 25 L HA 0.042 4.486 4.340 0.172 0.000 0.249 25 L C -1.091 175.947 176.870 0.281 0.000 1.308 25 L CA -1.400 53.533 54.840 0.156 0.000 1.209 25 L CB -1.628 40.509 42.059 0.129 0.000 1.401 25 L HN -0.116 8.105 8.230 -0.016 0.000 0.416 26 N N 4.840 123.660 118.700 0.200 0.000 2.294 26 N HA -0.157 4.748 4.740 0.275 0.000 0.248 26 N C -0.150 175.398 175.510 0.064 0.000 1.300 26 N CA -1.518 51.639 53.050 0.179 0.000 0.925 26 N CB 0.407 38.946 38.487 0.087 0.000 1.188 26 N HN -0.476 7.952 8.380 0.146 0.040 0.512 27 F N 0.519 120.205 119.950 -0.441 0.000 2.146 27 F HA -0.285 3.539 4.527 -1.172 0.000 0.298 27 F C 0.917 176.585 175.800 -0.220 0.000 1.096 27 F CA 4.113 61.660 58.000 -0.755 0.000 1.275 27 F CB 0.089 38.574 39.000 -0.859 0.000 1.008 27 F HN 0.365 8.596 8.300 -0.114 0.000 0.480 28 E N -1.202 118.876 120.200 -0.203 0.000 2.085 28 E HA -0.379 3.793 4.350 -0.296 0.000 0.194 28 E C 2.444 178.946 176.600 -0.163 0.000 0.994 28 E CA 3.482 59.754 56.400 -0.212 0.000 0.801 28 E CB -0.972 28.691 29.700 -0.061 0.000 0.743 28 E HN 0.273 8.601 8.360 -0.053 0.000 0.453 29 M N 0.375 119.950 119.600 -0.043 0.000 2.159 29 M HA -0.360 4.133 4.480 0.021 0.000 0.263 29 M C 1.410 177.748 176.300 0.063 0.000 1.063 29 M CA 3.608 58.929 55.300 0.035 0.000 1.110 29 M CB 0.220 32.880 32.600 0.101 0.000 1.374 29 M HN -0.202 8.404 8.290 -0.013 -0.324 0.411 30 Y N -0.740 119.525 120.300 -0.059 0.000 2.293 30 Y HA -0.499 4.119 4.550 0.114 0.000 0.291 30 Y C 1.668 177.532 175.900 -0.060 0.000 1.137 30 Y CA 3.533 61.649 58.100 0.027 0.000 1.202 30 Y CB -0.063 38.515 38.460 0.196 0.000 0.990 30 Y HN -0.466 7.818 8.280 0.142 0.082 0.537 31 Q N -0.837 118.757 119.800 -0.343 0.000 2.079 31 Q HA -0.365 3.726 4.340 -0.415 0.000 0.200 31 Q C 1.630 177.528 176.000 -0.170 0.000 0.974 31 Q CA 2.906 58.473 55.803 -0.394 0.000 0.840 31 Q CB -0.170 28.226 28.738 -0.571 0.000 0.898 31 Q HN -0.263 7.652 8.270 -0.423 0.101 0.430 32 R N -3.079 117.351 120.500 -0.116 0.000 2.152 32 R HA -0.221 4.096 4.340 -0.038 0.000 0.232 32 R C 1.612 177.921 176.300 0.014 0.000 1.117 32 R CA 2.271 58.349 56.100 -0.037 0.000 0.981 32 R CB 0.262 30.553 30.300 -0.015 0.000 0.870 32 R HN -0.582 7.610 8.270 -0.130 0.000 0.451 33 L N -5.163 116.075 121.223 0.025 0.000 2.463 33 L HA 0.058 4.501 4.340 0.173 0.000 0.219 33 L C 0.067 176.964 176.870 0.046 0.000 1.088 33 L CA 0.278 55.189 54.840 0.119 0.000 0.849 33 L CB 0.577 42.754 42.059 0.196 0.000 1.012 33 L HN -0.807 7.389 8.230 -0.015 0.025 0.468 34 F N 1.770 121.556 119.950 -0.275 0.000 2.578 34 F HA -0.264 4.048 4.527 -0.357 0.000 0.381 34 F C 0.517 176.243 175.800 -0.124 0.000 1.069 34 F CA 2.757 60.562 58.000 -0.325 0.000 1.231 34 F CB 0.584 39.304 39.000 -0.466 0.000 1.086 34 F HN -0.524 7.642 8.300 -0.056 0.100 0.564 35 G N 5.267 113.767 108.800 -0.500 0.000 2.241 35 G HA2 -0.337 3.403 3.960 -0.367 0.000 0.244 35 G HA3 -0.337 3.558 3.960 -0.109 0.000 0.244 35 G C -0.942 173.901 174.900 -0.095 0.000 0.998 35 G CA -0.303 44.640 45.100 -0.260 0.000 0.621 35 G HN 0.224 8.052 8.290 -0.769 0.000 0.519 36 K N 2.630 123.018 120.400 -0.020 0.000 2.202 36 K HA 0.036 4.346 4.320 -0.018 0.000 0.264 36 K C -1.100 175.550 176.600 0.082 0.000 1.010 36 K CA 0.215 56.515 56.287 0.022 0.000 0.940 36 K CB 0.779 33.300 32.500 0.035 0.000 0.983 36 K HN -0.419 7.754 8.250 -0.000 0.077 0.475 37 K N -1.166 119.246 120.400 0.020 0.000 2.533 37 K HA 0.678 5.299 4.320 0.242 -0.156 0.272 37 K C -0.494 176.082 176.600 -0.040 0.000 0.985 37 K CA -1.874 54.460 56.287 0.079 0.000 0.876 37 K CB 3.660 36.200 32.500 0.067 0.000 1.452 37 K HN -0.073 8.159 8.250 -0.031 0.000 0.439 38 T N -3.202 111.349 114.554 -0.004 0.000 2.729 38 T HA 0.145 4.404 4.350 -0.152 0.000 0.298 38 T C 1.623 176.263 174.700 -0.100 0.000 1.013 38 T CA -1.880 60.173 62.100 -0.079 0.000 0.957 38 T CB 1.989 70.861 68.868 0.006 0.000 1.130 38 T HN 0.150 8.451 8.240 0.102 0.000 0.526 39 A N 0.577 123.264 122.820 -0.221 0.000 2.172 39 A HA -0.083 4.126 4.320 -0.185 0.000 0.216 39 A C 0.310 177.703 177.584 -0.319 0.000 1.154 39 A CA 2.052 53.911 52.037 -0.297 0.000 0.701 39 A CB -0.604 18.156 19.000 -0.400 0.000 0.789 39 A HN 0.644 8.641 8.150 -0.254 0.000 0.465 40 H N -2.986 116.094 119.070 0.017 0.000 2.594 40 H HA 0.128 4.697 4.556 0.022 0.000 0.279 40 H C -0.063 175.291 175.328 0.043 0.000 1.042 40 H CA -0.690 55.375 56.048 0.029 0.000 1.177 40 H CB -0.043 29.739 29.762 0.034 0.000 1.524 40 H HN -0.327 7.819 8.280 -0.130 0.056 0.537 41 G N -1.097 107.768 108.800 0.109 0.000 2.143 41 G HA2 -0.465 3.533 3.960 0.064 0.000 0.249 41 G HA3 -0.465 3.548 3.960 0.089 0.000 0.249 41 G C -0.590 174.385 174.900 0.125 0.000 0.981 41 G CA 0.493 45.649 45.100 0.093 0.000 0.665 41 G HN -0.412 7.753 8.290 0.059 0.161 0.528 42 V N 1.327 121.348 119.914 0.178 0.000 2.555 42 V HA -0.016 4.209 4.120 0.175 0.000 0.286 42 V C -0.598 175.684 176.094 0.313 0.000 1.044 42 V CA 0.287 62.723 62.300 0.227 0.000 1.026 42 V CB 0.270 32.267 31.823 0.290 0.000 0.981 42 V HN -0.620 7.641 8.190 0.187 0.041 0.480 43 T N 1.406 116.069 114.554 0.182 0.000 2.938 43 T HA 0.438 4.996 4.350 0.347 0.000 0.285 43 T C 0.309 174.797 174.700 -0.353 0.000 1.028 43 T CA -3.072 59.088 62.100 0.101 0.000 1.005 43 T CB 3.217 72.070 68.868 -0.024 0.000 1.157 43 T HN -0.486 7.818 8.240 0.107 0.000 0.550 44 V N 0.727 120.297 119.914 -0.573 0.000 2.427 44 V HA -0.409 2.904 4.120 -1.345 0.000 0.248 44 V C 0.440 176.375 176.094 -0.265 0.000 1.051 44 V CA 3.709 65.555 62.300 -0.756 0.000 1.048 44 V CB 0.019 31.604 31.823 -0.397 0.000 0.666 44 V HN 0.688 8.693 8.190 -0.308 0.000 0.456 45 D N -1.582 118.764 120.400 -0.090 0.000 2.123 45 D HA -0.363 4.342 4.640 0.109 0.000 0.196 45 D C 1.582 177.863 176.300 -0.031 0.000 0.992 45 D CA 3.567 57.584 54.000 0.029 0.000 0.833 45 D CB -0.647 40.192 40.800 0.064 0.000 0.954 45 D HN 0.017 8.319 8.370 -0.113 0.000 0.455 46 K N -0.311 120.054 120.400 -0.057 0.000 1.991 46 K HA -0.245 4.076 4.320 0.001 0.000 0.212 46 K C 2.849 179.429 176.600 -0.034 0.000 1.049 46 K CA 2.494 58.769 56.287 -0.021 0.000 0.932 46 K CB -0.261 32.249 32.500 0.017 0.000 0.717 46 K HN -0.725 7.480 8.250 -0.075 0.000 0.441 47 V N -4.442 115.416 119.914 -0.094 0.000 2.759 47 V HA -0.166 4.123 4.120 -0.002 -0.171 0.256 47 V C 1.467 177.487 176.094 -0.124 0.000 1.080 47 V CA 3.010 65.263 62.300 -0.079 0.000 1.101 47 V CB -0.020 31.755 31.823 -0.081 0.000 0.698 47 V HN -0.663 7.426 8.190 -0.170 0.000 0.477 48 I N -5.768 114.734 120.570 -0.114 0.000 3.860 48 I HA 0.357 4.586 4.170 -0.104 -0.121 0.319 48 I C 0.732 176.825 176.117 -0.039 0.000 1.279 48 I CA -0.830 60.426 61.300 -0.074 0.000 1.220 48 I CB -0.301 37.693 38.000 -0.010 0.000 1.027 48 I HN -0.477 7.636 8.210 -0.111 0.030 0.428 49 Q N 2.794 122.572 119.800 -0.036 0.000 2.062 49 Q HA -0.285 4.027 4.340 -0.046 0.000 0.209 49 Q C -0.990 174.993 176.000 -0.029 0.000 0.996 49 Q CA 4.802 60.586 55.803 -0.031 0.000 0.859 49 Q CB -2.651 26.083 28.738 -0.007 0.000 0.920 49 Q HN -0.436 7.705 8.270 -0.035 0.108 0.415 50 P HA -0.135 4.291 4.420 0.010 0.000 0.220 50 P C 1.118 178.412 177.300 -0.010 0.000 1.148 50 P CA 2.521 65.621 63.100 -0.001 0.000 0.803 50 P CB -0.763 30.943 31.700 0.010 0.000 0.782 51 S N -2.479 113.215 115.700 -0.009 0.000 2.423 51 S HA -0.190 4.290 4.470 0.018 0.000 0.231 51 S C 1.669 176.289 174.600 0.033 0.000 1.014 51 S CA 2.966 61.184 58.200 0.030 0.000 0.965 51 S CB -0.683 62.541 63.200 0.039 0.000 0.785 51 S HN -0.370 7.911 8.310 -0.017 0.019 0.495 52 V N 2.218 122.072 119.914 -0.100 0.000 2.500 52 V HA -0.238 3.499 4.120 -0.638 0.000 0.243 52 V C 0.884 176.851 176.094 -0.210 0.000 1.039 52 V CA 3.001 65.092 62.300 -0.348 0.000 1.053 52 V CB 0.249 31.840 31.823 -0.387 0.000 0.695 52 V HN -0.490 7.515 8.190 -0.081 0.137 0.463 53 D N -2.529 117.812 120.400 -0.098 0.000 2.097 53 D HA -0.156 4.484 4.640 -0.001 0.000 0.195 53 D C 0.265 176.550 176.300 -0.024 0.000 0.989 53 D CA 2.455 56.439 54.000 -0.027 0.000 0.827 53 D CB 0.252 41.060 40.800 0.012 0.000 0.966 53 D HN -0.510 7.813 8.370 -0.078 0.000 0.456 54 N N -0.743 117.923 118.700 -0.056 0.000 2.434 54 N HA 0.028 4.715 4.740 -0.087 0.000 0.272 54 N C -0.703 174.761 175.510 -0.077 0.000 1.040 54 N CA -0.222 52.781 53.050 -0.078 0.000 0.956 54 N CB 0.614 39.041 38.487 -0.101 0.000 1.108 54 N HN -0.550 7.804 8.380 -0.044 0.000 0.481 55 F N 3.014 122.859 119.950 -0.175 0.000 2.754 55 F HA -0.002 4.243 4.527 -0.471 0.000 0.297 55 F C 0.801 176.505 175.800 -0.161 0.000 1.122 55 F CA 1.080 58.887 58.000 -0.322 0.000 1.400 55 F CB 0.765 39.508 39.000 -0.428 0.000 1.117 55 F HN 0.272 8.697 8.300 0.208 0.000 0.587 56 G N -0.915 107.908 108.800 0.038 0.000 2.570 56 G HA2 -0.181 3.793 3.960 0.023 0.000 0.276 56 G HA3 -0.181 3.780 3.960 0.003 0.000 0.276 56 G C -1.528 173.383 174.900 0.019 0.000 1.346 56 G CA -0.825 44.285 45.100 0.018 0.000 1.034 56 G HN -0.608 7.929 8.290 0.009 -0.241 0.512 57 N N 0.295 119.004 118.700 0.016 0.000 2.401 57 N HA -0.028 4.719 4.740 0.012 0.000 0.255 57 N C -1.084 174.433 175.510 0.011 0.000 1.110 57 N CA 0.394 53.452 53.050 0.013 0.000 0.949 57 N CB -1.188 37.306 38.487 0.011 0.000 1.110 57 N HN 0.151 8.541 8.380 0.016 0.000 0.490 58 C N -1.518 117.784 119.300 0.003 0.000 3.295 58 C HA 0.323 4.783 4.460 0.001 0.000 0.341 58 C C -0.531 174.448 174.990 -0.019 0.000 1.418 58 C CA -2.304 56.713 59.018 -0.001 0.000 1.240 58 C CB 2.584 30.330 27.740 0.009 0.000 1.562 58 C HN -0.096 8.134 8.230 0.000 0.000 0.457 59 I N 2.013 122.566 120.570 -0.028 0.000 2.188 59 I HA -0.220 3.918 4.170 -0.052 0.000 0.237 59 I C 0.966 177.044 176.117 -0.065 0.000 1.073 59 I CA 2.607 63.876 61.300 -0.051 0.000 1.359 59 I CB 0.141 38.107 38.000 -0.057 0.000 1.083 59 I HN 0.761 8.958 8.210 -0.023 0.000 0.412 60 G N -4.919 103.850 108.800 -0.052 0.000 2.175 60 G HA2 -0.364 3.578 3.960 -0.029 0.000 0.244 60 G HA3 -0.364 3.564 3.960 -0.053 0.000 0.244 60 G C -1.089 173.757 174.900 -0.089 0.000 0.982 60 G CA -0.132 44.936 45.100 -0.052 0.000 0.641 60 G HN 0.160 8.427 8.290 -0.038 0.000 0.527 61 L N -0.565 120.581 121.223 -0.128 0.000 2.322 61 L HA 0.705 5.094 4.340 -0.236 -0.190 0.281 61 L C -2.312 174.484 176.870 -0.123 0.000 1.014 61 L CA -0.517 54.189 54.840 -0.224 0.000 0.815 61 L CB 2.613 44.427 42.059 -0.409 0.000 1.247 61 L HN -0.677 7.429 8.230 -0.112 0.057 0.421 62 I N 4.985 125.513 120.570 -0.069 0.000 2.569 62 I HA 0.365 4.689 4.170 0.060 -0.118 0.290 62 I C -2.633 173.584 176.117 0.166 0.000 1.088 62 I CA -2.096 59.231 61.300 0.044 0.000 1.047 62 I CB 4.757 42.773 38.000 0.026 0.000 1.237 62 I HN 0.398 8.553 8.210 -0.092 0.000 0.421 63 A N 7.714 130.656 122.820 0.202 0.000 2.450 63 A HA 0.078 4.601 4.320 0.339 0.000 0.255 63 A C -0.796 176.955 177.584 0.280 0.000 1.096 63 A CA 0.231 52.390 52.037 0.203 0.000 0.778 63 A CB 0.173 19.125 19.000 -0.080 0.000 1.031 63 A HN 0.233 8.460 8.150 0.128 0.000 0.494 64 G N 0.297 109.280 108.800 0.306 0.000 2.430 64 G HA2 -0.072 4.052 3.960 0.274 0.000 0.216 64 G HA3 -0.072 4.035 3.960 0.245 0.000 0.216 64 G C -1.328 173.778 174.900 0.344 0.000 1.146 64 G CA 0.548 45.826 45.100 0.297 0.000 0.793 64 G HN 0.246 8.711 8.290 0.291 0.000 0.537 65 D N -3.272 117.338 120.400 0.349 0.000 2.677 65 D HA 0.189 4.691 4.640 -0.230 0.000 0.298 65 D C -0.166 176.242 176.300 0.180 0.000 1.250 65 D CA -1.764 52.294 54.000 0.097 0.000 0.888 65 D CB 0.738 41.640 40.800 0.171 0.000 1.397 65 D HN -0.760 7.817 8.370 0.346 0.000 0.461 66 E N 0.334 120.537 120.200 0.005 0.000 2.110 66 E HA -0.419 4.160 4.350 0.381 0.000 0.193 66 E C 1.445 178.163 176.600 0.197 0.000 0.988 66 E CA 3.589 60.098 56.400 0.182 0.000 0.804 66 E CB 0.004 29.750 29.700 0.076 0.000 0.745 66 E HN 0.549 8.833 8.360 -0.126 0.000 0.458 67 E N -1.733 118.540 120.200 0.122 0.000 2.338 67 E HA -0.205 4.155 4.350 0.017 0.000 0.197 67 E C 1.984 178.568 176.600 -0.027 0.000 1.007 67 E CA 2.367 58.785 56.400 0.031 0.000 0.849 67 E CB -0.866 28.821 29.700 -0.021 0.000 0.774 67 E HN 0.464 8.899 8.360 0.146 0.013 0.506 68 S N 0.952 116.658 115.700 0.010 0.000 2.400 68 S HA -0.249 4.294 4.470 0.121 0.000 0.232 68 S C 1.575 175.919 174.600 -0.428 0.000 1.025 68 S CA 3.448 61.618 58.200 -0.050 0.000 0.993 68 S CB -0.333 62.859 63.200 -0.014 0.000 0.808 68 S HN -0.444 7.835 8.310 0.087 0.082 0.478 69 Y N -1.095 118.924 120.300 -0.469 0.000 2.373 69 Y HA -0.272 3.705 4.550 -0.955 0.000 0.293 69 Y C 1.358 177.138 175.900 -0.199 0.000 1.129 69 Y CA 3.315 61.094 58.100 -0.536 0.000 1.226 69 Y CB -0.352 37.888 38.460 -0.365 0.000 1.000 69 Y HN -0.633 7.557 8.280 -0.114 0.021 0.549 70 E N -0.498 119.685 120.200 -0.028 0.000 2.099 70 E HA -0.103 4.246 4.350 -0.002 0.000 0.191 70 E C 2.640 179.170 176.600 -0.116 0.000 0.962 70 E CA 1.640 58.015 56.400 -0.042 0.000 0.826 70 E CB -0.175 29.495 29.700 -0.050 0.000 0.788 70 E HN -0.634 7.572 8.360 -0.046 0.126 0.461 71 V N 0.095 119.848 119.914 -0.268 0.000 2.407 71 V HA -0.419 3.472 4.120 -0.383 0.000 0.248 71 V C 0.664 176.409 176.094 -0.581 0.000 1.055 71 V CA 3.738 65.716 62.300 -0.537 0.000 1.049 71 V CB 0.423 31.700 31.823 -0.911 0.000 0.662 71 V HN -0.096 7.935 8.190 -0.265 0.000 0.455 72 F N -5.149 114.869 119.950 0.113 0.000 2.923 72 F HA 0.358 4.977 4.527 0.153 0.000 0.314 72 F C -0.403 175.580 175.800 0.306 0.000 1.196 72 F CA -2.510 55.624 58.000 0.223 0.000 1.320 72 F CB -2.059 37.146 39.000 0.341 0.000 0.953 72 F HN -0.276 7.947 8.300 -0.129 0.000 0.505 73 K N 1.409 121.962 120.400 0.255 0.000 2.063 73 K HA -0.418 4.218 4.320 0.285 -0.145 0.208 73 K C 1.232 177.974 176.600 0.238 0.000 1.048 73 K CA 4.473 60.901 56.287 0.234 0.000 0.928 73 K CB 0.078 32.647 32.500 0.115 0.000 0.713 73 K HN -0.723 7.539 8.250 0.131 0.068 0.442 74 E N -2.174 118.136 120.200 0.183 0.000 2.106 74 E HA -0.266 4.157 4.350 0.121 0.000 0.192 74 E C 2.068 178.751 176.600 0.137 0.000 0.984 74 E CA 2.435 58.918 56.400 0.139 0.000 0.806 74 E CB -0.922 28.842 29.700 0.107 0.000 0.750 74 E HN 0.154 8.617 8.360 0.172 0.000 0.458 75 L N 1.050 122.372 121.223 0.165 0.000 2.023 75 L HA -0.224 4.146 4.340 0.050 0.000 0.205 75 L C 1.391 178.270 176.870 0.015 0.000 1.073 75 L CA 2.400 57.283 54.840 0.072 0.000 0.745 75 L CB -0.429 41.655 42.059 0.041 0.000 0.900 75 L HN -0.888 7.470 8.230 0.215 0.000 0.435 76 F N -0.998 118.996 119.950 0.074 0.000 2.069 76 F HA -0.553 3.997 4.527 0.038 0.000 0.298 76 F C 2.057 177.916 175.800 0.099 0.000 1.113 76 F CA 4.844 62.889 58.000 0.076 0.000 1.214 76 F CB -0.537 38.525 39.000 0.103 0.000 0.978 76 F HN -0.100 8.440 8.300 0.399 0.000 0.474 77 D N -1.228 119.352 120.400 0.301 0.000 2.133 77 D HA -0.398 4.394 4.640 0.253 0.000 0.195 77 D C 2.339 178.697 176.300 0.096 0.000 0.997 77 D CA 3.784 57.908 54.000 0.206 0.000 0.840 77 D CB -0.820 40.075 40.800 0.157 0.000 0.947 77 D HN 0.284 8.738 8.370 0.320 0.108 0.452 78 A N -0.657 122.164 122.820 0.002 0.000 1.877 78 A HA -0.225 4.023 4.320 -0.119 0.000 0.216 78 A C 2.207 179.553 177.584 -0.397 0.000 1.186 78 A CA 3.082 55.006 52.037 -0.189 0.000 0.620 78 A CB -0.507 18.368 19.000 -0.209 0.000 0.822 78 A HN -0.705 7.463 8.150 0.031 0.000 0.443 79 V N -1.212 118.518 119.914 -0.307 0.000 2.515 79 V HA -0.484 3.408 4.120 -0.379 0.000 0.250 79 V C 2.089 178.145 176.094 -0.063 0.000 1.058 79 V CA 4.273 66.423 62.300 -0.251 0.000 1.064 79 V CB -0.010 31.702 31.823 -0.185 0.000 0.675 79 V HN -0.514 7.549 8.190 -0.211 0.000 0.461 80 I N 0.216 120.834 120.570 0.080 0.000 2.252 80 I HA -0.519 3.815 4.170 0.273 0.000 0.245 80 I C 1.912 178.169 176.117 0.234 0.000 1.102 80 I CA 4.271 65.712 61.300 0.234 0.000 1.385 80 I CB -0.242 37.947 38.000 0.314 0.000 1.064 80 I HN 0.271 8.444 8.210 0.097 0.096 0.414 81 N N -0.284 118.511 118.700 0.159 0.000 2.069 81 N HA -0.377 4.726 4.740 0.248 -0.215 0.191 81 N C 1.655 177.236 175.510 0.118 0.000 1.031 81 N CA 3.253 56.399 53.050 0.160 0.000 0.852 81 N CB -0.239 38.298 38.487 0.084 0.000 1.018 81 N HN -0.142 8.301 8.380 0.104 0.000 0.423 82 E N -0.185 120.037 120.200 0.037 0.000 2.016 82 E HA -0.296 4.102 4.350 0.079 0.000 0.190 82 E C 2.814 179.425 176.600 0.017 0.000 0.985 82 E CA 3.138 59.568 56.400 0.050 0.000 0.802 82 E CB 0.058 29.804 29.700 0.077 0.000 0.762 82 E HN -0.630 7.710 8.360 -0.032 0.000 0.448 83 K N 0.296 120.664 120.400 -0.053 0.000 2.063 83 K HA -0.267 3.972 4.320 -0.134 0.000 0.208 83 K C 1.605 178.060 176.600 -0.241 0.000 1.048 83 K CA 2.225 58.401 56.287 -0.185 0.000 0.928 83 K CB -0.138 32.172 32.500 -0.316 0.000 0.713 83 K HN -0.310 7.907 8.250 -0.055 0.000 0.442 84 H N -3.429 115.662 119.070 0.034 0.000 2.519 84 H HA 0.200 4.768 4.556 0.020 0.000 0.289 84 H C -1.140 174.237 175.328 0.082 0.000 1.040 84 H CA -0.367 55.702 56.048 0.035 0.000 1.165 84 H CB -0.128 29.622 29.762 -0.020 0.000 1.462 84 H HN -0.619 7.684 8.280 0.055 0.011 0.555 85 K N -3.182 117.303 120.400 0.141 0.000 3.239 85 K HA -0.495 3.879 4.320 0.090 0.000 0.270 85 K C -1.239 175.445 176.600 0.141 0.000 1.049 85 K CA 0.905 57.261 56.287 0.115 0.000 0.769 85 K CB -3.023 29.534 32.500 0.094 0.000 1.305 85 K HN -0.204 7.921 8.250 0.101 0.185 0.469 86 G N -4.294 104.604 108.800 0.163 0.000 3.043 86 G HA2 -0.361 3.778 3.960 0.119 0.000 0.239 86 G HA3 -0.361 3.672 3.960 0.121 0.000 0.239 86 G C -2.419 172.617 174.900 0.227 0.000 1.042 86 G CA -0.057 45.133 45.100 0.149 0.000 1.189 86 G HN 0.057 8.449 8.290 0.168 0.000 0.578 87 F N 2.402 122.390 119.950 0.064 0.000 2.824 87 F HA 0.341 5.061 4.527 0.032 -0.174 0.375 87 F C -1.539 174.284 175.800 0.038 0.000 1.190 87 F CA -1.827 56.202 58.000 0.047 0.000 1.180 87 F CB 1.851 40.885 39.000 0.057 0.000 1.477 87 F HN -0.602 8.044 8.300 0.282 -0.177 0.542 88 G N 3.254 111.951 108.800 -0.171 0.000 2.563 88 G HA2 0.236 4.191 3.960 -0.009 0.000 0.283 88 G HA3 0.236 4.139 3.960 -0.095 0.000 0.283 88 G C -1.677 173.120 174.900 -0.171 0.000 1.309 88 G CA -1.740 43.297 45.100 -0.104 0.000 1.022 88 G HN -0.487 7.848 8.290 -0.232 -0.184 0.501 89 P HA -0.214 4.194 4.420 -0.020 0.000 0.218 89 P C 0.469 177.704 177.300 -0.108 0.000 1.148 89 P CA 1.851 64.918 63.100 -0.055 0.000 0.822 89 P CB 0.437 32.128 31.700 -0.016 0.000 0.784 90 N N -5.187 113.430 118.700 -0.137 0.000 2.336 90 N HA -0.068 4.606 4.740 -0.110 0.000 0.189 90 N C -0.848 174.534 175.510 -0.213 0.000 1.113 90 N CA -0.204 52.764 53.050 -0.137 0.000 0.858 90 N CB 0.119 38.549 38.487 -0.096 0.000 0.970 90 N HN -0.177 8.104 8.380 -0.132 0.021 0.471 91 D N 1.380 121.549 120.400 -0.386 0.000 2.264 91 D HA 0.153 4.560 4.640 -0.388 0.000 0.249 91 D C -1.651 174.324 176.300 -0.541 0.000 1.070 91 D CA 0.343 53.986 54.000 -0.595 0.000 0.912 91 D CB 1.630 41.767 40.800 -1.107 0.000 1.193 91 D HN -0.576 7.370 8.370 -0.425 0.168 0.427 92 S N -0.388 115.155 115.700 -0.262 0.000 2.538 92 S HA 0.159 4.769 4.470 0.040 -0.116 0.288 92 S C -1.006 173.696 174.600 0.170 0.000 1.108 92 S CA -1.582 56.613 58.200 -0.007 0.000 0.971 92 S CB 2.059 65.239 63.200 -0.033 0.000 1.041 92 S HN 0.055 8.234 8.310 -0.219 0.000 0.483 93 Q N 6.609 126.545 119.800 0.227 0.000 2.332 93 Q HA 0.162 4.626 4.340 0.206 0.000 0.263 93 Q C -1.921 174.135 176.000 0.093 0.000 0.979 93 Q CA -1.436 54.455 55.803 0.147 0.000 0.885 93 Q CB 0.367 29.104 28.738 -0.002 0.000 1.218 93 Q HN -0.081 8.184 8.270 0.187 0.117 0.405 94 P HA -0.106 4.357 4.420 0.072 0.000 0.266 94 P C -1.084 176.294 177.300 0.131 0.000 1.193 94 P CA -0.060 63.088 63.100 0.080 0.000 0.770 94 P CB 0.685 32.409 31.700 0.041 0.000 0.836 95 A N 2.624 125.527 122.820 0.138 0.000 2.531 95 A HA -0.077 4.410 4.320 0.278 0.000 0.236 95 A C -1.315 176.362 177.584 0.154 0.000 1.062 95 A CA -0.814 51.329 52.037 0.177 0.000 0.760 95 A CB -0.525 18.543 19.000 0.112 0.000 0.995 95 A HN 0.107 8.323 8.150 0.109 0.000 0.501 96 P HA 0.106 4.803 4.420 0.237 -0.135 0.269 96 P C -1.884 175.509 177.300 0.155 0.000 1.215 96 P CA -0.319 62.894 63.100 0.188 0.000 0.780 96 P CB 0.520 32.331 31.700 0.185 0.000 0.898 97 D N 1.444 121.973 120.400 0.214 0.000 2.479 97 D HA 0.138 4.865 4.640 0.145 0.000 0.246 97 D C -1.001 175.486 176.300 0.312 0.000 1.336 97 D CA -0.021 54.099 54.000 0.200 0.000 0.967 97 D CB 1.333 42.233 40.800 0.167 0.000 1.275 97 D HN -0.069 8.709 8.370 0.268 -0.248 0.577 98 L N 3.678 125.020 121.223 0.197 0.000 2.965 98 L HA 0.155 4.610 4.340 0.192 0.000 0.254 98 L C -0.899 175.892 176.870 -0.131 0.000 1.220 98 L CA -0.723 54.154 54.840 0.061 0.000 1.023 98 L CB 0.283 42.337 42.059 -0.010 0.000 1.355 98 L HN 0.192 8.498 8.230 0.127 0.000 0.545 99 D N 1.519 121.954 120.400 0.059 0.000 2.422 99 D HA 0.066 4.683 4.640 -0.038 0.000 0.227 99 D C 0.172 176.547 176.300 0.125 0.000 1.190 99 D CA -1.100 52.920 54.000 0.035 0.000 0.905 99 D CB 0.538 41.373 40.800 0.058 0.000 1.034 99 D HN -0.631 8.040 8.370 0.152 -0.209 0.507 100 A N 7.996 130.824 122.820 0.014 0.000 2.019 100 A HA -0.275 4.341 4.320 0.492 0.000 0.219 100 A C 1.347 179.014 177.584 0.139 0.000 1.164 100 A CA 2.528 54.680 52.037 0.191 0.000 0.644 100 A CB -0.335 18.709 19.000 0.074 0.000 0.805 100 A HN 0.212 8.282 8.150 -0.134 0.000 0.449 101 S N -2.330 113.411 115.700 0.069 0.000 2.469 101 S HA -0.206 4.290 4.470 0.044 0.000 0.238 101 S C 1.059 175.693 174.600 0.055 0.000 0.998 101 S CA 2.392 60.621 58.200 0.048 0.000 0.957 101 S CB -0.599 62.616 63.200 0.025 0.000 0.764 101 S HN -0.359 8.167 8.310 0.045 -0.189 0.514 102 K N -0.212 120.235 120.400 0.080 0.000 2.444 102 K HA -0.017 4.331 4.320 0.047 0.000 0.193 102 K C -0.033 176.606 176.600 0.066 0.000 1.024 102 K CA -0.347 55.981 56.287 0.067 0.000 1.077 102 K CB 0.016 32.561 32.500 0.074 0.000 0.833 102 K HN -0.759 7.511 8.250 0.102 0.041 0.517 103 L N -1.137 120.135 121.223 0.082 0.000 2.452 103 L HA -0.028 4.475 4.340 0.032 -0.144 0.267 103 L C 0.375 177.252 176.870 0.011 0.000 1.188 103 L CA -0.317 54.551 54.840 0.046 0.000 0.821 103 L CB 1.008 43.102 42.059 0.059 0.000 1.102 103 L HN -0.661 7.470 8.230 0.106 0.162 0.470 104 V N 1.001 120.908 119.914 -0.013 0.000 2.444 104 V HA 0.124 4.236 4.120 -0.014 0.000 0.294 104 V C -0.144 175.922 176.094 -0.045 0.000 1.022 104 V CA -0.783 61.505 62.300 -0.019 0.000 0.850 104 V CB 1.764 33.582 31.823 -0.010 0.000 0.992 104 V HN -0.192 8.237 8.190 -0.020 -0.251 0.426 105 G N 6.425 115.194 108.800 -0.052 0.000 2.338 105 G HA2 -0.273 3.646 3.960 -0.067 0.000 0.296 105 G HA3 -0.273 3.649 3.960 -0.064 0.000 0.296 105 G C 0.511 175.301 174.900 -0.184 0.000 1.040 105 G CA 0.271 45.322 45.100 -0.081 0.000 1.004 105 G HN 0.331 8.598 8.290 -0.038 0.000 0.509 106 G N -3.557 105.133 108.800 -0.183 0.000 3.279 106 G HA2 -0.183 3.522 3.960 -0.426 0.000 0.230 106 G HA3 -0.183 3.664 3.960 -0.188 0.000 0.230 106 G C -2.041 172.651 174.900 -0.345 0.000 1.230 106 G CA 0.021 44.945 45.100 -0.292 0.000 0.891 106 G HN 0.132 8.351 8.290 -0.119 0.000 0.518 107 Q N 0.252 119.879 119.800 -0.288 0.000 2.357 107 Q HA 0.454 4.837 4.340 -0.202 -0.164 0.266 107 Q C -0.978 174.915 176.000 -0.178 0.000 1.021 107 Q CA -1.877 53.805 55.803 -0.202 0.000 0.784 107 Q CB 1.073 29.773 28.738 -0.063 0.000 1.243 107 Q HN -0.378 7.681 8.270 -0.226 0.076 0.465 108 F N 7.341 127.318 119.950 0.045 0.000 2.380 108 F HA -0.001 4.551 4.527 0.042 0.000 0.325 108 F C -0.052 175.792 175.800 0.074 0.000 1.136 108 F CA -0.195 57.837 58.000 0.053 0.000 1.171 108 F CB 1.251 40.286 39.000 0.059 0.000 1.230 108 F HN 0.425 8.561 8.300 -0.089 0.111 0.554 109 D N 0.717 121.311 120.400 0.323 0.000 2.382 109 D HA -0.101 4.664 4.640 0.209 0.000 0.259 109 D C 0.316 176.784 176.300 0.279 0.000 1.224 109 D CA 0.057 54.218 54.000 0.269 0.000 0.894 109 D CB 0.128 41.110 40.800 0.305 0.000 1.127 109 D HN 0.056 8.629 8.370 0.338 0.000 0.487 110 E N 6.644 126.955 120.200 0.184 0.000 2.511 110 E HA -0.097 4.523 4.350 0.151 -0.179 0.196 110 E C 1.339 177.974 176.600 0.058 0.000 1.066 110 E CA 1.350 57.827 56.400 0.129 0.000 0.871 110 E CB -0.175 29.581 29.700 0.093 0.000 0.863 110 E HN 0.435 8.888 8.360 0.156 0.000 0.520 111 K N -1.312 119.105 120.400 0.029 0.000 2.365 111 K HA -0.169 4.056 4.320 -0.157 0.000 0.199 111 K C 2.158 178.494 176.600 -0.441 0.000 1.045 111 K CA 1.457 57.622 56.287 -0.204 0.000 0.962 111 K CB -0.457 31.875 32.500 -0.280 0.000 0.759 111 K HN -0.141 8.427 8.250 0.102 -0.257 0.469 112 Y N -2.442 117.875 120.300 0.028 0.000 2.678 112 Y HA 0.005 4.546 4.550 -0.015 0.000 0.274 112 Y C 0.411 176.304 175.900 -0.012 0.000 1.114 112 Y CA 1.632 59.730 58.100 -0.003 0.000 1.274 112 Y CB 2.385 40.837 38.460 -0.014 0.000 1.438 112 Y HN -0.525 7.733 8.280 0.214 0.150 0.493 113 V N -0.197 119.815 119.914 0.164 0.000 2.408 113 V HA -0.003 4.305 4.120 0.052 -0.157 0.267 113 V C 0.009 176.160 176.094 0.095 0.000 1.047 113 V CA 1.059 63.411 62.300 0.086 0.000 0.937 113 V CB 0.061 31.923 31.823 0.064 0.000 0.999 113 V HN -0.293 8.028 8.190 0.217 0.000 0.472 114 K N 5.519 125.966 120.400 0.079 0.000 2.352 114 K HA 0.187 4.537 4.320 0.050 0.000 0.194 114 K C -0.260 176.365 176.600 0.040 0.000 1.038 114 K CA -0.965 55.357 56.287 0.059 0.000 1.023 114 K CB 0.961 33.497 32.500 0.059 0.000 0.840 114 K HN 0.760 9.064 8.250 0.088 0.000 0.519 115 S N -3.458 112.267 115.700 0.041 0.000 2.578 115 S HA 0.399 5.158 4.470 0.011 -0.282 0.272 115 S C -2.083 172.525 174.600 0.014 0.000 1.145 115 S CA -0.311 57.879 58.200 -0.016 0.000 0.835 115 S CB 2.250 65.353 63.200 -0.163 0.000 1.104 115 S HN -0.707 7.645 8.310 0.069 0.000 0.458 116 C N -0.244 119.071 119.300 0.025 0.000 2.712 116 C HA 0.781 5.440 4.460 0.080 -0.151 0.308 116 C C -1.854 173.148 174.990 0.020 0.000 1.201 116 C CA -0.861 58.199 59.018 0.070 0.000 1.554 116 C CB 5.053 32.880 27.740 0.144 0.000 2.117 116 C HN 0.486 8.725 8.230 0.015 0.000 0.480 117 R N 2.551 123.057 120.500 0.011 0.000 2.561 117 R HA 0.839 5.369 4.340 -0.007 -0.194 0.266 117 R C -2.744 173.522 176.300 -0.056 0.000 1.091 117 R CA -0.657 55.430 56.100 -0.021 0.000 0.927 117 R CB 4.041 34.309 30.300 -0.054 0.000 1.240 117 R HN 0.539 8.823 8.270 0.024 0.000 0.449 118 I N 4.615 125.135 120.570 -0.084 0.000 2.478 118 I HA 0.497 4.704 4.170 -0.235 -0.178 0.287 118 I C -2.332 173.681 176.117 -0.173 0.000 1.042 118 I CA -1.004 60.150 61.300 -0.243 0.000 1.067 118 I CB 3.596 41.301 38.000 -0.492 0.000 1.233 118 I HN 0.784 8.973 8.210 -0.036 0.000 0.431 119 R N 7.994 128.410 120.500 -0.141 0.000 2.637 119 R HA 1.137 5.742 4.340 0.038 -0.242 0.291 119 R C -1.545 174.795 176.300 0.067 0.000 0.963 119 R CA -2.049 54.039 56.100 -0.020 0.000 0.901 119 R CB 4.132 34.376 30.300 -0.093 0.000 1.160 119 R HN 0.467 8.631 8.270 -0.177 0.000 0.457 120 T N 4.193 118.844 114.554 0.162 0.000 2.754 120 T HA 0.652 5.277 4.350 0.052 -0.244 0.296 120 T C -2.284 172.401 174.700 -0.025 0.000 1.205 120 T CA -2.759 59.400 62.100 0.098 0.000 1.009 120 T CB 2.022 71.028 68.868 0.230 0.000 1.368 120 T HN 0.238 8.574 8.240 0.160 0.000 0.509 121 G N -0.885 107.879 108.800 -0.060 0.000 2.563 121 G HA2 0.719 4.800 3.960 -0.097 0.000 0.302 121 G HA3 0.719 4.847 3.960 -0.052 -0.199 0.302 121 G C -1.761 173.041 174.900 -0.163 0.000 1.301 121 G CA -0.681 44.365 45.100 -0.089 0.000 0.965 121 G HN 0.067 8.332 8.290 -0.042 0.000 0.480 122 R N -0.135 120.261 120.500 -0.173 0.000 2.686 122 R HA 0.357 4.574 4.340 -0.205 0.000 0.283 122 R C -1.625 174.701 176.300 0.044 0.000 0.978 122 R CA -2.361 53.606 56.100 -0.220 0.000 0.897 122 R CB 4.294 34.185 30.300 -0.681 0.000 1.192 122 R HN 0.615 8.814 8.270 -0.118 0.000 0.457 123 G N -0.070 108.829 108.800 0.165 0.000 2.389 123 G HA2 0.556 4.702 3.960 0.310 0.000 0.328 123 G HA3 0.556 4.670 3.960 0.256 0.000 0.328 123 G C -1.672 173.472 174.900 0.406 0.000 1.133 123 G CA -1.725 43.553 45.100 0.297 0.000 0.891 123 G HN 0.285 8.675 8.290 0.167 0.000 0.485 124 I N 3.089 123.991 120.570 0.554 0.000 2.291 124 I HA 0.130 4.455 4.170 0.258 0.000 0.292 124 I C -0.554 175.660 176.117 0.162 0.000 1.064 124 I CA -2.125 59.328 61.300 0.255 0.000 1.269 124 I CB -1.128 36.907 38.000 0.058 0.000 1.418 124 I HN 0.131 8.991 8.210 1.083 0.000 0.485 125 R N 8.657 129.241 120.500 0.140 0.000 2.585 125 R HA -0.272 4.115 4.340 0.079 0.000 0.275 125 R C 0.755 177.083 176.300 0.047 0.000 1.018 125 R CA 1.924 58.079 56.100 0.091 0.000 1.072 125 R CB 0.563 30.928 30.300 0.107 0.000 0.953 125 R HN -0.000 8.369 8.270 0.166 0.000 0.419 126 G N 3.488 112.313 108.800 0.042 0.000 2.213 126 G HA2 -0.345 3.683 3.960 0.114 0.000 0.226 126 G HA3 -0.345 3.637 3.960 0.037 0.000 0.226 126 G C -1.276 173.598 174.900 -0.043 0.000 0.992 126 G CA -0.317 44.812 45.100 0.048 0.000 0.632 126 G HN 0.578 8.897 8.290 0.048 0.000 0.511 127 L N -0.933 120.228 121.223 -0.104 0.000 2.362 127 L HA 0.197 4.403 4.340 -0.224 0.000 0.275 127 L C -0.288 176.476 176.870 -0.176 0.000 0.998 127 L CA -1.371 53.364 54.840 -0.175 0.000 0.820 127 L CB 2.360 44.303 42.059 -0.192 0.000 1.270 127 L HN -0.713 7.417 8.230 -0.054 0.067 0.415 128 C N 3.825 122.955 119.300 -0.283 0.000 2.702 128 C HA -0.296 3.975 4.460 -0.314 0.000 0.411 128 C C 0.013 175.054 174.990 0.085 0.000 1.286 128 C CA 2.279 61.179 59.018 -0.197 0.000 1.979 128 C CB 0.290 27.955 27.740 -0.124 0.000 2.728 128 C HN -0.128 8.166 8.230 -0.335 -0.265 0.652 129 Y N 2.657 123.027 120.300 0.116 0.000 2.330 129 Y HA -0.024 4.484 4.550 -0.070 0.000 0.341 129 Y C -0.053 175.922 175.900 0.125 0.000 1.278 129 Y CA -0.358 57.772 58.100 0.050 0.000 1.453 129 Y CB -1.013 37.442 38.460 -0.009 0.000 1.342 129 Y HN -0.160 8.108 8.280 -0.021 0.000 0.590 130 P HA -0.084 4.480 4.420 0.241 0.000 0.217 130 P C -1.401 176.012 177.300 0.189 0.000 1.148 130 P CA 3.247 66.489 63.100 0.237 0.000 0.834 130 P CB -1.298 30.528 31.700 0.209 0.000 0.783 131 P HA -0.054 4.570 4.420 0.125 -0.129 0.220 131 P C 0.791 178.171 177.300 0.134 0.000 1.148 131 P CA 2.230 65.415 63.100 0.142 0.000 0.803 131 P CB 0.089 31.869 31.700 0.132 0.000 0.782 132 S N -3.829 111.960 115.700 0.149 0.000 2.649 132 S HA 0.085 4.620 4.470 0.108 0.000 0.246 132 S C 0.093 174.749 174.600 0.094 0.000 1.057 132 S CA -0.268 58.004 58.200 0.119 0.000 1.051 132 S CB 1.935 65.213 63.200 0.130 0.000 1.018 132 S HN -0.181 8.205 8.310 0.175 0.030 0.569 133 C N 3.325 122.689 119.300 0.107 0.000 2.679 133 C HA -0.008 4.694 4.460 0.030 -0.224 0.417 133 C C 0.120 175.146 174.990 0.060 0.000 1.302 133 C CA -0.783 58.278 59.018 0.071 0.000 1.973 133 C CB 1.372 29.177 27.740 0.108 0.000 2.715 133 C HN -0.273 8.042 8.230 0.142 0.000 0.628 134 T N 1.556 116.130 114.554 0.033 0.000 2.824 134 T HA 0.248 4.625 4.350 0.046 0.000 0.277 134 T C 1.409 176.127 174.700 0.031 0.000 0.975 134 T CA -1.941 60.180 62.100 0.035 0.000 0.966 134 T CB 1.666 70.549 68.868 0.026 0.000 1.054 134 T HN 0.246 8.760 8.240 0.014 -0.265 0.533 135 R N -0.160 120.359 120.500 0.031 0.000 2.127 135 R HA -0.364 3.994 4.340 0.029 0.000 0.238 135 R C 2.510 178.815 176.300 0.008 0.000 1.134 135 R CA 4.114 60.229 56.100 0.024 0.000 0.975 135 R CB -0.351 29.963 30.300 0.024 0.000 0.865 135 R HN 0.550 8.840 8.270 0.034 0.000 0.447 136 G N -1.296 107.506 108.800 0.005 0.000 2.414 136 G HA2 -0.248 3.707 3.960 -0.008 0.000 0.215 136 G HA3 -0.248 3.709 3.960 -0.004 0.000 0.215 136 G C 1.061 175.947 174.900 -0.024 0.000 1.188 136 G CA 1.353 46.449 45.100 -0.007 0.000 0.783 136 G HN -0.450 7.827 8.290 0.010 0.019 0.537 137 E N 1.967 122.150 120.200 -0.028 0.000 2.070 137 E HA -0.490 3.818 4.350 -0.071 0.000 0.197 137 E C 2.165 178.718 176.600 -0.079 0.000 1.004 137 E CA 3.363 59.727 56.400 -0.060 0.000 0.805 137 E CB -0.275 29.389 29.700 -0.060 0.000 0.744 137 E HN -0.455 7.894 8.360 -0.017 0.000 0.451 138 R N -1.293 119.184 120.500 -0.039 0.000 2.081 138 R HA -0.340 3.966 4.340 -0.056 0.000 0.235 138 R C 2.380 178.652 176.300 -0.047 0.000 1.131 138 R CA 3.150 59.231 56.100 -0.032 0.000 0.960 138 R CB -0.086 30.227 30.300 0.022 0.000 0.856 138 R HN -0.186 8.076 8.270 -0.013 0.000 0.436 139 R N -2.372 118.107 120.500 -0.034 0.000 2.096 139 R HA -0.289 4.037 4.340 -0.024 0.000 0.235 139 R C 2.444 178.713 176.300 -0.052 0.000 1.127 139 R CA 3.464 59.545 56.100 -0.032 0.000 0.968 139 R CB -0.143 30.146 30.300 -0.019 0.000 0.861 139 R HN -0.168 8.087 8.270 -0.025 0.000 0.440 140 E N 0.160 120.320 120.200 -0.066 0.000 2.106 140 E HA -0.214 4.096 4.350 -0.067 0.000 0.192 140 E C 2.098 178.632 176.600 -0.111 0.000 0.984 140 E CA 2.726 59.079 56.400 -0.079 0.000 0.806 140 E CB -0.629 29.025 29.700 -0.077 0.000 0.750 140 E HN -0.240 7.995 8.360 -0.064 0.087 0.458 141 V N 0.409 120.231 119.914 -0.153 0.000 2.332 141 V HA -0.557 3.432 4.120 -0.218 0.000 0.248 141 V C 1.511 177.527 176.094 -0.131 0.000 1.055 141 V CA 4.830 67.007 62.300 -0.205 0.000 1.038 141 V CB -0.169 31.446 31.823 -0.346 0.000 0.651 141 V HN -0.023 7.994 8.190 -0.154 0.081 0.450 142 E N -0.473 119.670 120.200 -0.096 0.000 2.072 142 E HA -0.431 3.861 4.350 -0.095 0.000 0.191 142 E C 1.755 178.271 176.600 -0.140 0.000 0.985 142 E CA 3.298 59.643 56.400 -0.092 0.000 0.801 142 E CB -0.189 29.493 29.700 -0.030 0.000 0.750 142 E HN -0.527 7.697 8.360 -0.083 0.086 0.452 143 R N 0.257 120.694 120.500 -0.105 0.000 2.070 143 R HA -0.283 3.992 4.340 -0.108 0.000 0.232 143 R C 2.408 178.636 176.300 -0.120 0.000 1.138 143 R CA 3.410 59.449 56.100 -0.103 0.000 0.936 143 R CB -0.058 30.199 30.300 -0.071 0.000 0.839 143 R HN -0.542 7.676 8.270 -0.086 0.000 0.429 144 V N -0.431 119.418 119.914 -0.109 0.000 2.250 144 V HA -0.524 3.536 4.120 -0.100 0.000 0.250 144 V C 2.451 178.468 176.094 -0.128 0.000 1.060 144 V CA 4.232 66.467 62.300 -0.108 0.000 1.030 144 V CB 0.022 31.788 31.823 -0.096 0.000 0.643 144 V HN -0.080 8.048 8.190 -0.104 0.000 0.445 145 I N -2.386 118.101 120.570 -0.140 0.000 2.202 145 I HA -0.473 3.612 4.170 -0.141 0.000 0.242 145 I C 1.943 177.907 176.117 -0.255 0.000 1.091 145 I CA 3.974 65.175 61.300 -0.165 0.000 1.368 145 I CB -0.050 37.871 38.000 -0.131 0.000 1.058 145 I HN -0.472 7.658 8.210 -0.133 0.000 0.410 146 T N -1.345 113.024 114.554 -0.308 0.000 2.821 146 T HA -0.374 3.698 4.350 -0.464 0.000 0.267 146 T C 2.401 176.961 174.700 -0.233 0.000 1.046 146 T CA 4.521 66.388 62.100 -0.390 0.000 1.139 146 T CB -0.013 68.541 68.868 -0.524 0.000 0.871 146 T HN 0.257 8.324 8.240 -0.289 0.000 0.454 147 T N -0.329 114.122 114.554 -0.172 0.000 2.821 147 T HA -0.334 3.959 4.350 -0.096 0.000 0.267 147 T C 1.730 176.355 174.700 -0.125 0.000 1.046 147 T CA 3.183 65.212 62.100 -0.118 0.000 1.139 147 T CB -0.065 68.748 68.868 -0.092 0.000 0.871 147 T HN -0.065 8.074 8.240 -0.170 0.000 0.454 148 A N 1.925 124.652 122.820 -0.155 0.000 1.873 148 A HA -0.217 4.023 4.320 -0.133 0.000 0.215 148 A C 2.459 179.925 177.584 -0.197 0.000 1.186 148 A CA 2.586 54.527 52.037 -0.160 0.000 0.616 148 A CB -0.506 18.395 19.000 -0.164 0.000 0.823 148 A HN -0.658 7.393 8.150 -0.165 0.000 0.442 149 L N -1.882 119.161 121.223 -0.299 0.000 2.083 149 L HA -0.376 3.666 4.340 -0.496 0.000 0.209 149 L C 2.581 179.358 176.870 -0.156 0.000 1.083 149 L CA 2.683 57.250 54.840 -0.454 0.000 0.752 149 L CB -0.504 40.986 42.059 -0.948 0.000 0.899 149 L HN -0.027 8.012 8.230 -0.318 0.000 0.433 150 A N -1.908 120.869 122.820 -0.072 0.000 2.067 150 A HA -0.170 4.218 4.320 0.114 0.000 0.219 150 A C 1.033 178.625 177.584 0.014 0.000 1.158 150 A CA 2.014 54.069 52.037 0.030 0.000 0.661 150 A CB -0.493 18.513 19.000 0.009 0.000 0.801 150 A HN -0.254 7.814 8.150 -0.115 0.014 0.452 151 G N -3.107 105.673 108.800 -0.033 0.000 2.985 151 G HA2 0.015 3.964 3.960 -0.018 0.000 0.209 151 G HA3 0.015 4.114 3.960 -0.049 -0.168 0.209 151 G C -0.468 174.417 174.900 -0.025 0.000 1.165 151 G CA -0.393 44.688 45.100 -0.032 0.000 0.776 151 G HN -0.454 7.658 8.290 -0.066 0.138 0.541 152 L N 0.592 121.808 121.223 -0.011 0.000 2.371 152 L HA 0.156 4.479 4.340 -0.028 0.000 0.272 152 L C -0.620 176.284 176.870 0.056 0.000 1.124 152 L CA 0.194 55.036 54.840 0.004 0.000 0.816 152 L CB 0.398 42.459 42.059 0.004 0.000 1.129 152 L HN -0.771 7.285 8.230 -0.008 0.169 0.448 153 S N 0.400 116.118 115.700 0.031 0.000 2.998 153 S HA 0.449 4.955 4.470 0.061 0.000 0.323 153 S C 0.179 174.794 174.600 0.024 0.000 1.141 153 S CA -1.385 56.837 58.200 0.037 0.000 0.873 153 S CB 2.589 65.799 63.200 0.017 0.000 1.315 153 S HN -0.204 8.109 8.310 0.004 0.000 0.637 154 G N 1.310 110.121 108.800 0.019 0.000 2.574 154 G HA2 -0.449 3.518 3.960 0.011 0.000 0.286 154 G HA3 -0.449 3.510 3.960 -0.002 0.000 0.286 154 G C -0.082 174.831 174.900 0.022 0.000 1.212 154 G CA 0.973 46.079 45.100 0.011 0.000 0.979 154 G HN 0.263 8.565 8.290 0.019 0.000 0.557 155 D N 2.078 122.484 120.400 0.010 0.000 2.350 155 D HA -0.233 4.430 4.640 0.037 0.000 0.216 155 D C 0.389 176.715 176.300 0.043 0.000 0.968 155 D CA 2.052 56.066 54.000 0.023 0.000 0.894 155 D CB -0.725 40.081 40.800 0.010 0.000 0.909 155 D HN 0.308 8.676 8.370 -0.004 0.000 0.520 156 L N -2.338 118.906 121.223 0.036 0.000 2.629 156 L HA 0.147 4.594 4.340 0.178 0.000 0.230 156 L C -0.432 176.599 176.870 0.267 0.000 1.151 156 L CA -0.813 54.105 54.840 0.131 0.000 0.924 156 L CB -0.286 41.770 42.059 -0.005 0.000 1.137 156 L HN -0.748 7.447 8.230 0.009 0.041 0.457 157 S N 0.355 116.148 115.700 0.155 0.000 2.537 157 S HA -0.110 4.468 4.470 0.180 0.000 0.286 157 S C -0.064 174.601 174.600 0.109 0.000 1.299 157 S CA 1.642 59.929 58.200 0.145 0.000 1.067 157 S CB 0.599 63.844 63.200 0.074 0.000 0.864 157 S HN -0.786 7.429 8.310 0.103 0.157 0.494 158 G N 2.746 111.615 108.800 0.115 0.000 2.634 158 G HA2 0.618 4.538 3.960 -0.335 0.000 0.309 158 G HA3 0.618 4.235 3.960 -0.665 -0.056 0.309 158 G C -1.912 172.835 174.900 -0.255 0.000 1.299 158 G CA 0.227 45.160 45.100 -0.278 0.000 0.798 158 G HN 0.179 8.594 8.290 0.208 0.000 0.490 159 T N 0.617 114.742 114.554 -0.716 0.000 2.933 159 T HA 0.215 4.429 4.350 -0.226 0.000 0.305 159 T C -2.461 171.950 174.700 -0.481 0.000 1.092 159 T CA -0.470 61.334 62.100 -0.493 0.000 1.008 159 T CB 3.187 71.701 68.868 -0.591 0.000 1.102 159 T HN -0.011 7.483 8.240 -1.243 0.000 0.469 160 Y N 6.123 126.264 120.300 -0.265 0.000 2.330 160 Y HA 0.200 4.960 4.550 0.139 -0.127 0.336 160 Y C -1.618 174.105 175.900 -0.295 0.000 1.036 160 Y CA -2.014 56.069 58.100 -0.030 0.000 1.125 160 Y CB 1.737 40.307 38.460 0.184 0.000 1.194 160 Y HN 0.348 8.630 8.280 0.003 0.000 0.469 161 Y N 6.411 126.415 120.300 -0.495 0.000 2.712 161 Y HA 0.349 4.687 4.550 -0.353 0.000 0.328 161 Y C -2.102 173.360 175.900 -0.729 0.000 0.995 161 Y CA -3.029 54.797 58.100 -0.457 0.000 1.283 161 Y CB 0.262 38.613 38.460 -0.183 0.000 1.092 161 Y HN 0.715 8.858 8.280 -0.227 0.000 0.519 162 P HA -0.055 4.164 4.420 -0.515 -0.108 0.265 162 P C 0.580 177.737 177.300 -0.239 0.000 1.193 162 P CA -0.113 62.718 63.100 -0.448 0.000 0.765 162 P CB 0.444 32.026 31.700 -0.196 0.000 0.823 163 L N 3.693 124.774 121.223 -0.237 0.000 2.083 163 L HA -0.351 3.846 4.340 -0.238 0.000 0.209 163 L C 2.081 178.850 176.870 -0.167 0.000 1.083 163 L CA 3.123 57.815 54.840 -0.246 0.000 0.752 163 L CB -0.614 41.221 42.059 -0.372 0.000 0.899 163 L HN 0.204 8.294 8.230 -0.233 0.000 0.433 164 S N -1.345 114.267 115.700 -0.146 0.000 2.442 164 S HA -0.209 4.205 4.470 -0.094 0.000 0.236 164 S C 0.664 175.227 174.600 -0.062 0.000 1.007 164 S CA 2.427 60.570 58.200 -0.094 0.000 0.965 164 S CB -0.118 63.038 63.200 -0.073 0.000 0.773 164 S HN 0.280 8.485 8.310 -0.152 0.014 0.504 165 K N -1.822 118.538 120.400 -0.066 0.000 2.413 165 K HA 0.162 4.464 4.320 -0.030 0.000 0.204 165 K C -1.120 175.462 176.600 -0.029 0.000 1.041 165 K CA -1.281 54.983 56.287 -0.039 0.000 1.082 165 K CB 0.775 33.255 32.500 -0.033 0.000 0.871 165 K HN -0.782 7.376 8.250 -0.086 0.041 0.535 166 M N 1.823 121.395 119.600 -0.046 0.000 2.356 166 M HA -0.177 4.495 4.480 -0.014 -0.200 0.348 166 M C 0.671 176.956 176.300 -0.026 0.000 1.595 166 M CA 0.244 55.522 55.300 -0.038 0.000 1.095 166 M CB 0.291 32.844 32.600 -0.077 0.000 1.963 166 M HN -0.706 7.441 8.290 -0.067 0.103 0.459 167 T N 5.617 120.165 114.554 -0.009 0.000 2.882 167 T HA 0.422 4.765 4.350 -0.012 0.000 0.287 167 T C -0.258 174.428 174.700 -0.025 0.000 1.014 167 T CA -3.542 58.552 62.100 -0.010 0.000 1.049 167 T CB 0.841 69.711 68.868 0.004 0.000 1.001 167 T HN -0.025 8.449 8.240 0.007 -0.230 0.525 168 P HA -0.163 4.236 4.420 -0.035 0.000 0.216 168 P C 1.524 178.804 177.300 -0.035 0.000 1.150 168 P CA 2.482 65.564 63.100 -0.029 0.000 0.837 168 P CB 0.101 31.788 31.700 -0.021 0.000 0.786 169 E N -1.946 118.238 120.200 -0.026 0.000 2.038 169 E HA -0.309 4.024 4.350 -0.029 0.000 0.195 169 E C 2.579 179.151 176.600 -0.048 0.000 1.000 169 E CA 3.776 60.160 56.400 -0.027 0.000 0.803 169 E CB -0.625 29.070 29.700 -0.009 0.000 0.750 169 E HN 0.264 8.613 8.360 -0.018 0.000 0.448 170 Q N -1.189 118.580 119.800 -0.051 0.000 2.096 170 Q HA -0.338 3.916 4.340 -0.143 0.000 0.204 170 Q C 2.377 178.283 176.000 -0.158 0.000 0.982 170 Q CA 3.030 58.761 55.803 -0.120 0.000 0.850 170 Q CB -0.065 28.623 28.738 -0.083 0.000 0.901 170 Q HN -0.409 7.844 8.270 -0.028 0.000 0.422 171 E N -0.566 119.570 120.200 -0.107 0.000 2.077 171 E HA -0.367 3.912 4.350 -0.119 0.000 0.193 171 E C 2.204 178.750 176.600 -0.091 0.000 0.989 171 E CA 3.017 59.356 56.400 -0.101 0.000 0.800 171 E CB -0.086 29.569 29.700 -0.076 0.000 0.746 171 E HN -0.313 7.987 8.360 -0.081 0.011 0.452 172 N N -1.211 117.443 118.700 -0.078 0.000 2.216 172 N HA -0.192 4.509 4.740 -0.066 0.000 0.183 172 N C 2.477 177.937 175.510 -0.084 0.000 1.017 172 N CA 2.685 55.693 53.050 -0.069 0.000 0.861 172 N CB -0.282 38.174 38.487 -0.053 0.000 0.986 172 N HN -0.439 7.898 8.380 -0.071 0.000 0.428 173 Q N 1.432 121.173 119.800 -0.100 0.000 2.084 173 Q HA -0.201 4.072 4.340 -0.112 0.000 0.202 173 Q C 2.292 178.192 176.000 -0.167 0.000 0.978 173 Q CA 2.676 58.405 55.803 -0.124 0.000 0.844 173 Q CB -0.400 28.267 28.738 -0.118 0.000 0.898 173 Q HN -0.555 7.656 8.270 -0.098 0.000 0.426 174 L N -1.392 119.741 121.223 -0.151 0.000 2.056 174 L HA -0.324 3.941 4.340 -0.124 0.000 0.207 174 L C 2.420 179.253 176.870 -0.062 0.000 1.078 174 L CA 3.117 57.899 54.840 -0.095 0.000 0.749 174 L CB -0.171 41.862 42.059 -0.043 0.000 0.901 174 L HN -0.354 7.786 8.230 -0.151 0.000 0.433 175 I N -0.778 119.750 120.570 -0.070 0.000 2.163 175 I HA -0.578 3.555 4.170 -0.062 0.000 0.243 175 I C 2.281 178.348 176.117 -0.083 0.000 1.085 175 I CA 4.176 65.432 61.300 -0.074 0.000 1.347 175 I CB -0.328 37.626 38.000 -0.076 0.000 1.044 175 I HN -0.307 7.856 8.210 -0.079 0.000 0.408 176 A N -1.013 121.757 122.820 -0.083 0.000 1.940 176 A HA -0.299 4.013 4.320 -0.014 0.000 0.219 176 A C 1.023 178.576 177.584 -0.052 0.000 1.176 176 A CA 2.663 54.666 52.037 -0.057 0.000 0.631 176 A CB -0.590 18.356 19.000 -0.090 0.000 0.814 176 A HN -0.217 7.877 8.150 -0.095 0.000 0.446 177 D N -4.751 115.505 120.400 -0.241 0.000 2.349 177 D HA 0.037 4.424 4.640 -0.421 0.000 0.215 177 D C -0.472 175.688 176.300 -0.233 0.000 1.016 177 D CA 0.977 54.649 54.000 -0.547 0.000 0.870 177 D CB 0.420 40.364 40.800 -1.426 0.000 0.917 177 D HN -0.716 7.374 8.370 -0.277 0.114 0.524 178 H N -3.890 115.115 119.070 -0.110 0.000 2.886 178 H HA -0.380 4.270 4.556 0.157 0.000 0.294 178 H C -1.483 174.135 175.328 0.483 0.000 1.246 178 H CA 1.129 57.267 56.048 0.151 0.000 1.142 178 H CB -2.299 27.540 29.762 0.128 0.000 1.358 178 H HN -0.301 7.840 8.280 0.059 0.174 0.406 179 F N -4.259 115.854 119.950 0.272 0.000 2.694 179 F HA 0.152 4.950 4.527 0.452 0.000 0.292 179 F C -0.299 175.846 175.800 0.574 0.000 1.121 179 F CA -1.599 56.642 58.000 0.400 0.000 1.352 179 F CB 0.892 40.028 39.000 0.226 0.000 1.107 179 F HN -0.057 8.468 8.300 0.376 0.000 0.597 180 L N -1.055 120.443 121.223 0.459 0.000 2.439 180 L HA -0.107 4.280 4.340 0.077 0.000 0.269 180 L C -1.245 175.679 176.870 0.089 0.000 1.179 180 L CA 0.441 55.377 54.840 0.160 0.000 0.828 180 L CB 0.926 42.993 42.059 0.012 0.000 1.106 180 L HN -0.806 7.632 8.230 0.347 0.000 0.467 181 F N -0.041 119.698 119.950 -0.352 0.000 2.603 181 F HA 0.344 4.694 4.527 -0.293 0.000 0.317 181 F C -1.658 174.051 175.800 -0.152 0.000 1.066 181 F CA -1.892 55.828 58.000 -0.466 0.000 0.941 181 F CB 1.956 40.210 39.000 -1.244 0.000 1.291 181 F HN -0.501 7.386 8.300 -0.689 0.000 0.472 182 Q N -0.466 119.385 119.800 0.086 0.000 2.572 182 Q HA 0.168 4.552 4.340 0.073 0.000 0.284 182 Q C -1.115 174.844 176.000 -0.069 0.000 1.091 182 Q CA -1.615 54.215 55.803 0.044 0.000 0.840 182 Q CB 2.949 31.660 28.738 -0.044 0.000 1.433 182 Q HN 0.147 8.494 8.270 0.128 0.000 0.471 183 K N 1.269 121.360 120.400 -0.515 0.000 2.430 183 K HA 0.028 2.823 4.320 -2.540 0.000 0.280 183 K C -1.904 174.293 176.600 -0.671 0.000 1.063 183 K CA -0.992 54.484 56.287 -1.352 0.000 1.071 183 K CB -0.173 31.574 32.500 -1.254 0.000 0.899 183 K HN 0.153 8.191 8.250 -0.354 0.000 0.473 184 P HA -0.036 4.267 4.420 -0.193 0.000 0.266 184 P C -1.059 176.091 177.300 -0.249 0.000 1.195 184 P CA 0.155 63.085 63.100 -0.283 0.000 0.768 184 P CB 0.582 32.169 31.700 -0.188 0.000 0.838 185 T N -2.720 111.729 114.554 -0.176 0.000 3.004 185 T HA 0.042 4.290 4.350 -0.170 0.000 0.266 185 T C 0.594 175.184 174.700 -0.184 0.000 0.986 185 T CA -0.752 61.247 62.100 -0.168 0.000 0.902 185 T CB 0.732 69.509 68.868 -0.151 0.000 1.118 185 T HN -0.283 7.869 8.240 -0.147 0.000 0.522 186 G N 1.831 110.541 108.800 -0.150 0.000 2.614 186 G HA2 -0.090 3.731 3.960 -0.232 0.000 0.239 186 G HA3 -0.090 3.818 3.960 -0.086 0.000 0.239 186 G C 0.413 175.231 174.900 -0.137 0.000 1.240 186 G CA -0.906 44.099 45.100 -0.158 0.000 0.842 186 G HN -0.347 7.872 8.290 -0.119 0.000 0.584 187 H N 2.840 121.913 119.070 0.004 0.000 2.321 187 H HA -0.337 4.225 4.556 0.010 0.000 0.300 187 H C 2.510 177.845 175.328 0.011 0.000 1.087 187 H CA 3.573 59.628 56.048 0.011 0.000 1.319 187 H CB -0.012 29.763 29.762 0.022 0.000 1.379 187 H HN 0.377 8.584 8.280 -0.122 0.000 0.501 188 L N -0.552 120.752 121.223 0.134 0.000 2.079 188 L HA -0.268 4.119 4.340 0.078 0.000 0.210 188 L C 1.359 178.263 176.870 0.056 0.000 1.081 188 L CA 3.247 58.134 54.840 0.078 0.000 0.752 188 L CB -0.720 41.371 42.059 0.054 0.000 0.896 188 L HN 0.119 8.430 8.230 0.134 0.000 0.433 189 M N -2.955 116.668 119.600 0.039 0.000 2.193 189 M HA -0.202 4.304 4.480 0.044 0.000 0.265 189 M C 2.614 178.932 176.300 0.030 0.000 1.071 189 M CA 2.188 57.506 55.300 0.031 0.000 1.140 189 M CB -0.654 31.950 32.600 0.006 0.000 1.369 189 M HN -0.768 7.529 8.290 0.030 0.012 0.423 190 V N 0.467 120.390 119.914 0.015 0.000 2.307 190 V HA -0.555 3.570 4.120 0.008 0.000 0.245 190 V C 2.471 178.594 176.094 0.048 0.000 1.045 190 V CA 4.647 66.957 62.300 0.017 0.000 1.024 190 V CB -0.237 31.583 31.823 -0.005 0.000 0.651 190 V HN 0.016 8.209 8.190 0.005 0.000 0.449 191 N N -1.283 117.458 118.700 0.068 0.000 2.457 191 N HA -0.132 4.646 4.740 0.063 0.000 0.180 191 N C 1.217 176.758 175.510 0.052 0.000 1.050 191 N CA 2.132 55.222 53.050 0.066 0.000 0.906 191 N CB -0.279 38.255 38.487 0.078 0.000 0.968 191 N HN 0.199 8.627 8.380 0.080 0.000 0.445 192 S N -2.612 113.121 115.700 0.055 0.000 2.593 192 S HA -0.006 4.493 4.470 0.049 0.000 0.217 192 S C -0.519 174.123 174.600 0.069 0.000 0.966 192 S CA 0.282 58.516 58.200 0.056 0.000 0.914 192 S CB 0.505 63.739 63.200 0.056 0.000 0.776 192 S HN -0.695 7.625 8.310 0.057 0.025 0.523 193 A N 0.198 123.059 122.820 0.068 0.000 2.872 193 A HA -0.420 3.944 4.320 0.073 0.000 0.273 193 A C -0.244 177.401 177.584 0.102 0.000 1.442 193 A CA 1.086 53.169 52.037 0.078 0.000 0.801 193 A CB -2.639 16.406 19.000 0.076 0.000 1.031 193 A HN -0.221 7.790 8.150 0.062 0.176 0.582 194 S N -2.924 112.838 115.700 0.103 0.000 2.593 194 S HA -0.086 4.585 4.470 0.148 -0.112 0.217 194 S C 0.035 174.746 174.600 0.185 0.000 0.966 194 S CA 1.875 60.157 58.200 0.136 0.000 0.914 194 S CB 0.517 63.787 63.200 0.117 0.000 0.776 194 S HN -0.094 8.257 8.310 0.086 0.011 0.523 195 V N 0.199 120.209 119.914 0.159 0.000 3.043 195 V HA 0.051 4.410 4.120 0.399 0.000 0.357 195 V C -1.494 174.758 176.094 0.263 0.000 1.372 195 V CA -1.454 60.976 62.300 0.217 0.000 1.214 195 V CB -0.684 31.134 31.823 -0.007 0.000 1.224 195 V HN -0.446 7.775 8.190 0.116 0.038 0.507 196 R N 1.841 122.475 120.500 0.223 0.000 2.594 196 R HA -0.103 4.334 4.340 0.162 0.000 0.272 196 R C -0.480 175.948 176.300 0.214 0.000 1.074 196 R CA 1.112 57.322 56.100 0.184 0.000 1.105 196 R CB 0.475 30.855 30.300 0.133 0.000 1.008 196 R HN -0.814 7.514 8.270 0.199 0.062 0.472 197 D N -2.540 117.966 120.400 0.176 0.000 2.945 197 D HA -0.371 4.340 4.640 0.118 0.000 0.225 197 D C -0.503 175.893 176.300 0.161 0.000 1.158 197 D CA 1.426 55.508 54.000 0.137 0.000 0.805 197 D CB -1.619 39.233 40.800 0.087 0.000 1.098 197 D HN 0.362 8.827 8.370 0.157 0.000 0.426 198 W N 0.860 122.185 121.300 0.042 0.000 2.193 198 W HA -0.081 4.611 4.660 0.053 0.000 0.338 198 W C -1.559 174.973 176.519 0.022 0.000 1.310 198 W CA 0.264 57.633 57.345 0.040 0.000 1.243 198 W CB 0.115 29.597 29.460 0.036 0.000 1.165 198 W HN -0.607 7.799 8.180 0.420 0.026 0.566 199 P HA 0.171 3.416 4.420 -1.958 0.000 0.254 199 P C -1.533 175.458 177.300 -0.515 0.000 1.620 199 P CA -1.000 61.551 63.100 -0.916 0.000 1.050 199 P CB 0.541 31.874 31.700 -0.612 0.000 1.539 200 D N 1.702 121.946 120.400 -0.259 0.000 2.487 200 D HA -0.267 4.302 4.640 -0.118 0.000 0.243 200 D C 0.395 176.614 176.300 -0.135 0.000 1.154 200 D CA 1.820 55.737 54.000 -0.138 0.000 0.876 200 D CB 0.857 41.626 40.800 -0.051 0.000 1.161 200 D HN -0.255 7.930 8.370 -0.178 0.079 0.478 201 A N 2.010 124.783 122.820 -0.078 0.000 2.899 201 A HA -0.372 4.194 4.320 0.020 -0.234 0.257 201 A C -1.418 176.160 177.584 -0.011 0.000 1.335 201 A CA 1.439 53.464 52.037 -0.020 0.000 0.924 201 A CB -1.041 17.950 19.000 -0.015 0.000 1.105 201 A HN 0.410 8.522 8.150 -0.063 0.000 0.765 202 R N -2.241 118.194 120.500 -0.109 0.000 2.540 202 R HA 0.464 5.016 4.340 0.069 -0.171 0.287 202 R C -0.093 176.242 176.300 0.059 0.000 0.980 202 R CA -2.004 54.058 56.100 -0.064 0.000 0.966 202 R CB 1.961 31.988 30.300 -0.454 0.000 1.106 202 R HN -0.734 7.363 8.270 -0.198 0.054 0.480 203 G N -1.013 107.963 108.800 0.292 0.000 2.506 203 G HA2 0.557 4.549 3.960 -0.058 0.000 0.292 203 G HA3 0.557 4.645 3.960 0.214 0.000 0.292 203 G C -3.191 172.012 174.900 0.506 0.000 1.425 203 G CA 0.523 45.755 45.100 0.220 0.000 0.788 203 G HN -0.284 8.276 8.290 0.450 0.000 0.490 204 I N -1.155 119.625 120.570 0.351 0.000 2.466 204 I HA 0.620 5.432 4.170 0.798 -0.163 0.289 204 I C -2.034 174.491 176.117 0.680 0.000 1.026 204 I CA -0.798 60.860 61.300 0.595 0.000 1.078 204 I CB 4.093 42.357 38.000 0.439 0.000 1.249 204 I HN -0.075 8.168 8.210 0.056 0.000 0.429 205 W N 9.655 131.276 121.300 0.535 0.000 2.702 205 W HA 0.842 5.940 4.660 0.389 -0.205 0.331 205 W C -2.292 174.421 176.519 0.323 0.000 1.049 205 W CA -1.909 55.685 57.345 0.415 0.000 1.230 205 W CB 3.732 33.410 29.460 0.362 0.000 1.408 205 W HN 0.871 9.571 8.180 0.867 0.000 0.492 206 H N 3.598 122.345 119.070 -0.539 0.000 2.996 206 H HA 0.830 5.279 4.556 -0.469 -0.174 0.368 206 H C -1.110 173.597 175.328 -1.036 0.000 1.185 206 H CA -2.059 53.613 56.048 -0.626 0.000 1.160 206 H CB 2.929 32.572 29.762 -0.198 0.000 1.820 206 H HN 0.205 7.865 8.280 -1.035 0.000 0.547 207 N N 0.562 118.954 118.700 -0.512 0.000 2.354 207 N HA -0.050 4.549 4.740 -0.467 -0.139 0.246 207 N C 1.448 177.020 175.510 0.102 0.000 1.285 207 N CA -1.148 51.761 53.050 -0.236 0.000 0.925 207 N CB 0.588 39.129 38.487 0.090 0.000 1.174 207 N HN -0.163 8.096 8.380 -0.201 0.000 0.478 208 N N -0.654 118.084 118.700 0.062 0.000 2.166 208 N HA -0.279 4.556 4.740 0.158 0.000 0.186 208 N C 0.173 175.773 175.510 0.149 0.000 1.019 208 N CA 2.716 55.837 53.050 0.120 0.000 0.856 208 N CB -0.217 38.310 38.487 0.066 0.000 0.993 208 N HN 0.280 8.674 8.380 0.024 0.000 0.426 209 E N -4.448 115.831 120.200 0.131 0.000 2.489 209 E HA -0.021 4.388 4.350 0.099 0.000 0.193 209 E C -0.438 176.251 176.600 0.149 0.000 1.057 209 E CA -0.390 56.081 56.400 0.118 0.000 0.866 209 E CB -0.095 29.663 29.700 0.096 0.000 0.916 209 E HN -0.153 8.268 8.360 0.122 0.013 0.500 210 K N -3.285 117.242 120.400 0.211 0.000 3.150 210 K HA -0.290 4.325 4.320 0.319 -0.104 0.267 210 K C -0.568 176.194 176.600 0.270 0.000 1.028 210 K CA 0.945 57.403 56.287 0.285 0.000 0.753 210 K CB -2.862 29.778 32.500 0.234 0.000 1.288 210 K HN -0.340 7.939 8.250 0.234 0.112 0.473 211 T N -8.089 106.606 114.554 0.236 0.000 3.043 211 T HA 0.284 4.866 4.350 0.203 -0.110 0.272 211 T C -1.011 173.888 174.700 0.332 0.000 0.990 211 T CA -1.495 60.745 62.100 0.234 0.000 0.897 211 T CB 2.511 71.501 68.868 0.204 0.000 1.111 211 T HN -0.240 8.407 8.240 0.243 -0.261 0.529 212 F N 3.116 123.125 119.950 0.097 0.000 2.573 212 F HA 0.733 5.518 4.527 0.122 -0.184 0.316 212 F C -2.907 172.965 175.800 0.120 0.000 1.148 212 F CA -0.710 57.379 58.000 0.149 0.000 0.940 212 F CB 4.428 43.597 39.000 0.281 0.000 1.214 212 F HN -0.413 8.306 8.300 0.311 -0.232 0.448 213 L N 6.880 127.976 121.223 -0.212 0.000 2.438 213 L HA 0.798 5.298 4.340 -0.011 -0.166 0.270 213 L C -2.752 174.032 176.870 -0.144 0.000 0.972 213 L CA -1.164 53.554 54.840 -0.204 0.000 0.831 213 L CB 4.630 46.328 42.059 -0.602 0.000 1.273 213 L HN 0.539 8.477 8.230 -0.486 0.000 0.405 214 I N 5.016 125.730 120.570 0.240 0.000 2.433 214 I HA 0.816 5.189 4.170 -0.015 -0.212 0.292 214 I C -1.272 175.133 176.117 0.480 0.000 1.001 214 I CA -2.436 58.986 61.300 0.203 0.000 1.119 214 I CB 2.466 40.594 38.000 0.214 0.000 1.289 214 I HN 0.869 9.274 8.210 0.502 0.106 0.438 215 W N 6.239 127.609 121.300 0.117 0.000 2.478 215 W HA 0.526 5.525 4.660 0.338 -0.136 0.318 215 W C -0.813 175.759 176.519 0.089 0.000 1.062 215 W CA -3.021 54.407 57.345 0.138 0.000 1.210 215 W CB 1.882 31.267 29.460 -0.125 0.000 1.325 215 W HN 0.589 8.903 8.180 0.223 0.000 0.496 216 I N 3.470 124.288 120.570 0.412 0.000 2.339 216 I HA 0.299 4.771 4.170 0.204 -0.179 0.290 216 I C -0.225 176.017 176.117 0.208 0.000 0.994 216 I CA -0.817 60.642 61.300 0.264 0.000 1.191 216 I CB 1.251 39.404 38.000 0.255 0.000 1.343 216 I HN 0.322 8.856 8.210 0.539 0.000 0.458 217 N N 3.684 122.481 118.700 0.161 0.000 2.747 217 N HA -0.432 4.520 4.740 0.202 -0.091 0.249 217 N C -0.382 175.215 175.510 0.144 0.000 1.107 217 N CA 1.639 54.783 53.050 0.158 0.000 0.707 217 N CB -1.792 36.763 38.487 0.113 0.000 1.054 217 N HN 0.628 9.001 8.380 0.173 0.111 0.555 218 E N -0.149 120.066 120.200 0.026 0.000 2.110 218 E HA -0.225 4.298 4.350 0.288 0.000 0.220 218 E C 0.343 177.024 176.600 0.134 0.000 0.893 218 E CA 2.555 58.958 56.400 0.004 0.000 1.027 218 E CB 0.342 29.677 29.700 -0.608 0.000 1.017 218 E HN -0.187 8.126 8.360 -0.028 0.030 0.522 219 E N -3.886 116.357 120.200 0.073 0.000 2.140 219 E HA -0.074 4.333 4.350 0.096 0.000 0.191 219 E C -0.083 176.560 176.600 0.072 0.000 0.973 219 E CA 1.266 57.715 56.400 0.081 0.000 0.829 219 E CB 1.094 30.830 29.700 0.059 0.000 0.781 219 E HN 0.010 8.395 8.360 0.041 0.000 0.466 220 D N -3.885 116.560 120.400 0.074 0.000 2.392 220 D HA 0.328 4.986 4.640 0.029 0.000 0.246 220 D C 0.356 176.758 176.300 0.171 0.000 1.013 220 D CA -1.482 52.558 54.000 0.067 0.000 0.993 220 D CB 2.486 43.305 40.800 0.032 0.000 1.219 220 D HN -0.490 7.926 8.370 0.077 0.000 0.538 221 H N -0.424 118.731 119.070 0.142 0.000 2.289 221 H HA -0.238 4.549 4.556 0.108 -0.167 0.296 221 H C 0.903 176.276 175.328 0.076 0.000 1.091 221 H CA 2.718 58.832 56.048 0.110 0.000 1.274 221 H CB 1.036 30.866 29.762 0.112 0.000 1.364 221 H HN 0.366 8.699 8.280 0.089 0.000 0.490 222 M N -2.979 116.732 119.600 0.185 0.000 2.165 222 M HA 0.593 5.313 4.480 0.109 -0.175 0.283 222 M C -2.480 173.830 176.300 0.016 0.000 0.978 222 M CA -1.245 54.105 55.300 0.085 0.000 0.948 222 M CB 3.286 35.908 32.600 0.038 0.000 1.599 222 M HN -0.448 7.946 8.290 0.173 0.000 0.450 223 R N 7.301 127.821 120.500 0.033 0.000 2.346 223 R HA 0.638 5.090 4.340 -0.062 -0.150 0.311 223 R C -2.072 174.148 176.300 -0.134 0.000 0.983 223 R CA -1.575 54.500 56.100 -0.042 0.000 0.880 223 R CB 2.238 32.538 30.300 0.001 0.000 1.100 223 R HN 0.810 9.138 8.270 0.096 0.000 0.453 224 V N 7.114 126.915 119.914 -0.189 0.000 2.487 224 V HA 0.446 4.483 4.120 -0.359 -0.133 0.298 224 V C -1.907 174.029 176.094 -0.264 0.000 1.028 224 V CA -0.925 61.196 62.300 -0.298 0.000 0.860 224 V CB 2.804 34.432 31.823 -0.325 0.000 0.991 224 V HN 0.475 8.576 8.190 -0.149 0.000 0.427 225 I N 6.824 127.133 120.570 -0.435 0.000 2.468 225 I HA 0.538 4.841 4.170 -0.128 -0.209 0.285 225 I C -1.559 174.369 176.117 -0.315 0.000 1.039 225 I CA -1.261 59.864 61.300 -0.291 0.000 1.074 225 I CB 3.315 41.107 38.000 -0.347 0.000 1.228 225 I HN 0.668 8.527 8.210 -0.586 0.000 0.436 226 S N 7.463 123.162 115.700 -0.001 0.000 2.480 226 S HA 0.711 5.504 4.470 0.255 -0.170 0.286 226 S C -1.156 173.522 174.600 0.130 0.000 1.180 226 S CA -1.541 56.789 58.200 0.216 0.000 1.075 226 S CB 1.109 64.629 63.200 0.532 0.000 0.996 226 S HN 0.332 8.723 8.310 0.136 0.000 0.487 227 M N 4.093 123.777 119.600 0.140 0.000 2.470 227 M HA 0.838 5.528 4.480 0.068 -0.169 0.285 227 M C -2.398 173.966 176.300 0.107 0.000 1.213 227 M CA -0.797 54.555 55.300 0.086 0.000 0.901 227 M CB 4.774 37.399 32.600 0.042 0.000 1.718 227 M HN 0.585 8.882 8.290 0.188 0.106 0.469 228 Q N -0.270 119.576 119.800 0.075 0.000 2.377 228 Q HA 0.458 4.844 4.340 0.077 0.000 0.279 228 Q C -1.531 174.492 176.000 0.038 0.000 1.049 228 Q CA -1.307 54.538 55.803 0.070 0.000 0.825 228 Q CB 5.144 33.932 28.738 0.084 0.000 1.401 228 Q HN 0.303 8.608 8.270 0.058 0.000 0.404 229 K N 0.342 120.759 120.400 0.028 0.000 2.319 229 K HA -0.222 4.199 4.320 -0.002 -0.102 0.265 229 K C 0.916 177.541 176.600 0.042 0.000 1.000 229 K CA 0.751 57.048 56.287 0.016 0.000 0.943 229 K CB 0.325 32.831 32.500 0.009 0.000 0.950 229 K HN 0.264 8.534 8.250 0.033 0.000 0.485 230 G N 0.609 109.439 108.800 0.050 0.000 2.587 230 G HA2 -0.277 3.728 3.960 0.075 0.000 0.212 230 G HA3 -0.277 3.818 3.960 0.072 -0.092 0.212 230 G C -0.796 174.177 174.900 0.123 0.000 1.327 230 G CA -0.731 44.415 45.100 0.077 0.000 0.898 230 G HN -0.188 8.021 8.290 0.040 0.106 0.551 231 G N -2.392 106.502 108.800 0.157 0.000 3.993 231 G HA2 0.105 4.267 3.960 0.337 0.000 0.294 231 G HA3 0.105 4.267 3.960 0.338 0.000 0.294 231 G C -1.421 173.576 174.900 0.161 0.000 1.043 231 G CA -0.331 44.931 45.100 0.270 0.000 0.839 231 G HN -0.031 8.656 8.290 0.131 -0.319 0.516 232 N N 1.846 120.600 118.700 0.090 0.000 3.124 232 N HA 0.090 4.932 4.740 -0.031 -0.121 0.284 232 N C -0.043 175.485 175.510 0.031 0.000 1.209 232 N CA -1.478 51.587 53.050 0.024 0.000 1.149 232 N CB -1.049 37.460 38.487 0.037 0.000 1.434 232 N HN -0.107 8.332 8.380 0.098 0.000 0.529 233 V N 4.110 124.011 119.914 -0.022 0.000 2.594 233 V HA -0.474 3.705 4.120 0.098 0.000 0.253 233 V C 0.667 176.790 176.094 0.049 0.000 1.069 233 V CA 2.883 65.201 62.300 0.030 0.000 1.082 233 V CB 0.063 31.892 31.823 0.010 0.000 0.680 233 V HN -0.382 7.693 8.190 -0.123 0.041 0.469 234 K N -0.314 120.086 120.400 0.001 0.000 2.026 234 K HA -0.330 4.073 4.320 0.139 0.000 0.208 234 K C 1.662 178.337 176.600 0.125 0.000 1.048 234 K CA 3.691 60.025 56.287 0.078 0.000 0.929 234 K CB -0.189 32.323 32.500 0.021 0.000 0.713 234 K HN -0.209 8.048 8.250 -0.067 -0.047 0.439 235 A N -1.016 121.854 122.820 0.084 0.000 1.933 235 A HA -0.207 4.157 4.320 0.074 0.000 0.218 235 A C 2.281 179.943 177.584 0.130 0.000 1.175 235 A CA 2.953 55.042 52.037 0.087 0.000 0.628 235 A CB -0.782 18.257 19.000 0.066 0.000 0.814 235 A HN -0.433 8.026 8.150 0.057 -0.275 0.444 236 V N -0.554 119.454 119.914 0.156 0.000 2.343 236 V HA -0.446 3.802 4.120 0.215 0.000 0.247 236 V C 2.208 178.487 176.094 0.309 0.000 1.051 236 V CA 4.071 66.496 62.300 0.209 0.000 1.036 236 V CB -0.034 31.887 31.823 0.164 0.000 0.654 236 V HN -0.441 7.829 8.190 0.134 0.000 0.451 237 F N 0.310 120.321 119.950 0.101 0.000 2.186 237 F HA -0.338 4.274 4.527 0.141 0.000 0.299 237 F C 1.279 177.203 175.800 0.207 0.000 1.090 237 F CA 2.306 60.386 58.000 0.133 0.000 1.307 237 F CB -0.063 38.972 39.000 0.058 0.000 1.019 237 F HN 0.100 8.610 8.300 0.350 0.000 0.489 238 E N 0.897 121.151 120.200 0.091 0.000 2.051 238 E HA -0.454 3.806 4.350 -0.149 0.000 0.192 238 E C 2.509 179.090 176.600 -0.031 0.000 0.991 238 E CA 3.566 59.941 56.400 -0.040 0.000 0.799 238 E CB -0.244 29.461 29.700 0.009 0.000 0.748 238 E HN 0.176 8.638 8.360 0.169 0.000 0.449 239 R N -1.804 118.730 120.500 0.057 0.000 2.092 239 R HA -0.276 4.002 4.340 -0.104 0.000 0.231 239 R C 2.256 178.593 176.300 0.062 0.000 1.119 239 R CA 3.059 59.158 56.100 -0.001 0.000 0.970 239 R CB -0.170 30.165 30.300 0.058 0.000 0.864 239 R HN -0.450 7.885 8.270 0.109 0.000 0.440 240 F N 0.614 120.666 119.950 0.170 0.000 2.026 240 F HA -0.383 4.558 4.527 0.690 0.000 0.296 240 F C 1.363 177.223 175.800 0.100 0.000 1.133 240 F CA 3.793 61.982 58.000 0.316 0.000 1.188 240 F CB -0.211 38.955 39.000 0.276 0.000 0.968 240 F HN -0.045 8.528 8.300 0.455 0.000 0.476 241 G N -3.289 105.481 108.800 -0.050 0.000 2.408 241 G HA2 -0.401 3.400 3.960 -0.265 0.000 0.217 241 G HA3 -0.401 3.396 3.960 -0.271 0.000 0.217 241 G C 0.628 175.414 174.900 -0.191 0.000 1.150 241 G CA 1.643 46.612 45.100 -0.219 0.000 0.776 241 G HN -0.038 8.242 8.290 -0.015 0.000 0.542 242 R N 2.139 122.535 120.500 -0.174 0.000 2.092 242 R HA -0.267 3.987 4.340 -0.143 0.000 0.231 242 R C 2.271 178.452 176.300 -0.198 0.000 1.119 242 R CA 3.021 59.021 56.100 -0.167 0.000 0.970 242 R CB -0.118 30.087 30.300 -0.158 0.000 0.864 242 R HN -0.416 7.756 8.270 -0.163 0.000 0.440 243 G N -0.922 107.716 108.800 -0.271 0.000 2.394 243 G HA2 -0.251 3.516 3.960 -0.323 0.000 0.214 243 G HA3 -0.251 3.438 3.960 -0.453 0.000 0.214 243 G C 1.012 175.857 174.900 -0.092 0.000 1.176 243 G CA 1.643 46.569 45.100 -0.290 0.000 0.786 243 G HN -0.298 7.825 8.290 -0.280 0.000 0.533 244 L N 2.324 123.478 121.223 -0.114 0.000 2.013 244 L HA -0.425 3.884 4.340 -0.052 0.000 0.212 244 L C 2.525 179.402 176.870 0.010 0.000 1.073 244 L CA 3.090 57.868 54.840 -0.104 0.000 0.753 244 L CB -0.273 41.596 42.059 -0.318 0.000 0.890 244 L HN -0.074 8.050 8.230 -0.177 0.000 0.432 245 N N -2.272 116.393 118.700 -0.058 0.000 2.244 245 N HA -0.342 4.379 4.740 -0.032 0.000 0.183 245 N C 2.029 177.486 175.510 -0.088 0.000 1.016 245 N CA 2.937 55.952 53.050 -0.058 0.000 0.866 245 N CB -0.526 37.916 38.487 -0.075 0.000 0.980 245 N HN -0.257 8.063 8.380 -0.100 0.000 0.430 246 A N 0.831 123.591 122.820 -0.101 0.000 1.897 246 A HA -0.170 4.087 4.320 -0.105 0.000 0.215 246 A C 1.825 179.338 177.584 -0.117 0.000 1.181 246 A CA 2.910 54.881 52.037 -0.111 0.000 0.620 246 A CB -0.308 18.617 19.000 -0.126 0.000 0.821 246 A HN -0.440 7.557 8.150 -0.108 0.088 0.443 247 I N -1.372 119.136 120.570 -0.105 0.000 2.252 247 I HA -0.555 3.531 4.170 -0.140 0.000 0.245 247 I C 1.545 177.561 176.117 -0.167 0.000 1.102 247 I CA 4.076 65.308 61.300 -0.113 0.000 1.385 247 I CB -0.085 37.883 38.000 -0.053 0.000 1.064 247 I HN -0.137 8.023 8.210 -0.084 0.000 0.414 248 A N -0.619 122.071 122.820 -0.217 0.000 1.908 248 A HA -0.343 3.582 4.320 -0.659 0.000 0.218 248 A C 1.685 179.104 177.584 -0.274 0.000 1.181 248 A CA 2.912 54.684 52.037 -0.442 0.000 0.627 248 A CB -0.898 17.818 19.000 -0.474 0.000 0.818 248 A HN -0.315 7.759 8.150 -0.127 0.000 0.445 249 E N -2.033 118.057 120.200 -0.182 0.000 2.077 249 E HA -0.344 3.923 4.350 -0.140 0.000 0.193 249 E C 3.051 179.573 176.600 -0.130 0.000 0.989 249 E CA 2.830 59.146 56.400 -0.140 0.000 0.800 249 E CB -0.128 29.507 29.700 -0.109 0.000 0.746 249 E HN -0.533 7.730 8.360 -0.161 0.000 0.452 250 Q N -1.282 118.439 119.800 -0.130 0.000 2.170 250 Q HA -0.268 4.011 4.340 -0.100 0.000 0.203 250 Q C 2.803 178.728 176.000 -0.125 0.000 0.976 250 Q CA 2.429 58.162 55.803 -0.117 0.000 0.858 250 Q CB -0.283 28.384 28.738 -0.119 0.000 0.907 250 Q HN -0.334 7.856 8.270 -0.134 0.000 0.433 251 M N -1.399 118.106 119.600 -0.159 0.000 2.374 251 M HA -0.317 4.082 4.480 -0.136 0.000 0.264 251 M C 1.118 177.337 176.300 -0.135 0.000 1.067 251 M CA 3.539 58.744 55.300 -0.159 0.000 1.103 251 M CB -0.386 32.080 32.600 -0.223 0.000 1.402 251 M HN 0.037 8.109 8.290 -0.184 0.108 0.444 252 K N -1.431 118.890 120.400 -0.131 0.000 2.280 252 K HA -0.211 4.049 4.320 -0.100 0.000 0.202 252 K C 2.718 179.270 176.600 -0.080 0.000 1.047 252 K CA 2.724 58.950 56.287 -0.102 0.000 0.942 252 K CB -0.638 31.805 32.500 -0.096 0.000 0.739 252 K HN -0.527 7.504 8.250 -0.140 0.134 0.457 253 K N -0.881 119.471 120.400 -0.080 0.000 2.211 253 K HA -0.206 4.079 4.320 -0.058 0.000 0.203 253 K C 1.047 177.611 176.600 -0.061 0.000 1.050 253 K CA 2.285 58.532 56.287 -0.066 0.000 0.945 253 K CB -0.183 32.278 32.500 -0.066 0.000 0.732 253 K HN -0.433 7.623 8.250 -0.089 0.140 0.451 254 N N -2.922 115.737 118.700 -0.069 0.000 2.238 254 N HA 0.199 4.907 4.740 -0.053 0.000 0.222 254 N C -0.860 174.616 175.510 -0.056 0.000 1.133 254 N CA -0.537 52.477 53.050 -0.061 0.000 0.854 254 N CB 0.238 38.684 38.487 -0.068 0.000 1.041 254 N HN -0.664 7.539 8.380 -0.080 0.130 0.510 255 G N -0.642 108.124 108.800 -0.057 0.000 2.203 255 G HA2 -0.442 3.488 3.960 -0.050 0.000 0.263 255 G HA3 -0.442 3.494 3.960 -0.040 0.000 0.263 255 G C -0.229 174.641 174.900 -0.051 0.000 1.012 255 G CA 1.095 46.166 45.100 -0.049 0.000 0.749 255 G HN -0.476 7.602 8.290 -0.061 0.175 0.512 256 R N 0.068 120.526 120.500 -0.070 0.000 2.720 256 R HA 0.353 4.665 4.340 -0.046 0.000 0.272 256 R C -1.713 174.521 176.300 -0.109 0.000 0.991 256 R CA -1.876 54.181 56.100 -0.071 0.000 1.010 256 R CB 1.782 32.038 30.300 -0.075 0.000 1.141 256 R HN -0.314 7.876 8.270 -0.081 0.031 0.494 257 E N -2.858 117.290 120.200 -0.086 0.000 2.437 257 E HA 0.089 4.257 4.350 -0.302 0.000 0.280 257 E C -2.259 174.343 176.600 0.004 0.000 1.044 257 E CA -1.419 54.896 56.400 -0.141 0.000 0.826 257 E CB 2.325 31.986 29.700 -0.066 0.000 1.358 257 E HN -0.016 8.322 8.360 -0.035 0.000 0.459 258 Y N -1.097 119.261 120.300 0.097 0.000 2.397 258 Y HA 0.262 5.090 4.550 0.133 -0.199 0.335 258 Y C 0.938 176.992 175.900 0.257 0.000 1.213 258 Y CA -0.967 57.234 58.100 0.168 0.000 1.391 258 Y CB 0.734 39.308 38.460 0.190 0.000 1.293 258 Y HN 0.257 8.445 8.280 -0.153 0.000 0.557 259 M N 0.827 120.688 119.600 0.434 0.000 2.251 259 M HA -0.167 4.485 4.480 0.287 0.000 0.346 259 M C -0.919 175.660 176.300 0.465 0.000 1.499 259 M CA 1.139 56.646 55.300 0.345 0.000 1.128 259 M CB -0.057 32.692 32.600 0.248 0.000 1.809 259 M HN 0.045 8.580 8.290 0.407 0.000 0.464 260 W N 6.912 128.289 121.300 0.129 0.000 3.479 260 W HA 0.372 5.211 4.660 -0.052 -0.210 0.304 260 W C -2.898 173.587 176.519 -0.058 0.000 1.243 260 W CA -0.307 57.032 57.345 -0.011 0.000 1.202 260 W CB 3.952 33.360 29.460 -0.086 0.000 1.346 260 W HN 0.312 8.715 8.180 0.371 0.000 0.539 261 N N 4.377 122.427 118.700 -1.082 0.000 2.647 261 N HA 0.300 4.481 4.740 -0.933 0.000 0.266 261 N C -0.558 173.862 175.510 -1.816 0.000 1.373 261 N CA -1.181 51.167 53.050 -1.169 0.000 0.807 261 N CB 1.638 39.842 38.487 -0.472 0.000 1.513 261 N HN -0.091 7.523 8.380 -1.277 0.000 0.505 262 Q N -2.092 117.070 119.800 -1.063 0.000 2.230 262 Q HA -0.320 3.576 4.340 -0.739 0.000 0.202 262 Q C 1.364 177.139 176.000 -0.375 0.000 0.963 262 Q CA 3.216 58.645 55.803 -0.624 0.000 0.866 262 Q CB 0.022 28.671 28.738 -0.148 0.000 0.931 262 Q HN 0.502 8.380 8.270 -0.653 0.000 0.452 263 R N 0.342 120.648 120.500 -0.323 0.000 2.057 263 R HA -0.118 4.187 4.340 -0.058 0.000 0.224 263 R C 2.048 178.304 176.300 -0.075 0.000 1.136 263 R CA 2.452 58.476 56.100 -0.126 0.000 0.968 263 R CB 0.375 30.626 30.300 -0.081 0.000 0.863 263 R HN -0.725 7.414 8.270 -0.365 -0.088 0.433 264 L N -5.059 116.002 121.223 -0.270 0.000 2.640 264 L HA 0.153 4.354 4.340 -0.232 0.000 0.230 264 L C -0.779 175.847 176.870 -0.408 0.000 1.123 264 L CA -0.535 54.122 54.840 -0.305 0.000 0.900 264 L CB 0.774 42.615 42.059 -0.363 0.000 1.146 264 L HN 0.096 8.488 8.230 -0.381 -0.391 0.484 265 G N -2.035 106.399 108.800 -0.611 0.000 2.547 265 G HA2 -0.463 2.904 3.960 -1.101 0.000 0.271 265 G HA3 -0.463 3.448 3.960 -0.342 -0.156 0.271 265 G C -0.748 173.782 174.900 -0.617 0.000 1.209 265 G CA 0.100 44.778 45.100 -0.704 0.000 0.959 265 G HN -0.400 7.449 8.290 -0.736 0.000 0.563 266 Y N 1.284 121.605 120.300 0.034 0.000 2.465 266 Y HA 0.022 4.879 4.550 0.195 -0.189 0.331 266 Y C 0.141 176.011 175.900 -0.050 0.000 1.102 266 Y CA 1.384 59.550 58.100 0.110 0.000 1.358 266 Y CB -0.098 38.457 38.460 0.157 0.000 1.213 266 Y HN -0.435 7.848 8.280 0.005 0.000 0.525 267 L N 2.867 124.157 121.223 0.112 0.000 2.307 267 L HA 0.161 4.408 4.340 -0.156 0.000 0.282 267 L C -0.331 176.627 176.870 0.146 0.000 1.051 267 L CA -0.418 54.414 54.840 -0.013 0.000 0.804 267 L CB 0.965 42.965 42.059 -0.099 0.000 1.197 267 L HN -0.269 8.078 8.230 0.194 0.000 0.431 268 C N -0.528 118.780 119.300 0.013 0.000 3.108 268 C HA 0.071 4.451 4.460 -0.132 0.000 0.321 268 C C -0.565 174.107 174.990 -0.529 0.000 1.357 268 C CA -1.686 57.224 59.018 -0.180 0.000 1.562 268 C CB 4.267 31.950 27.740 -0.094 0.000 2.003 268 C HN 0.302 8.513 8.230 -0.031 0.000 0.460 269 A N 1.532 123.771 122.820 -0.968 0.000 1.865 269 A HA -0.256 3.390 4.320 -1.124 0.000 0.217 269 A C -0.424 177.055 177.584 -0.176 0.000 1.191 269 A CA 3.185 54.746 52.037 -0.794 0.000 0.623 269 A CB -0.212 18.480 19.000 -0.512 0.000 0.826 269 A HN 0.863 8.492 8.150 -0.869 0.000 0.444 270 C N -3.200 116.049 119.300 -0.085 0.000 2.482 270 C HA 0.456 4.947 4.460 0.052 0.000 0.378 270 C C -1.151 173.912 174.990 0.122 0.000 1.284 270 C CA -3.273 55.764 59.018 0.031 0.000 1.826 270 C CB 0.655 28.400 27.740 0.008 0.000 2.473 270 C HN -0.065 8.092 8.230 -0.122 0.000 0.562 271 P HA -0.154 4.508 4.420 0.403 0.000 0.223 271 P C 0.670 178.137 177.300 0.278 0.000 1.144 271 P CA 1.916 65.212 63.100 0.327 0.000 0.783 271 P CB -0.013 31.906 31.700 0.365 0.000 0.771 272 S N -1.679 114.097 115.700 0.126 0.000 2.419 272 S HA -0.291 4.127 4.470 -0.088 0.000 0.235 272 S C 0.822 175.526 174.600 0.174 0.000 1.019 272 S CA 2.566 60.800 58.200 0.055 0.000 0.982 272 S CB -0.326 62.864 63.200 -0.016 0.000 0.789 272 S HN -0.485 7.836 8.310 0.082 0.038 0.490 273 N N -0.420 118.351 118.700 0.117 0.000 2.273 273 N HA 0.217 4.987 4.740 0.051 0.000 0.231 273 N C -1.055 174.470 175.510 0.025 0.000 1.134 273 N CA -0.617 52.466 53.050 0.056 0.000 0.856 273 N CB 0.597 39.094 38.487 0.017 0.000 1.068 273 N HN -0.489 7.915 8.380 0.107 0.041 0.510 274 L N -1.980 119.244 121.223 0.003 0.000 2.479 274 L HA 0.026 4.449 4.340 -0.090 -0.137 0.248 274 L C 1.746 178.518 176.870 -0.164 0.000 1.205 274 L CA 0.949 55.715 54.840 -0.124 0.000 0.817 274 L CB 0.699 42.623 42.059 -0.225 0.000 1.162 274 L HN -1.037 7.176 8.230 0.075 0.062 0.486 275 G N -1.692 107.006 108.800 -0.171 0.000 5.356 275 G HA2 -0.481 3.516 3.960 -0.163 0.000 0.309 275 G HA3 -0.481 3.389 3.960 -0.151 0.000 0.309 275 G C 0.433 175.397 174.900 0.107 0.000 1.451 275 G CA 1.710 46.743 45.100 -0.112 0.000 0.978 275 G HN 0.444 8.618 8.290 -0.194 0.000 0.771 276 T N 1.697 116.353 114.554 0.170 0.000 2.978 276 T HA 0.363 5.107 4.350 0.422 -0.141 0.248 276 T C 1.217 176.037 174.700 0.200 0.000 1.018 276 T CA -0.854 61.423 62.100 0.296 0.000 1.026 276 T CB 2.297 71.382 68.868 0.363 0.000 1.032 276 T HN -0.319 7.989 8.240 0.113 0.000 0.485 277 G N 2.797 111.642 108.800 0.075 0.000 2.296 277 G HA2 -0.437 3.552 3.960 -0.009 0.000 0.282 277 G HA3 -0.437 3.589 3.960 0.040 -0.042 0.282 277 G C -1.702 173.195 174.900 -0.005 0.000 1.014 277 G CA 0.921 46.034 45.100 0.022 0.000 0.812 277 G HN -0.440 7.875 8.290 0.041 0.000 0.508 278 L N -1.202 119.988 121.223 -0.055 0.000 2.289 278 L HA 0.632 5.174 4.340 -0.028 -0.219 0.285 278 L C -2.170 174.556 176.870 -0.240 0.000 1.049 278 L CA -1.290 53.494 54.840 -0.094 0.000 0.804 278 L CB 2.067 44.113 42.059 -0.022 0.000 1.195 278 L HN -0.655 7.511 8.230 -0.087 0.012 0.428 279 R N 5.567 125.953 120.500 -0.190 0.000 2.407 279 R HA 0.298 4.611 4.340 -0.236 -0.114 0.298 279 R C -1.678 174.513 176.300 -0.182 0.000 1.166 279 R CA -1.814 54.171 56.100 -0.192 0.000 1.006 279 R CB 2.150 32.371 30.300 -0.131 0.000 1.145 279 R HN 0.437 8.616 8.270 -0.152 0.000 0.538 280 A N 7.915 130.619 122.820 -0.193 0.000 2.309 280 A HA 0.942 5.339 4.320 -0.165 -0.176 0.298 280 A C -1.647 175.890 177.584 -0.079 0.000 1.165 280 A CA -1.723 50.223 52.037 -0.152 0.000 0.821 280 A CB 1.936 20.839 19.000 -0.162 0.000 1.102 280 A HN 0.615 8.932 8.150 -0.214 -0.296 0.500 281 S N 0.218 115.898 115.700 -0.035 0.000 2.565 281 S HA 1.048 5.690 4.470 -0.005 -0.175 0.269 281 S C -1.591 173.035 174.600 0.043 0.000 1.153 281 S CA -1.199 57.003 58.200 0.004 0.000 0.835 281 S CB 3.214 66.423 63.200 0.015 0.000 1.122 281 S HN 0.543 8.833 8.310 -0.032 0.000 0.462 282 V N -5.851 114.092 119.914 0.049 0.000 2.960 282 V HA 0.800 5.122 4.120 0.072 -0.159 0.315 282 V C -1.478 174.737 176.094 0.202 0.000 1.087 282 V CA -3.484 58.853 62.300 0.061 0.000 0.982 282 V CB 3.547 35.306 31.823 -0.106 0.000 1.039 282 V HN 0.519 8.727 8.190 0.029 0.000 0.437 283 H N 2.578 121.639 119.070 -0.014 0.000 2.556 283 H HA 0.578 5.364 4.556 0.009 -0.225 0.310 283 H C -1.203 174.120 175.328 -0.007 0.000 1.057 283 H CA -1.541 54.505 56.048 -0.004 0.000 1.264 283 H CB 1.207 30.963 29.762 -0.011 0.000 1.404 283 H HN -0.070 8.335 8.280 0.208 0.000 0.462 284 V N 4.010 123.982 119.914 0.096 0.000 2.638 284 V HA 0.634 4.992 4.120 0.061 -0.201 0.306 284 V C -2.462 173.682 176.094 0.083 0.000 1.052 284 V CA -3.258 59.080 62.300 0.063 0.000 0.885 284 V CB 3.807 35.626 31.823 -0.006 0.000 0.999 284 V HN 0.472 8.718 8.190 0.093 0.000 0.424 285 Q N 8.932 128.758 119.800 0.044 0.000 2.314 285 Q HA 0.278 4.784 4.340 -0.075 -0.210 0.257 285 Q C -1.219 174.776 176.000 -0.009 0.000 0.975 285 Q CA -0.506 55.259 55.803 -0.062 0.000 0.933 285 Q CB 1.122 29.741 28.738 -0.198 0.000 1.195 285 Q HN 0.503 8.696 8.270 0.055 0.110 0.426 286 L N 7.380 128.578 121.223 -0.041 0.000 2.488 286 L HA 0.428 4.833 4.340 0.019 -0.054 0.250 286 L C -0.738 176.077 176.870 -0.092 0.000 1.280 286 L CA -1.528 53.279 54.840 -0.055 0.000 0.929 286 L CB 0.199 42.175 42.059 -0.139 0.000 1.200 286 L HN 0.295 8.524 8.230 -0.002 0.000 0.495 287 H N 2.843 121.934 119.070 0.036 0.000 2.267 287 H HA -0.299 4.446 4.556 0.026 -0.174 0.297 287 H C 1.963 177.272 175.328 -0.032 0.000 1.080 287 H CA 3.936 59.991 56.048 0.013 0.000 1.278 287 H CB 0.251 30.024 29.762 0.019 0.000 1.365 287 H HN 0.264 8.550 8.280 -0.046 -0.033 0.489 288 Q N -2.937 116.922 119.800 0.097 0.000 2.096 288 Q HA -0.136 4.226 4.340 0.036 0.000 0.197 288 Q C 2.583 178.539 176.000 -0.074 0.000 0.964 288 Q CA 1.623 57.440 55.803 0.023 0.000 0.838 288 Q CB -0.263 28.498 28.738 0.038 0.000 0.906 288 Q HN -0.197 8.564 8.270 0.126 -0.415 0.444 289 L N 0.450 121.562 121.223 -0.185 0.000 2.191 289 L HA -0.181 4.032 4.340 -0.212 0.000 0.212 289 L C 1.712 178.138 176.870 -0.740 0.000 1.103 289 L CA 2.302 56.921 54.840 -0.368 0.000 0.769 289 L CB -0.466 41.340 42.059 -0.421 0.000 0.908 289 L HN 0.067 8.546 8.230 -0.158 -0.344 0.438 290 S N -1.325 113.937 115.700 -0.730 0.000 2.515 290 S HA -0.151 3.413 4.470 -1.510 0.000 0.231 290 S C 1.021 175.520 174.600 -0.169 0.000 0.987 290 S CA 2.255 60.023 58.200 -0.720 0.000 0.936 290 S CB -0.298 62.801 63.200 -0.168 0.000 0.766 290 S HN -0.348 7.649 8.310 -0.476 0.028 0.528 291 K N -0.947 119.396 120.400 -0.095 0.000 2.361 291 K HA 0.043 4.381 4.320 0.031 0.000 0.194 291 K C -0.207 176.409 176.600 0.026 0.000 1.032 291 K CA -0.137 56.152 56.287 0.004 0.000 1.048 291 K CB 0.810 33.317 32.500 0.012 0.000 0.842 291 K HN -0.545 7.466 8.250 -0.122 0.167 0.526 292 H N 2.171 121.199 119.070 -0.070 0.000 2.815 292 H HA 0.116 4.665 4.556 -0.013 0.000 0.350 292 H C 0.140 175.492 175.328 0.040 0.000 1.080 292 H CA -0.499 55.537 56.048 -0.020 0.000 1.433 292 H CB 1.460 31.198 29.762 -0.040 0.000 1.432 292 H HN -0.800 7.385 8.280 0.047 0.123 0.592 293 P HA 0.026 4.456 4.420 0.016 0.000 0.237 293 P C -0.572 176.808 177.300 0.133 0.000 1.178 293 P CA 1.063 64.141 63.100 -0.038 0.000 0.766 293 P CB 0.232 31.845 31.700 -0.145 0.000 0.876 294 K N -4.307 116.345 120.400 0.419 0.000 2.374 294 K HA 0.247 4.683 4.320 0.194 0.000 0.202 294 K C -0.110 176.651 176.600 0.268 0.000 1.040 294 K CA -1.031 55.450 56.287 0.324 0.000 1.085 294 K CB 0.337 33.044 32.500 0.345 0.000 0.873 294 K HN -0.422 8.292 8.250 0.879 0.063 0.539 295 F N 2.210 122.223 119.950 0.105 0.000 2.043 295 F HA -0.571 3.912 4.527 -0.073 0.000 0.297 295 F C 0.769 176.527 175.800 -0.069 0.000 1.118 295 F CA 3.650 61.631 58.000 -0.032 0.000 1.202 295 F CB -0.156 38.805 39.000 -0.065 0.000 0.965 295 F HN -0.696 7.883 8.300 0.465 0.000 0.482 296 E N -2.739 117.379 120.200 -0.136 0.000 2.058 296 E HA -0.377 3.690 4.350 -0.471 0.000 0.194 296 E C 2.155 178.668 176.600 -0.144 0.000 0.997 296 E CA 3.961 60.211 56.400 -0.251 0.000 0.801 296 E CB -1.156 28.474 29.700 -0.118 0.000 0.746 296 E HN 0.500 8.866 8.360 0.009 0.000 0.450 297 D N -0.779 119.597 120.400 -0.041 0.000 2.219 297 D HA -0.205 4.418 4.640 -0.028 0.000 0.205 297 D C 2.316 178.601 176.300 -0.026 0.000 0.970 297 D CA 2.825 56.815 54.000 -0.018 0.000 0.851 297 D CB -0.632 40.182 40.800 0.023 0.000 0.943 297 D HN 0.061 8.432 8.370 0.003 0.000 0.488 298 I N 0.147 120.702 120.570 -0.024 0.000 2.233 298 I HA -0.435 3.723 4.170 -0.020 0.000 0.243 298 I C 1.577 177.658 176.117 -0.061 0.000 1.093 298 I CA 3.825 65.109 61.300 -0.026 0.000 1.380 298 I CB 0.118 38.117 38.000 -0.000 0.000 1.067 298 I HN -0.085 7.979 8.210 -0.008 0.141 0.413 299 V N 0.205 120.041 119.914 -0.130 0.000 2.287 299 V HA -0.590 3.453 4.120 -0.127 0.000 0.248 299 V C 1.799 177.829 176.094 -0.108 0.000 1.053 299 V CA 5.175 67.377 62.300 -0.164 0.000 1.027 299 V CB -0.182 31.446 31.823 -0.325 0.000 0.646 299 V HN -0.558 7.526 8.190 -0.176 0.000 0.447 300 V N -1.121 118.734 119.914 -0.098 0.000 2.548 300 V HA -0.333 3.908 4.120 -0.058 -0.156 0.249 300 V C 2.477 178.552 176.094 -0.031 0.000 1.055 300 V CA 3.358 65.622 62.300 -0.059 0.000 1.065 300 V CB -0.177 31.616 31.823 -0.051 0.000 0.681 300 V HN -0.555 7.568 8.190 -0.112 0.000 0.462 301 A N 0.476 123.279 122.820 -0.029 0.000 2.015 301 A HA -0.178 4.138 4.320 -0.006 0.000 0.219 301 A C 1.064 178.643 177.584 -0.009 0.000 1.163 301 A CA 2.826 54.856 52.037 -0.013 0.000 0.646 301 A CB -0.347 18.646 19.000 -0.011 0.000 0.806 301 A HN -0.602 7.439 8.150 -0.037 0.086 0.448 302 L N -4.900 116.312 121.223 -0.017 0.000 2.612 302 L HA 0.017 4.356 4.340 -0.002 0.000 0.230 302 L C -0.550 176.324 176.870 0.006 0.000 1.140 302 L CA -0.458 54.377 54.840 -0.008 0.000 0.896 302 L CB -0.365 41.684 42.059 -0.018 0.000 1.065 302 L HN -0.677 7.412 8.230 -0.029 0.123 0.447 303 Q N -7.078 112.726 119.800 0.006 0.000 2.494 303 Q HA -0.450 3.969 4.340 0.022 -0.065 0.272 303 Q C -0.923 175.087 176.000 0.016 0.000 1.145 303 Q CA 0.830 56.649 55.803 0.027 0.000 0.943 303 Q CB -2.952 25.824 28.738 0.063 0.000 1.338 303 Q HN -0.435 7.634 8.270 -0.002 0.200 0.492 304 L N -4.272 116.939 121.223 -0.021 0.000 2.421 304 L HA 0.701 5.141 4.340 -0.031 -0.118 0.267 304 L C -1.000 175.827 176.870 -0.072 0.000 1.036 304 L CA -1.836 52.978 54.840 -0.044 0.000 0.829 304 L CB 3.077 45.102 42.059 -0.057 0.000 1.437 304 L HN -0.251 7.936 8.230 -0.032 0.024 0.488 305 Q N -1.818 117.928 119.800 -0.090 0.000 2.309 305 Q HA 0.288 4.557 4.340 -0.118 0.000 0.273 305 Q C -2.215 173.710 176.000 -0.124 0.000 1.040 305 Q CA -0.689 55.050 55.803 -0.107 0.000 0.834 305 Q CB 4.296 32.983 28.738 -0.086 0.000 1.345 305 Q HN 0.257 8.476 8.270 -0.085 0.000 0.414 306 K N 6.789 127.091 120.400 -0.163 0.000 2.259 306 K HA 0.744 5.165 4.320 -0.113 -0.169 0.252 306 K C -1.042 175.489 176.600 -0.114 0.000 0.936 306 K CA -1.305 54.886 56.287 -0.161 0.000 0.810 306 K CB 2.929 35.222 32.500 -0.346 0.000 1.143 306 K HN 0.405 8.550 8.250 -0.176 0.000 0.427 307 R N 1.732 122.215 120.500 -0.029 0.000 2.747 307 R HA 0.308 4.602 4.340 -0.077 0.000 0.272 307 R C -1.692 174.602 176.300 -0.011 0.000 1.032 307 R CA -1.632 54.435 56.100 -0.055 0.000 0.896 307 R CB 2.128 32.349 30.300 -0.132 0.000 1.253 307 R HN 0.156 8.434 8.270 0.013 0.000 0.461 308 G N -2.258 106.495 108.800 -0.080 0.000 2.667 308 G HA2 0.172 3.974 3.960 -0.265 0.000 0.250 308 G HA3 0.172 4.222 3.960 -0.137 -0.172 0.250 308 G C 0.377 175.164 174.900 -0.189 0.000 1.212 308 G CA -0.410 44.591 45.100 -0.166 0.000 0.874 308 G HN 0.344 8.583 8.290 -0.084 0.000 0.561 309 T N -3.280 111.123 114.554 -0.253 0.000 3.113 309 T HA -0.160 3.951 4.350 -0.398 0.000 0.256 309 T C 0.341 175.020 174.700 -0.034 0.000 1.131 309 T CA 0.537 62.476 62.100 -0.267 0.000 1.074 309 T CB -0.049 68.634 68.868 -0.308 0.000 0.944 309 T HN 0.294 8.375 8.240 -0.264 0.000 0.516 310 G N 0.119 108.905 108.800 -0.023 0.000 3.383 310 G HA2 0.128 4.137 3.960 0.081 0.000 0.251 310 G HA3 0.128 4.105 3.960 0.028 0.000 0.251 310 G C -0.082 174.846 174.900 0.047 0.000 1.203 310 G CA -0.595 44.529 45.100 0.039 0.000 0.852 310 G HN -0.048 8.152 8.290 -0.058 0.055 0.531 311 G N 0.504 109.325 108.800 0.035 0.000 2.527 311 G HA2 -0.396 3.588 3.960 0.041 0.000 0.227 311 G HA3 -0.396 3.597 3.960 0.055 0.000 0.227 311 G C -1.272 173.628 174.900 0.000 0.000 1.291 311 G CA -0.519 44.602 45.100 0.036 0.000 0.904 311 G HN -0.809 7.409 8.290 0.020 0.084 0.577 312 E N 2.966 123.173 120.200 0.012 0.000 2.417 312 E HA -0.110 4.195 4.350 -0.076 0.000 0.261 312 E C -0.254 176.375 176.600 0.048 0.000 1.000 312 E CA 0.543 56.939 56.400 -0.006 0.000 0.919 312 E CB -0.566 29.160 29.700 0.042 0.000 0.955 312 E HN 0.172 8.550 8.360 0.030 0.000 0.455 313 H N -0.475 118.603 119.070 0.014 0.000 2.355 313 H HA -0.215 4.352 4.556 0.019 0.000 0.324 313 H C -0.298 175.036 175.328 0.010 0.000 1.015 313 H CA 0.821 56.878 56.048 0.015 0.000 1.101 313 H CB -2.130 27.641 29.762 0.015 0.000 1.555 313 H HN 0.271 8.364 8.280 -0.311 0.000 0.386 314 T N 0.924 115.518 114.554 0.067 0.000 2.902 314 T HA 0.186 4.569 4.350 0.054 0.000 0.283 314 T C -0.994 173.715 174.700 0.016 0.000 1.009 314 T CA -0.651 61.472 62.100 0.039 0.000 1.051 314 T CB 1.418 70.294 68.868 0.012 0.000 0.999 314 T HN -0.485 7.750 8.240 0.023 0.019 0.474 315 A N 3.439 126.266 122.820 0.013 0.000 2.531 315 A HA -0.071 4.258 4.320 0.015 0.000 0.236 315 A C -0.672 176.859 177.584 -0.088 0.000 1.062 315 A CA 0.295 52.325 52.037 -0.010 0.000 0.760 315 A CB 0.454 19.453 19.000 -0.002 0.000 0.995 315 A HN 0.067 8.229 8.150 0.020 0.000 0.501 316 A N 2.307 125.022 122.820 -0.175 0.000 2.302 316 A HA 0.077 4.193 4.320 -0.340 0.000 0.295 316 A C -0.280 177.156 177.584 -0.247 0.000 1.235 316 A CA -0.695 51.119 52.037 -0.372 0.000 0.876 316 A CB 0.170 18.596 19.000 -0.956 0.000 1.133 316 A HN 0.126 8.193 8.150 -0.139 0.000 0.533 317 V N 4.910 124.713 119.914 -0.185 0.000 2.530 317 V HA -0.099 3.975 4.120 -0.076 0.000 0.282 317 V C 0.124 176.155 176.094 -0.106 0.000 1.048 317 V CA 0.376 62.613 62.300 -0.104 0.000 0.997 317 V CB 0.599 32.385 31.823 -0.062 0.000 0.987 317 V HN 0.360 8.439 8.190 -0.185 0.000 0.477 318 D N 5.986 126.361 120.400 -0.043 0.000 2.945 318 D HA -0.333 4.353 4.640 0.077 0.000 0.225 318 D C -1.380 174.890 176.300 -0.050 0.000 1.158 318 D CA 1.352 55.359 54.000 0.012 0.000 0.805 318 D CB -0.483 40.325 40.800 0.013 0.000 1.098 318 D HN 0.762 9.119 8.370 -0.023 0.000 0.426 319 D N -6.846 113.498 120.400 -0.092 0.000 2.837 319 D HA -0.432 4.163 4.640 -0.074 0.000 0.230 319 D C -1.241 174.979 176.300 -0.133 0.000 1.152 319 D CA 1.477 55.430 54.000 -0.079 0.000 0.736 319 D CB -1.541 39.263 40.800 0.007 0.000 1.084 319 D HN -0.113 8.164 8.370 -0.102 0.031 0.429 320 V N -2.156 117.597 119.914 -0.269 0.000 2.383 320 V HA -0.007 4.257 4.120 -0.059 -0.179 0.275 320 V C -1.643 174.234 176.094 -0.362 0.000 1.036 320 V CA -0.270 61.916 62.300 -0.190 0.000 0.889 320 V CB 0.664 32.401 31.823 -0.143 0.000 0.985 320 V HN -0.773 7.212 8.190 -0.294 0.029 0.459 321 Y N 5.591 125.838 120.300 -0.089 0.000 2.429 321 Y HA 0.207 4.774 4.550 -0.132 -0.097 0.342 321 Y C -1.005 174.786 175.900 -0.181 0.000 1.004 321 Y CA -1.405 56.634 58.100 -0.102 0.000 1.075 321 Y CB 3.643 42.124 38.460 0.036 0.000 1.214 321 Y HN 0.297 8.700 8.280 0.205 0.000 0.455 322 D N 3.304 123.642 120.400 -0.102 0.000 2.352 322 D HA 0.497 5.377 4.640 -0.011 -0.246 0.245 322 D C -1.052 175.255 176.300 0.012 0.000 1.224 322 D CA -0.933 53.027 54.000 -0.067 0.000 0.879 322 D CB 0.629 41.373 40.800 -0.093 0.000 1.057 322 D HN 0.174 8.469 8.370 -0.124 0.000 0.491 323 I N 6.825 127.408 120.570 0.022 0.000 2.441 323 I HA 0.887 5.248 4.170 -0.044 -0.218 0.295 323 I C -1.140 174.961 176.117 -0.027 0.000 0.994 323 I CA -2.503 58.783 61.300 -0.023 0.000 1.144 323 I CB 1.843 39.819 38.000 -0.040 0.000 1.314 323 I HN 0.196 8.431 8.210 0.042 0.000 0.445 324 S N 3.770 119.441 115.700 -0.048 0.000 2.625 324 S HA 0.558 5.153 4.470 -0.046 -0.153 0.271 324 S C -1.220 173.340 174.600 -0.068 0.000 1.161 324 S CA -1.890 56.277 58.200 -0.055 0.000 0.820 324 S CB 3.117 66.280 63.200 -0.062 0.000 1.137 324 S HN 0.277 8.551 8.310 -0.060 0.000 0.470 325 N N -1.252 117.394 118.700 -0.090 0.000 2.513 325 N HA -0.085 4.637 4.740 -0.030 0.000 0.268 325 N C 0.630 176.058 175.510 -0.136 0.000 1.180 325 N CA -0.221 52.774 53.050 -0.093 0.000 0.948 325 N CB 0.147 38.550 38.487 -0.139 0.000 1.083 325 N HN -0.273 8.044 8.380 -0.106 0.000 0.455 326 A N 2.556 125.332 122.820 -0.074 0.000 1.935 326 A HA 0.075 4.348 4.320 -0.080 0.000 0.214 326 A C -0.804 176.734 177.584 -0.076 0.000 1.178 326 A CA 1.463 53.460 52.037 -0.066 0.000 0.640 326 A CB 0.401 19.386 19.000 -0.026 0.000 0.825 326 A HN -0.217 7.917 8.150 -0.027 0.000 0.447 327 A N -3.004 119.787 122.820 -0.048 0.000 2.257 327 A HA -0.000 4.353 4.320 0.055 0.000 0.289 327 A C -1.052 176.367 177.584 -0.275 0.000 1.095 327 A CA -0.508 51.537 52.037 0.014 0.000 0.836 327 A CB 1.648 20.796 19.000 0.246 0.000 1.111 327 A HN -0.011 8.138 8.150 -0.000 0.000 0.497 328 R N -4.697 115.767 120.500 -0.060 0.000 2.576 328 R HA 0.302 4.343 4.340 -0.498 0.000 0.237 328 R C -0.472 175.882 176.300 0.090 0.000 0.917 328 R CA -0.191 55.809 56.100 -0.167 0.000 1.002 328 R CB 1.930 32.194 30.300 -0.060 0.000 1.428 328 R HN 0.347 8.682 8.270 0.108 0.000 0.603 329 L N -1.731 119.519 121.223 0.045 0.000 2.304 329 L HA 0.145 4.542 4.340 -0.098 -0.116 0.268 329 L C 0.048 176.975 176.870 0.095 0.000 1.010 329 L CA -0.635 54.139 54.840 -0.109 0.000 0.813 329 L CB 2.132 43.797 42.059 -0.657 0.000 1.315 329 L HN -0.593 7.669 8.230 0.052 0.000 0.445 330 K N -5.761 114.665 120.400 0.043 0.000 3.604 330 K HA -0.439 3.969 4.320 0.146 0.000 0.271 330 K C -1.638 174.914 176.600 -0.079 0.000 1.180 330 K CA 1.819 58.151 56.287 0.075 0.000 1.017 330 K CB -0.858 31.714 32.500 0.120 0.000 1.292 330 K HN 0.389 8.954 8.250 0.012 -0.308 0.501 331 K N -2.910 117.331 120.400 -0.265 0.000 2.426 331 K HA 0.307 4.553 4.320 -0.334 -0.126 0.251 331 K C -0.768 175.596 176.600 -0.393 0.000 0.941 331 K CA -1.995 53.961 56.287 -0.551 0.000 0.808 331 K CB 4.062 35.822 32.500 -1.234 0.000 1.265 331 K HN -0.842 7.204 8.250 -0.198 0.086 0.432 332 S N 2.101 117.677 115.700 -0.205 0.000 2.608 332 S HA -0.046 4.483 4.470 0.098 0.000 0.261 332 S C 1.045 175.696 174.600 0.084 0.000 1.314 332 S CA -0.394 57.814 58.200 0.013 0.000 0.992 332 S CB 1.377 64.609 63.200 0.053 0.000 0.935 332 S HN 0.096 8.552 8.310 -0.197 -0.264 0.564 333 E N 2.004 122.369 120.200 0.274 0.000 2.049 333 E HA -0.395 4.192 4.350 0.395 0.000 0.198 333 E C 2.155 178.817 176.600 0.104 0.000 1.007 333 E CA 4.125 60.729 56.400 0.341 0.000 0.809 333 E CB -0.403 29.626 29.700 0.549 0.000 0.749 333 E HN 0.557 9.100 8.360 0.305 0.000 0.450 334 R N -1.264 119.345 120.500 0.181 0.000 2.105 334 R HA -0.335 3.810 4.340 -0.325 0.000 0.239 334 R C 2.298 178.535 176.300 -0.105 0.000 1.135 334 R CA 2.879 58.986 56.100 0.011 0.000 0.967 334 R CB -0.231 30.225 30.300 0.259 0.000 0.861 334 R HN -0.361 8.092 8.270 0.304 0.000 0.442 335 E N -1.140 119.012 120.200 -0.079 0.000 2.150 335 E HA -0.285 4.003 4.350 -0.103 0.000 0.193 335 E C 2.606 179.110 176.600 -0.160 0.000 0.985 335 E CA 2.819 59.132 56.400 -0.146 0.000 0.814 335 E CB -0.311 29.257 29.700 -0.220 0.000 0.752 335 E HN -0.634 7.697 8.360 -0.050 0.000 0.466 336 F N -0.469 119.422 119.950 -0.097 0.000 2.206 336 F HA -0.297 4.187 4.527 -0.071 0.000 0.298 336 F C 1.983 177.685 175.800 -0.164 0.000 1.090 336 F CA 3.626 61.561 58.000 -0.107 0.000 1.323 336 F CB 0.424 39.366 39.000 -0.097 0.000 1.028 336 F HN -0.366 7.814 8.300 -0.042 0.095 0.492 337 V N -0.503 119.342 119.914 -0.116 0.000 2.427 337 V HA -0.582 3.440 4.120 -0.164 0.000 0.248 337 V C 1.659 177.688 176.094 -0.108 0.000 1.051 337 V CA 4.438 66.596 62.300 -0.236 0.000 1.048 337 V CB -0.387 31.048 31.823 -0.646 0.000 0.666 337 V HN -0.363 7.702 8.190 -0.207 0.000 0.456 338 Q N -0.130 119.611 119.800 -0.098 0.000 2.119 338 Q HA -0.270 4.046 4.340 -0.041 0.000 0.201 338 Q C 2.052 178.054 176.000 0.004 0.000 0.972 338 Q CA 2.643 58.420 55.803 -0.043 0.000 0.847 338 Q CB -0.459 28.253 28.738 -0.044 0.000 0.903 338 Q HN -0.373 7.743 8.270 -0.125 0.078 0.433 339 L N 0.008 121.240 121.223 0.015 0.000 2.017 339 L HA -0.304 4.055 4.340 0.032 0.000 0.208 339 L C 1.652 178.564 176.870 0.070 0.000 1.073 339 L CA 3.155 58.024 54.840 0.048 0.000 0.745 339 L CB -0.240 41.874 42.059 0.092 0.000 0.894 339 L HN -0.111 8.041 8.230 0.005 0.081 0.432 340 L N -0.847 120.425 121.223 0.082 0.000 2.012 340 L HA -0.387 3.992 4.340 0.065 0.000 0.210 340 L C 1.422 178.404 176.870 0.187 0.000 1.073 340 L CA 3.342 58.240 54.840 0.097 0.000 0.748 340 L CB -0.234 41.879 42.059 0.091 0.000 0.891 340 L HN -0.249 8.028 8.230 0.077 0.000 0.431 341 I N -0.825 119.879 120.570 0.223 0.000 2.179 341 I HA -0.651 3.955 4.170 0.726 0.000 0.242 341 I C 1.785 178.048 176.117 0.244 0.000 1.088 341 I CA 4.825 66.325 61.300 0.333 0.000 1.357 341 I CB -0.387 37.648 38.000 0.058 0.000 1.051 341 I HN 0.123 8.342 8.210 0.136 0.073 0.409 342 D N -0.556 119.913 120.400 0.116 0.000 2.097 342 D HA -0.241 4.441 4.640 0.071 0.000 0.195 342 D C 2.743 179.080 176.300 0.062 0.000 0.989 342 D CA 3.501 57.544 54.000 0.072 0.000 0.827 342 D CB -0.657 40.165 40.800 0.037 0.000 0.966 342 D HN 0.128 8.551 8.370 0.088 0.000 0.456 343 G N -0.058 108.774 108.800 0.053 0.000 2.453 343 G HA2 -0.254 3.711 3.960 0.008 0.000 0.215 343 G HA3 -0.254 3.713 3.960 0.011 0.000 0.215 343 G C 1.347 176.242 174.900 -0.009 0.000 1.201 343 G CA 2.014 47.124 45.100 0.017 0.000 0.784 343 G HN 0.074 8.402 8.290 0.063 0.000 0.545 344 V N 2.490 122.388 119.914 -0.027 0.000 2.332 344 V HA -0.657 3.372 4.120 -0.153 0.000 0.248 344 V C 1.898 177.938 176.094 -0.089 0.000 1.055 344 V CA 4.201 66.410 62.300 -0.152 0.000 1.038 344 V CB -0.257 31.260 31.823 -0.509 0.000 0.651 344 V HN 0.154 8.348 8.190 0.006 0.000 0.450 345 K N -0.976 119.454 120.400 0.049 0.000 2.057 345 K HA -0.398 3.951 4.320 0.050 0.000 0.207 345 K C 2.354 178.944 176.600 -0.018 0.000 1.049 345 K CA 3.893 60.213 56.287 0.055 0.000 0.931 345 K CB -0.362 32.206 32.500 0.114 0.000 0.714 345 K HN -0.498 7.831 8.250 0.132 0.000 0.440 346 K N -0.721 119.671 120.400 -0.014 0.000 2.032 346 K HA -0.300 4.001 4.320 -0.033 0.000 0.209 346 K C 2.501 179.063 176.600 -0.063 0.000 1.048 346 K CA 3.314 59.581 56.287 -0.033 0.000 0.927 346 K CB -0.154 32.333 32.500 -0.022 0.000 0.712 346 K HN -0.606 7.646 8.250 0.004 0.000 0.441 347 L N -1.537 119.646 121.223 -0.066 0.000 2.042 347 L HA -0.331 3.970 4.340 -0.065 0.000 0.210 347 L C 2.496 179.286 176.870 -0.134 0.000 1.076 347 L CA 3.048 57.842 54.840 -0.077 0.000 0.749 347 L CB -0.294 41.736 42.059 -0.050 0.000 0.893 347 L HN -0.298 7.898 8.230 -0.057 0.000 0.432 348 I N -0.510 119.951 120.570 -0.181 0.000 2.315 348 I HA -0.593 3.334 4.170 -0.406 0.000 0.248 348 I C 1.830 177.773 176.117 -0.289 0.000 1.117 348 I CA 4.412 65.512 61.300 -0.334 0.000 1.404 348 I CB -0.407 37.364 38.000 -0.383 0.000 1.071 348 I HN 0.169 8.286 8.210 -0.155 0.000 0.419 349 D N 0.497 120.795 120.400 -0.169 0.000 2.117 349 D HA -0.211 4.356 4.640 -0.121 0.000 0.197 349 D C 2.659 178.895 176.300 -0.107 0.000 0.987 349 D CA 3.396 57.325 54.000 -0.118 0.000 0.829 349 D CB -0.363 40.395 40.800 -0.071 0.000 0.961 349 D HN -0.155 8.134 8.370 -0.136 0.000 0.460 350 M N -1.173 118.361 119.600 -0.110 0.000 2.200 350 M HA -0.398 4.028 4.480 -0.090 0.000 0.265 350 M C 1.790 178.026 176.300 -0.106 0.000 1.066 350 M CA 4.307 59.543 55.300 -0.106 0.000 1.127 350 M CB 0.014 32.539 32.600 -0.125 0.000 1.379 350 M HN -0.178 7.962 8.290 -0.113 0.082 0.420 351 E N 0.046 120.169 120.200 -0.129 0.000 2.110 351 E HA -0.357 3.947 4.350 -0.076 0.000 0.193 351 E C 2.413 178.988 176.600 -0.043 0.000 0.988 351 E CA 3.189 59.533 56.400 -0.093 0.000 0.804 351 E CB -0.570 29.060 29.700 -0.116 0.000 0.745 351 E HN -0.084 8.101 8.360 -0.155 0.082 0.458 352 Q N -1.347 118.401 119.800 -0.087 0.000 2.187 352 Q HA -0.170 4.358 4.340 0.032 -0.168 0.199 352 Q C 2.599 178.595 176.000 -0.007 0.000 0.957 352 Q CA 2.427 58.214 55.803 -0.027 0.000 0.857 352 Q CB 0.095 28.794 28.738 -0.066 0.000 0.929 352 Q HN -0.358 7.815 8.270 -0.142 0.011 0.453 353 A N 0.872 123.676 122.820 -0.027 0.000 1.902 353 A HA -0.239 4.078 4.320 -0.006 0.000 0.217 353 A C 1.835 179.420 177.584 0.002 0.000 1.181 353 A CA 3.142 55.171 52.037 -0.013 0.000 0.623 353 A CB -0.717 18.268 19.000 -0.025 0.000 0.818 353 A HN -0.290 7.832 8.150 -0.047 0.000 0.443 354 L N -2.876 118.347 121.223 -0.000 0.000 2.217 354 L HA -0.224 4.131 4.340 0.026 0.000 0.211 354 L C 3.356 180.244 176.870 0.030 0.000 1.107 354 L CA 2.275 57.127 54.840 0.019 0.000 0.783 354 L CB -0.279 41.790 42.059 0.016 0.000 0.919 354 L HN -0.283 7.938 8.230 -0.015 0.000 0.442 355 E N -0.265 119.958 120.200 0.039 0.000 2.110 355 E HA -0.299 4.082 4.350 0.052 0.000 0.193 355 E C 1.003 177.624 176.600 0.036 0.000 0.988 355 E CA 2.442 58.872 56.400 0.051 0.000 0.804 355 E CB -0.132 29.617 29.700 0.082 0.000 0.745 355 E HN -0.368 7.924 8.360 0.037 0.090 0.458 356 A N -4.020 118.817 122.820 0.029 0.000 2.302 356 A HA 0.132 4.466 4.320 0.023 0.000 0.219 356 A C 0.122 177.717 177.584 0.018 0.000 1.243 356 A CA -0.687 51.364 52.037 0.022 0.000 0.856 356 A CB -0.497 18.514 19.000 0.019 0.000 0.893 356 A HN -0.591 7.468 8.150 0.027 0.107 0.491 357 G N -0.822 107.990 108.800 0.020 0.000 2.203 357 G HA2 -0.396 3.577 3.960 0.021 0.000 0.263 357 G HA3 -0.396 3.574 3.960 0.016 0.000 0.263 357 G C -0.129 174.782 174.900 0.019 0.000 1.012 357 G CA 0.763 45.875 45.100 0.019 0.000 0.749 357 G HN -0.490 7.619 8.290 0.023 0.194 0.512 358 K N 0.451 120.863 120.400 0.019 0.000 2.144 358 K HA 0.175 4.505 4.320 0.017 0.000 0.270 358 K C -0.124 176.493 176.600 0.027 0.000 1.005 358 K CA -0.698 55.600 56.287 0.018 0.000 0.932 358 K CB 1.042 33.548 32.500 0.011 0.000 1.021 358 K HN -0.356 7.862 8.250 0.017 0.042 0.462 359 S N 0.741 116.460 115.700 0.031 0.000 2.593 359 S HA -0.039 4.473 4.470 0.071 0.000 0.269 359 S C 0.356 174.978 174.600 0.037 0.000 1.334 359 S CA 0.052 58.282 58.200 0.050 0.000 1.015 359 S CB 0.493 63.720 63.200 0.046 0.000 0.912 359 S HN 0.265 8.591 8.310 0.026 0.000 0.541 360 I N -7.134 113.465 120.570 0.049 0.000 3.966 360 I HA 0.425 4.715 4.170 -0.011 -0.126 0.324 360 I C -0.074 176.041 176.117 -0.003 0.000 1.517 360 I CA -0.530 60.765 61.300 -0.008 0.000 1.117 360 I CB 1.237 39.186 38.000 -0.086 0.000 1.190 360 I HN 0.465 8.733 8.210 0.097 0.000 0.466 361 D N 1.338 121.766 120.400 0.047 0.000 2.264 361 D HA -0.216 4.456 4.640 0.052 0.000 0.208 361 D C 0.035 176.347 176.300 0.020 0.000 0.966 361 D CA 2.394 56.423 54.000 0.048 0.000 0.864 361 D CB -0.556 40.284 40.800 0.066 0.000 0.933 361 D HN 0.236 8.645 8.370 0.065 0.000 0.499 362 D N -4.133 116.274 120.400 0.012 0.000 2.363 362 D HA -0.091 4.554 4.640 0.007 0.000 0.226 362 D C -0.273 176.024 176.300 -0.005 0.000 1.020 362 D CA 0.696 54.699 54.000 0.005 0.000 0.892 362 D CB -0.496 40.307 40.800 0.005 0.000 0.900 362 D HN 0.118 8.462 8.370 0.014 0.035 0.531 363 L N -2.988 118.226 121.223 -0.015 0.000 2.803 363 L HA 0.177 4.505 4.340 -0.020 0.000 0.246 363 L C 0.028 176.878 176.870 -0.033 0.000 1.100 363 L CA -0.094 54.730 54.840 -0.026 0.000 0.919 363 L CB 1.722 43.757 42.059 -0.040 0.000 1.285 363 L HN -0.562 7.462 8.230 -0.016 0.196 0.522 364 I N 0.000 120.549 120.570 -0.035 0.000 2.984 364 I HA 0.000 4.136 4.170 -0.056 0.000 0.288 364 I CA 0.000 61.277 61.300 -0.038 0.000 1.566 364 I CB 0.000 37.984 38.000 -0.027 0.000 1.214 364 I HN 0.000 8.193 8.210 -0.029 0.000 0.494