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 3m8u_1_A DATA FIRST_RESID 24 DATA SEQUENCE DKTFINcVSR SPTGFSPALV MDGISYNASS QQVYNRLVEF KRGSTDIEPA DATA SEQUENCE LAESWTVSDD GLTYTFNLRK GVKFHSNKEF TPSRDFNADD VVFSFQRQLD DATA SEQUENCE PNHPYHNVSK ATYPYFKAMK FSTLLKSVEK VDMHTVKITL NRQDATFLAS DATA SEQUENCE LGMDFISIYS AEYADKMLAA GKPETIDTTP IGTGPFLFAG YQVDQKSRYL DATA SEQUENCE AHKEYWKGKA DIDRLIFEIV PDATARYAKL QAGAcDLIDF PNAADLEKMK DATA SEQUENCE TDPKVNLHSQ SGLNIAYIAF NTEKAPFDNV KVRQALNYAV DKNAIIDAVY DATA SEQUENCE RGAGVAAKNP LPPTIWGYNN EITGYEYSPE KAKQLLKEAG FENGFETDIW DATA SEQUENCE VQPVVRASNP NPRRMAELVQ SDWEKVGVKS KLVSYEWGDY IKRTKAGELT DATA SEQUENCE AGTYGWSGDN GDPDNFLSPL FGSENVGNSN YARFKNPELD ALLHKAVGLS DATA SEQUENCE DKAERAKIYE QAQVLLKEQA PWINVAHSIN FAPTSKRVQD YKQSPFGYTY DATA SEQUENCE LYGTKLAD 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 24 D HA 0.000 4.651 4.640 0.018 0.000 0.175 24 D C 0.000 176.319 176.300 0.032 0.000 2.045 24 D CA 0.000 54.014 54.000 0.024 0.000 0.868 24 D CB 0.000 40.816 40.800 0.027 0.000 0.688 25 K N 3.132 123.560 120.400 0.047 0.000 2.206 25 K HA 0.179 4.529 4.320 0.050 0.000 0.268 25 K C -1.338 175.316 176.600 0.089 0.000 1.111 25 K CA -0.266 56.058 56.287 0.063 0.000 0.955 25 K CB -0.220 32.323 32.500 0.071 0.000 1.406 25 K HN -0.058 8.388 8.250 0.049 -0.167 0.427 26 T N 5.971 120.569 114.554 0.074 0.000 2.756 26 T HA 0.442 5.081 4.350 0.122 -0.215 0.290 26 T C -1.598 173.167 174.700 0.107 0.000 0.985 26 T CA -0.645 61.512 62.100 0.094 0.000 0.955 26 T CB 1.244 70.146 68.868 0.057 0.000 0.930 26 T HN -0.007 8.263 8.240 0.049 0.000 0.451 27 F N 10.152 130.104 119.950 0.003 0.000 2.420 27 F HA 0.210 4.859 4.527 -0.027 -0.138 0.352 27 F C -2.291 173.502 175.800 -0.012 0.000 1.108 27 F CA -0.901 57.086 58.000 -0.021 0.000 1.162 27 F CB 2.395 41.368 39.000 -0.045 0.000 1.118 27 F HN 0.500 8.980 8.300 0.299 0.000 0.510 28 I N 7.185 127.644 120.570 -0.185 0.000 2.307 28 I HA 0.246 4.612 4.170 0.101 -0.135 0.289 28 I C -1.578 174.486 176.117 -0.088 0.000 1.021 28 I CA -2.744 58.526 61.300 -0.049 0.000 1.224 28 I CB -0.803 37.137 38.000 -0.101 0.000 1.376 28 I HN 0.309 8.543 8.210 -0.486 -0.315 0.470 29 N N 8.380 127.144 118.700 0.106 0.000 2.437 29 N HA 0.268 5.006 4.740 -0.002 0.000 0.259 29 N C -1.687 173.748 175.510 -0.126 0.000 0.983 29 N CA -1.283 51.741 53.050 -0.044 0.000 0.937 29 N CB 1.533 39.793 38.487 -0.378 0.000 1.122 29 N HN 0.383 8.878 8.380 0.191 0.000 0.499 30 c N 6.100 124.633 118.600 -0.112 0.000 2.303 30 c HA 0.604 5.357 4.570 -0.032 -0.202 0.341 30 c C -0.121 173.916 174.090 -0.089 0.000 1.244 30 c CA -0.764 55.524 56.329 -0.068 0.000 1.765 30 c CB -1.212 41.270 42.510 -0.047 0.000 2.379 30 c HN 0.300 8.461 8.230 -0.115 0.000 0.530 31 V N 1.495 121.381 119.914 -0.048 0.000 2.919 31 V HA 0.489 4.792 4.120 -0.074 -0.228 0.316 31 V C -0.855 175.261 176.094 0.036 0.000 1.077 31 V CA -2.550 59.730 62.300 -0.033 0.000 0.977 31 V CB 3.258 35.072 31.823 -0.015 0.000 1.039 31 V HN 0.340 8.528 8.190 -0.004 0.000 0.441 32 S N 0.887 116.625 115.700 0.064 0.000 2.501 32 S HA 0.051 4.563 4.470 0.069 0.000 0.220 32 S C 0.180 174.820 174.600 0.067 0.000 0.997 32 S CA 1.015 59.267 58.200 0.088 0.000 0.919 32 S CB 1.082 64.388 63.200 0.178 0.000 0.778 32 S HN 0.182 8.782 8.310 0.067 -0.250 0.523 33 R N -1.026 119.516 120.500 0.071 0.000 2.739 33 R HA 0.182 4.557 4.340 0.058 0.000 0.271 33 R C -1.303 175.051 176.300 0.090 0.000 1.010 33 R CA -1.137 54.997 56.100 0.057 0.000 0.897 33 R CB 3.726 34.027 30.300 0.002 0.000 1.236 33 R HN -0.585 7.734 8.270 0.081 0.000 0.466 34 S N 2.121 117.886 115.700 0.108 0.000 2.562 34 S HA 0.125 4.710 4.470 0.192 0.000 0.281 34 S C -0.942 173.674 174.600 0.026 0.000 1.333 34 S CA -0.929 57.355 58.200 0.142 0.000 1.052 34 S CB 0.260 63.595 63.200 0.225 0.000 0.884 34 S HN 0.206 8.577 8.310 0.103 0.000 0.506 35 P HA 0.040 4.379 4.420 -0.135 0.000 0.275 35 P C -0.628 176.549 177.300 -0.207 0.000 1.228 35 P CA -0.186 62.777 63.100 -0.229 0.000 0.786 35 P CB 0.604 31.973 31.700 -0.550 0.000 0.927 36 T N 1.554 116.037 114.554 -0.119 0.000 2.788 36 T HA -0.275 4.078 4.350 0.005 0.000 0.268 36 T C 0.211 174.849 174.700 -0.104 0.000 1.044 36 T CA 2.330 64.404 62.100 -0.044 0.000 1.139 36 T CB 0.478 69.367 68.868 0.034 0.000 0.867 36 T HN 0.042 8.225 8.240 -0.095 0.000 0.454 37 G N -2.983 105.680 108.800 -0.229 0.000 2.506 37 G HA2 0.129 3.979 3.960 -0.184 0.000 0.292 37 G HA3 0.129 4.051 3.960 -0.063 0.000 0.292 37 G C -2.794 171.886 174.900 -0.367 0.000 1.425 37 G CA 0.162 45.136 45.100 -0.209 0.000 0.788 37 G HN -0.942 7.181 8.290 -0.278 0.000 0.490 38 F N -2.991 116.960 119.950 0.001 0.000 2.698 38 F HA 0.228 4.783 4.527 0.046 0.000 0.304 38 F C -0.668 175.200 175.800 0.112 0.000 1.108 38 F CA -0.464 57.542 58.000 0.009 0.000 1.263 38 F CB 1.656 40.553 39.000 -0.173 0.000 1.013 38 F HN 0.211 8.642 8.300 0.218 0.000 0.532 39 S N 1.079 116.936 115.700 0.262 0.000 2.601 39 S HA 0.387 5.070 4.470 0.354 0.000 0.312 39 S C -0.587 174.180 174.600 0.279 0.000 1.107 39 S CA -4.112 54.273 58.200 0.308 0.000 1.129 39 S CB 0.753 64.127 63.200 0.290 0.000 0.982 39 S HN -0.358 8.067 8.310 0.192 0.000 0.469 40 P HA -0.116 4.596 4.420 0.487 0.000 0.220 40 P C 0.223 177.734 177.300 0.352 0.000 1.148 40 P CA 1.584 64.872 63.100 0.314 0.000 0.803 40 P CB 0.170 31.893 31.700 0.038 0.000 0.782 41 A N -2.030 120.978 122.820 0.314 0.000 2.121 41 A HA -0.146 4.502 4.320 0.366 -0.108 0.218 41 A C 0.269 177.989 177.584 0.227 0.000 1.154 41 A CA 2.187 54.407 52.037 0.305 0.000 0.679 41 A CB -0.468 18.655 19.000 0.204 0.000 0.795 41 A HN -0.360 7.999 8.150 0.376 0.017 0.458 42 L N -5.987 115.314 121.223 0.130 0.000 2.590 42 L HA 0.159 4.380 4.340 -0.198 0.000 0.227 42 L C -0.689 176.187 176.870 0.010 0.000 1.099 42 L CA -0.005 54.809 54.840 -0.044 0.000 0.872 42 L CB 0.461 42.479 42.059 -0.069 0.000 1.088 42 L HN -0.445 7.737 8.230 0.180 0.156 0.479 43 V N -10.118 109.866 119.914 0.115 0.000 3.158 43 V HA 0.373 4.502 4.120 0.015 0.000 0.311 43 V C -1.227 174.910 176.094 0.072 0.000 1.181 43 V CA -2.759 59.572 62.300 0.052 0.000 1.054 43 V CB 3.427 35.244 31.823 -0.010 0.000 1.085 43 V HN -1.015 7.299 8.190 0.207 0.000 0.446 44 M N 0.170 119.708 119.600 -0.103 0.000 4.568 44 M HA 0.275 4.717 4.480 -0.063 0.000 0.533 44 M C -2.689 173.466 176.300 -0.241 0.000 2.143 44 M CA -0.320 54.897 55.300 -0.139 0.000 0.483 44 M CB 0.431 32.989 32.600 -0.070 0.000 1.438 44 M HN 0.362 8.588 8.290 -0.107 0.000 0.591 45 D N -1.978 118.144 120.400 -0.463 0.000 2.596 45 D HA 0.195 4.756 4.640 -0.131 0.000 0.234 45 D C -0.090 176.013 176.300 -0.328 0.000 1.181 45 D CA -1.075 52.786 54.000 -0.232 0.000 0.856 45 D CB 3.130 43.939 40.800 0.015 0.000 1.498 45 D HN -0.545 7.399 8.370 -0.711 0.000 0.446 46 G N -0.560 108.203 108.800 -0.061 0.000 2.448 46 G HA2 -0.113 4.077 3.960 0.384 0.000 0.218 46 G HA3 -0.113 3.923 3.960 0.126 0.000 0.218 46 G C 1.304 176.302 174.900 0.165 0.000 1.135 46 G CA 1.015 46.208 45.100 0.154 0.000 0.784 46 G HN 0.446 8.710 8.290 -0.043 0.000 0.543 47 I N 1.466 122.072 120.570 0.059 0.000 2.252 47 I HA -0.465 3.782 4.170 0.129 0.000 0.245 47 I C 1.495 177.653 176.117 0.068 0.000 1.102 47 I CA 3.409 64.757 61.300 0.079 0.000 1.385 47 I CB 0.026 38.044 38.000 0.030 0.000 1.064 47 I HN -0.629 7.701 8.210 0.007 -0.115 0.414 48 S N 0.321 116.004 115.700 -0.028 0.000 2.356 48 S HA -0.369 4.010 4.470 -0.153 0.000 0.223 48 S C 1.917 176.590 174.600 0.121 0.000 1.032 48 S CA 3.128 61.285 58.200 -0.071 0.000 1.005 48 S CB 0.235 63.352 63.200 -0.139 0.000 0.867 48 S HN -0.608 7.943 8.310 -0.068 -0.282 0.449 49 Y N 0.121 120.495 120.300 0.123 0.000 2.145 49 Y HA -0.232 4.371 4.550 0.089 0.000 0.286 49 Y C 2.683 178.663 175.900 0.134 0.000 1.145 49 Y CA 0.976 59.145 58.100 0.117 0.000 1.148 49 Y CB -0.823 37.709 38.460 0.120 0.000 0.981 49 Y HN -0.552 7.758 8.280 0.050 0.000 0.507 50 N N -1.949 116.990 118.700 0.397 0.000 2.137 50 N HA -0.314 4.645 4.740 0.364 0.000 0.190 50 N C 1.162 176.866 175.510 0.324 0.000 1.017 50 N CA 2.789 56.071 53.050 0.386 0.000 0.859 50 N CB -0.290 38.443 38.487 0.408 0.000 1.002 50 N HN -0.214 8.417 8.380 0.418 0.000 0.428 51 A N -4.545 118.430 122.820 0.259 0.000 2.251 51 A HA 0.025 4.253 4.320 -0.154 0.000 0.209 51 A C -0.781 176.950 177.584 0.245 0.000 1.187 51 A CA 1.037 53.155 52.037 0.136 0.000 0.823 51 A CB 0.880 19.981 19.000 0.168 0.000 0.846 51 A HN -0.434 7.753 8.150 0.242 0.109 0.486 52 S N -1.310 114.529 115.700 0.231 0.000 4.163 52 S HA -0.028 4.670 4.470 0.381 0.000 0.164 52 S C 1.264 176.027 174.600 0.272 0.000 0.896 52 S CA 1.501 59.896 58.200 0.325 0.000 1.125 52 S CB 0.304 63.734 63.200 0.383 0.000 1.698 52 S HN -0.403 7.863 8.310 0.215 0.172 0.817 53 S N 3.033 118.916 115.700 0.304 0.000 2.400 53 S HA -0.317 4.442 4.470 0.481 0.000 0.232 53 S C 2.390 177.070 174.600 0.133 0.000 1.025 53 S CA 3.430 61.777 58.200 0.245 0.000 0.993 53 S CB -1.217 61.969 63.200 -0.023 0.000 0.808 53 S HN 0.376 8.864 8.310 0.298 0.000 0.478 54 Q N -0.320 119.543 119.800 0.106 0.000 2.230 54 Q HA -0.189 4.247 4.340 0.160 0.000 0.202 54 Q C 1.669 177.777 176.000 0.181 0.000 0.963 54 Q CA 2.305 58.203 55.803 0.158 0.000 0.866 54 Q CB -0.342 28.509 28.738 0.188 0.000 0.931 54 Q HN -0.394 7.928 8.270 0.121 0.020 0.452 55 Q N -3.159 116.671 119.800 0.050 0.000 2.387 55 Q HA 0.189 4.553 4.340 0.040 0.000 0.208 55 Q C 1.880 177.927 176.000 0.079 0.000 0.935 55 Q CA 1.644 57.434 55.803 -0.021 0.000 0.891 55 Q CB 1.737 30.212 28.738 -0.438 0.000 1.007 55 Q HN -0.332 7.932 8.270 0.039 0.029 0.548 56 V N -7.603 112.341 119.914 0.051 0.000 3.605 56 V HA 0.512 4.944 4.120 0.120 -0.240 0.284 56 V C -1.069 174.934 176.094 -0.152 0.000 1.386 56 V CA -0.819 61.492 62.300 0.018 0.000 1.053 56 V CB 1.835 33.646 31.823 -0.021 0.000 0.857 56 V HN -0.210 8.014 8.190 0.058 0.000 0.436 57 Y N -1.394 118.929 120.300 0.039 0.000 2.549 57 Y HA 0.178 4.696 4.550 -0.055 0.000 0.339 57 Y C -0.874 175.012 175.900 -0.023 0.000 1.053 57 Y CA -0.315 57.760 58.100 -0.042 0.000 1.105 57 Y CB 3.195 41.577 38.460 -0.131 0.000 1.258 57 Y HN -0.989 7.376 8.280 0.142 0.000 0.478 58 N N -0.075 118.708 118.700 0.138 0.000 2.432 58 N HA 0.512 5.463 4.740 0.105 -0.148 0.292 58 N C -0.995 174.488 175.510 -0.046 0.000 1.193 58 N CA -0.591 52.502 53.050 0.073 0.000 0.878 58 N CB 3.673 42.218 38.487 0.097 0.000 1.252 58 N HN 0.256 8.711 8.380 0.125 0.000 0.520 59 R N -1.618 118.826 120.500 -0.094 0.000 2.797 59 R HA 0.398 4.614 4.340 -0.208 0.000 0.251 59 R C 1.184 177.360 176.300 -0.206 0.000 1.107 59 R CA -2.482 53.504 56.100 -0.190 0.000 1.084 59 R CB 1.746 31.901 30.300 -0.241 0.000 1.205 59 R HN 0.072 8.591 8.270 -0.056 -0.282 0.515 60 L N -0.448 120.619 121.223 -0.260 0.000 2.046 60 L HA -0.169 4.045 4.340 -0.209 0.000 0.208 60 L C -0.128 176.601 176.870 -0.235 0.000 1.077 60 L CA 3.462 58.141 54.840 -0.269 0.000 0.747 60 L CB 0.404 42.191 42.059 -0.453 0.000 0.896 60 L HN 0.650 8.707 8.230 -0.289 0.000 0.432 61 V N -10.434 109.297 119.914 -0.305 0.000 2.914 61 V HA 0.535 4.574 4.120 -0.135 0.000 0.314 61 V C -2.011 173.917 176.094 -0.276 0.000 1.084 61 V CA -2.982 59.156 62.300 -0.270 0.000 0.963 61 V CB 3.858 35.405 31.823 -0.461 0.000 1.025 61 V HN -0.940 7.036 8.190 -0.357 0.000 0.432 62 E N 0.494 120.569 120.200 -0.209 0.000 2.416 62 E HA 0.417 4.575 4.350 -0.320 0.000 0.273 62 E C -1.590 174.856 176.600 -0.257 0.000 0.935 62 E CA -2.316 53.950 56.400 -0.224 0.000 0.784 62 E CB 5.011 34.689 29.700 -0.037 0.000 1.301 62 E HN -0.048 8.240 8.360 -0.119 0.000 0.454 63 F N -0.366 119.597 119.950 0.022 0.000 2.412 63 F HA 0.341 5.100 4.527 0.087 -0.180 0.348 63 F C 1.238 177.039 175.800 0.002 0.000 1.102 63 F CA 0.251 58.283 58.000 0.054 0.000 1.196 63 F CB 0.620 39.695 39.000 0.125 0.000 1.144 63 F HN 0.273 8.652 8.300 0.132 0.000 0.541 64 K N 1.817 122.332 120.400 0.193 0.000 2.485 64 K HA -0.127 4.259 4.320 0.110 0.000 0.277 64 K C 0.332 176.978 176.600 0.076 0.000 0.990 64 K CA 0.449 56.808 56.287 0.121 0.000 0.994 64 K CB 0.475 33.042 32.500 0.112 0.000 0.906 64 K HN -0.086 8.290 8.250 0.210 0.000 0.488 65 R N 3.144 123.673 120.500 0.049 0.000 2.583 65 R HA -0.268 4.056 4.340 -0.026 0.000 0.274 65 R C 0.988 177.264 176.300 -0.039 0.000 0.998 65 R CA 1.666 57.771 56.100 0.008 0.000 1.081 65 R CB 0.039 30.377 30.300 0.063 0.000 0.940 65 R HN 0.522 8.837 8.270 0.076 0.000 0.413 66 G N 1.001 109.737 108.800 -0.106 0.000 2.203 66 G HA2 -0.317 3.724 3.960 -0.187 0.000 0.263 66 G HA3 -0.317 3.569 3.960 -0.125 0.000 0.263 66 G C -0.782 174.041 174.900 -0.127 0.000 1.012 66 G CA 0.312 45.326 45.100 -0.143 0.000 0.749 66 G HN 0.431 8.646 8.290 -0.124 0.000 0.512 67 S N -2.322 113.306 115.700 -0.119 0.000 2.579 67 S HA 0.317 4.750 4.470 -0.061 0.000 0.272 67 S C -0.939 173.641 174.600 -0.035 0.000 1.141 67 S CA -2.016 56.154 58.200 -0.049 0.000 0.843 67 S CB 1.044 64.268 63.200 0.040 0.000 1.122 67 S HN -0.741 7.473 8.310 -0.128 0.019 0.468 68 T N -2.416 112.173 114.554 0.059 0.000 3.086 68 T HA 0.121 4.587 4.350 0.193 0.000 0.250 68 T C -0.093 174.892 174.700 0.476 0.000 1.074 68 T CA -0.617 61.629 62.100 0.244 0.000 0.988 68 T CB 0.446 69.460 68.868 0.242 0.000 0.988 68 T HN 0.126 8.403 8.240 0.062 0.000 0.530 69 D N 3.792 124.386 120.400 0.323 0.000 2.382 69 D HA 0.062 4.860 4.640 0.263 0.000 0.245 69 D C -0.651 175.814 176.300 0.275 0.000 1.120 69 D CA 0.838 55.000 54.000 0.269 0.000 0.890 69 D CB 0.895 41.798 40.800 0.171 0.000 1.201 69 D HN -0.443 8.015 8.370 0.235 0.053 0.433 70 I N -3.822 116.848 120.570 0.167 0.000 2.664 70 I HA 0.463 4.718 4.170 -0.104 -0.147 0.308 70 I C -1.193 174.997 176.117 0.121 0.000 0.984 70 I CA -1.802 59.505 61.300 0.010 0.000 1.213 70 I CB 2.673 40.614 38.000 -0.099 0.000 1.379 70 I HN 0.000 8.318 8.210 0.179 0.000 0.501 71 E N 0.805 121.075 120.200 0.117 0.000 2.433 71 E HA 0.571 5.083 4.350 0.271 0.000 0.278 71 E C -3.049 173.725 176.600 0.290 0.000 0.976 71 E CA -3.196 53.336 56.400 0.220 0.000 0.793 71 E CB 1.022 30.820 29.700 0.164 0.000 1.311 71 E HN 0.384 8.762 8.360 0.031 0.000 0.460 72 P HA -0.043 4.802 4.420 0.618 -0.055 0.267 72 P C -1.833 175.602 177.300 0.225 0.000 1.200 72 P CA 0.686 64.019 63.100 0.388 0.000 0.772 72 P CB 0.267 32.109 31.700 0.236 0.000 0.855 73 A N 1.107 123.990 122.820 0.106 0.000 2.364 73 A HA 0.522 4.946 4.320 0.173 0.000 0.193 73 A C 0.988 178.327 177.584 -0.408 0.000 1.530 73 A CA -0.203 51.836 52.037 0.004 0.000 1.613 73 A CB 1.217 20.268 19.000 0.085 0.000 1.767 73 A HN -0.363 7.851 8.150 0.106 0.000 0.657 74 L N -1.136 119.866 121.223 -0.369 0.000 2.201 74 L HA -0.156 3.726 4.340 -0.765 0.000 0.212 74 L C -0.476 176.314 176.870 -0.134 0.000 1.105 74 L CA 1.816 56.359 54.840 -0.495 0.000 0.775 74 L CB 0.106 41.788 42.059 -0.628 0.000 0.913 74 L HN -0.517 7.559 8.230 -0.256 0.000 0.440 75 A N -2.982 119.837 122.820 -0.001 0.000 2.302 75 A HA 0.066 4.634 4.320 0.238 -0.106 0.295 75 A C -0.830 176.897 177.584 0.239 0.000 1.235 75 A CA -1.207 50.963 52.037 0.221 0.000 0.876 75 A CB 0.479 19.717 19.000 0.397 0.000 1.133 75 A HN -0.277 7.734 8.150 -0.038 0.117 0.533 76 E N 5.555 125.841 120.200 0.142 0.000 2.158 76 E HA -0.194 4.164 4.350 0.015 0.000 0.191 76 E C -0.183 176.451 176.600 0.056 0.000 0.982 76 E CA 1.929 58.361 56.400 0.054 0.000 0.823 76 E CB 1.045 30.734 29.700 -0.017 0.000 0.766 76 E HN 0.113 8.553 8.360 0.133 0.000 0.468 77 S N -5.334 110.442 115.700 0.127 0.000 2.636 77 S HA 0.144 4.334 4.470 -0.467 0.000 0.268 77 S C -2.715 172.003 174.600 0.198 0.000 1.159 77 S CA -0.645 57.488 58.200 -0.112 0.000 0.815 77 S CB 1.243 64.325 63.200 -0.197 0.000 1.130 77 S HN -0.690 7.753 8.310 0.222 0.000 0.471 78 W N -4.087 117.209 121.300 -0.008 0.000 3.059 78 W HA 1.002 5.735 4.660 -0.140 -0.157 0.329 78 W C -1.887 174.545 176.519 -0.145 0.000 1.246 78 W CA -0.815 56.458 57.345 -0.121 0.000 1.190 78 W CB 2.468 31.801 29.460 -0.212 0.000 1.423 78 W HN 0.035 7.835 8.180 -0.635 0.000 0.571 79 T N -3.323 111.244 114.554 0.021 0.000 2.906 79 T HA 0.467 4.783 4.350 -0.056 0.000 0.295 79 T C -2.043 172.583 174.700 -0.124 0.000 1.061 79 T CA -1.708 60.358 62.100 -0.055 0.000 1.000 79 T CB 2.166 70.983 68.868 -0.085 0.000 1.103 79 T HN 0.428 8.653 8.240 -0.024 0.000 0.486 80 V N 2.603 122.411 119.914 -0.177 0.000 2.588 80 V HA 0.524 4.504 4.120 -0.537 -0.182 0.304 80 V C 0.011 175.955 176.094 -0.251 0.000 1.042 80 V CA -1.841 60.227 62.300 -0.385 0.000 0.877 80 V CB 3.111 34.644 31.823 -0.482 0.000 0.996 80 V HN 0.185 8.298 8.190 -0.127 0.000 0.425 81 S N 6.617 122.169 115.700 -0.247 0.000 2.589 81 S HA -0.013 4.385 4.470 -0.119 0.000 0.265 81 S C 1.169 175.695 174.600 -0.123 0.000 1.342 81 S CA -0.532 57.580 58.200 -0.146 0.000 1.005 81 S CB 1.127 64.258 63.200 -0.115 0.000 0.909 81 S HN 0.196 8.328 8.310 -0.297 0.000 0.555 82 D N 1.539 121.890 120.400 -0.081 0.000 2.182 82 D HA -0.197 4.408 4.640 -0.059 0.000 0.201 82 D C 0.582 176.852 176.300 -0.051 0.000 0.986 82 D CA 2.585 56.550 54.000 -0.059 0.000 0.847 82 D CB -0.509 40.266 40.800 -0.043 0.000 0.942 82 D HN 0.453 8.780 8.370 -0.072 0.000 0.467 83 D N -4.795 115.573 120.400 -0.052 0.000 2.349 83 D HA -0.093 4.531 4.640 -0.027 0.000 0.224 83 D C 0.321 176.600 176.300 -0.035 0.000 1.029 83 D CA -0.404 53.574 54.000 -0.036 0.000 0.879 83 D CB -0.786 39.995 40.800 -0.032 0.000 0.906 83 D HN -0.118 8.201 8.370 -0.058 0.016 0.528 84 G N -1.092 107.668 108.800 -0.066 0.000 2.155 84 G HA2 -0.451 3.428 3.960 -0.136 0.000 0.257 84 G HA3 -0.451 3.506 3.960 -0.005 0.000 0.257 84 G C -0.062 174.835 174.900 -0.005 0.000 0.983 84 G CA 0.934 45.998 45.100 -0.059 0.000 0.676 84 G HN -0.260 7.798 8.290 -0.093 0.176 0.528 85 L N -2.813 118.390 121.223 -0.033 0.000 2.556 85 L HA 0.154 4.510 4.340 0.027 0.000 0.226 85 L C -1.128 175.756 176.870 0.022 0.000 1.089 85 L CA -0.223 54.617 54.840 0.001 0.000 0.864 85 L CB 0.813 42.855 42.059 -0.028 0.000 1.067 85 L HN -0.206 8.259 8.230 -0.060 -0.270 0.477 86 T N 1.518 116.050 114.554 -0.036 0.000 2.833 86 T HA 0.434 4.964 4.350 0.049 -0.150 0.297 86 T C -1.753 172.894 174.700 -0.088 0.000 1.015 86 T CA -0.073 62.019 62.100 -0.014 0.000 0.963 86 T CB 1.416 70.255 68.868 -0.048 0.000 0.955 86 T HN -0.532 7.643 8.240 -0.109 0.000 0.449 87 Y N 7.660 127.911 120.300 -0.081 0.000 2.331 87 Y HA 0.429 5.032 4.550 -0.197 -0.170 0.338 87 Y C -0.694 175.026 175.900 -0.300 0.000 0.976 87 Y CA -1.808 56.180 58.100 -0.188 0.000 1.137 87 Y CB 2.233 40.654 38.460 -0.064 0.000 1.172 87 Y HN 0.731 9.209 8.280 0.332 0.000 0.478 88 T N 6.262 120.651 114.554 -0.274 0.000 2.770 88 T HA 0.525 5.003 4.350 -0.037 -0.150 0.283 88 T C -1.208 173.339 174.700 -0.256 0.000 0.988 88 T CA -0.653 61.351 62.100 -0.160 0.000 0.957 88 T CB 1.212 70.045 68.868 -0.057 0.000 0.930 88 T HN 0.404 8.477 8.240 -0.279 0.000 0.443 89 F N 6.710 126.765 119.950 0.174 0.000 2.411 89 F HA 0.273 4.979 4.527 0.298 0.000 0.352 89 F C -1.024 174.871 175.800 0.160 0.000 1.123 89 F CA -1.502 56.623 58.000 0.208 0.000 1.044 89 F CB 1.610 40.708 39.000 0.164 0.000 1.135 89 F HN 0.952 9.434 8.300 0.304 0.000 0.461 90 N N 4.693 123.577 118.700 0.306 0.000 2.420 90 N HA 0.288 5.267 4.740 0.177 -0.133 0.249 90 N C -1.018 174.619 175.510 0.211 0.000 1.033 90 N CA -0.380 52.789 53.050 0.199 0.000 0.944 90 N CB 0.432 38.987 38.487 0.113 0.000 1.113 90 N HN 0.173 8.743 8.380 0.318 0.000 0.502 91 L N 3.510 124.851 121.223 0.197 0.000 2.371 91 L HA 0.202 4.832 4.340 0.255 -0.136 0.272 91 L C 1.013 177.962 176.870 0.132 0.000 1.124 91 L CA -0.333 54.636 54.840 0.214 0.000 0.816 91 L CB 0.992 43.155 42.059 0.173 0.000 1.129 91 L HN 0.451 8.687 8.230 0.187 0.107 0.448 92 R N 4.059 124.623 120.500 0.106 0.000 2.570 92 R HA -0.109 4.186 4.340 -0.075 0.000 0.277 92 R C -0.384 175.921 176.300 0.007 0.000 1.039 92 R CA 0.738 56.812 56.100 -0.044 0.000 1.065 92 R CB 0.862 30.985 30.300 -0.294 0.000 0.964 92 R HN -0.102 8.248 8.270 0.133 0.000 0.428 93 K N 4.637 124.985 120.400 -0.087 0.000 2.095 93 K HA 0.061 4.344 4.320 -0.062 0.000 0.252 93 K C 0.608 177.190 176.600 -0.028 0.000 0.977 93 K CA -0.150 56.076 56.287 -0.101 0.000 0.900 93 K CB 0.625 32.979 32.500 -0.243 0.000 1.060 93 K HN 0.338 8.522 8.250 -0.110 0.000 0.449 94 G N -0.793 108.019 108.800 0.020 0.000 2.143 94 G HA2 -0.381 3.772 3.960 0.052 0.000 0.249 94 G HA3 -0.381 3.594 3.960 0.024 0.000 0.249 94 G C -0.882 174.058 174.900 0.068 0.000 0.981 94 G CA 0.129 45.253 45.100 0.041 0.000 0.665 94 G HN 0.444 8.757 8.290 0.038 0.000 0.528 95 V N 0.747 120.711 119.914 0.082 0.000 2.455 95 V HA -0.134 4.033 4.120 0.078 0.000 0.273 95 V C -1.072 175.079 176.094 0.094 0.000 1.045 95 V CA -0.022 62.316 62.300 0.062 0.000 0.976 95 V CB 0.348 32.134 31.823 -0.063 0.000 0.993 95 V HN -0.453 7.761 8.190 0.106 0.040 0.475 96 K N 6.780 127.258 120.400 0.131 0.000 2.156 96 K HA 0.343 4.784 4.320 0.202 0.000 0.271 96 K C -0.422 176.274 176.600 0.160 0.000 0.995 96 K CA -2.073 54.333 56.287 0.199 0.000 0.890 96 K CB 1.133 33.788 32.500 0.259 0.000 1.073 96 K HN 0.528 8.869 8.250 0.153 0.000 0.454 97 F N 2.171 122.211 119.950 0.150 0.000 2.406 97 F HA 0.117 4.694 4.527 -0.181 -0.159 0.327 97 F C 1.397 177.155 175.800 -0.071 0.000 1.153 97 F CA 0.042 58.024 58.000 -0.030 0.000 1.218 97 F CB 1.163 40.203 39.000 0.067 0.000 1.215 97 F HN 0.271 8.812 8.300 0.402 0.000 0.570 98 H N 0.514 119.605 119.070 0.036 0.000 2.730 98 H HA 0.022 4.436 4.556 -0.237 0.000 0.376 98 H C -0.136 175.204 175.328 0.019 0.000 1.299 98 H CA -0.330 55.646 56.048 -0.121 0.000 1.447 98 H CB 0.936 30.588 29.762 -0.183 0.000 1.493 98 H HN 0.062 8.090 8.280 -0.419 0.000 0.619 99 S N -1.354 114.417 115.700 0.119 0.000 2.648 99 S HA 0.333 4.928 4.470 0.021 -0.113 0.305 99 S C -0.968 173.656 174.600 0.041 0.000 1.094 99 S CA -1.120 57.101 58.200 0.034 0.000 0.983 99 S CB 2.453 65.638 63.200 -0.024 0.000 1.101 99 S HN -0.004 8.367 8.310 0.101 0.000 0.514 100 N N 1.169 119.893 118.700 0.041 0.000 3.204 100 N HA 0.246 5.005 4.740 0.032 0.000 0.285 100 N C 0.208 175.753 175.510 0.059 0.000 1.536 100 N CA -0.796 52.285 53.050 0.052 0.000 0.832 100 N CB 0.656 39.194 38.487 0.084 0.000 1.645 100 N HN 0.498 8.904 8.380 0.044 0.000 0.586 101 K N -1.924 118.515 120.400 0.064 0.000 2.280 101 K HA -0.186 4.158 4.320 0.040 0.000 0.202 101 K C 0.679 177.334 176.600 0.092 0.000 1.047 101 K CA 2.469 58.792 56.287 0.060 0.000 0.942 101 K CB -0.373 32.157 32.500 0.050 0.000 0.739 101 K HN 0.445 8.734 8.250 0.065 0.000 0.457 102 E N -3.326 116.963 120.200 0.148 0.000 2.452 102 E HA -0.078 4.370 4.350 0.163 0.000 0.197 102 E C -0.613 176.168 176.600 0.301 0.000 1.022 102 E CA 0.534 57.059 56.400 0.208 0.000 0.890 102 E CB 1.346 31.197 29.700 0.252 0.000 0.918 102 E HN -0.496 8.166 8.360 0.160 -0.206 0.496 103 F N -1.001 118.976 119.950 0.044 0.000 2.622 103 F HA 0.216 4.772 4.527 0.047 0.000 0.318 103 F C -2.891 172.881 175.800 -0.047 0.000 1.135 103 F CA 0.053 58.056 58.000 0.005 0.000 1.015 103 F CB 3.384 42.355 39.000 -0.048 0.000 1.275 103 F HN -0.653 7.781 8.300 0.203 -0.013 0.457 104 T N 9.043 123.108 114.554 -0.813 0.000 2.809 104 T HA 0.458 4.423 4.350 -0.642 0.000 0.284 104 T C -2.315 171.728 174.700 -1.096 0.000 0.992 104 T CA -3.486 58.157 62.100 -0.761 0.000 0.957 104 T CB 1.229 69.909 68.868 -0.315 0.000 0.942 104 T HN 0.047 7.887 8.240 -0.667 0.000 0.439 105 P HA 0.053 4.271 4.420 -0.543 -0.123 0.269 105 P C -1.036 176.158 177.300 -0.177 0.000 1.209 105 P CA -0.332 62.493 63.100 -0.458 0.000 0.776 105 P CB 0.829 32.545 31.700 0.027 0.000 0.876 106 S N 1.263 116.931 115.700 -0.054 0.000 2.559 106 S HA 0.112 4.567 4.470 -0.024 0.000 0.226 106 S C -0.193 174.437 174.600 0.050 0.000 1.000 106 S CA -0.072 58.124 58.200 -0.007 0.000 0.948 106 S CB 1.464 64.662 63.200 -0.003 0.000 0.870 106 S HN 0.113 8.866 8.310 -0.003 -0.444 0.497 107 R N 0.057 120.617 120.500 0.099 0.000 2.710 107 R HA 0.273 4.676 4.340 0.106 0.000 0.270 107 R C -2.017 174.408 176.300 0.208 0.000 1.021 107 R CA -0.647 55.529 56.100 0.127 0.000 0.889 107 R CB 2.160 32.525 30.300 0.107 0.000 1.243 107 R HN -0.975 7.367 8.270 0.120 0.000 0.464 108 D N -0.454 120.064 120.400 0.197 0.000 2.360 108 D HA 0.191 5.083 4.640 0.282 -0.083 0.242 108 D C 0.225 176.718 176.300 0.322 0.000 1.184 108 D CA -1.019 53.131 54.000 0.251 0.000 0.930 108 D CB 0.551 41.462 40.800 0.185 0.000 1.161 108 D HN -0.185 8.280 8.370 0.158 0.000 0.447 109 F N 3.278 123.343 119.950 0.191 0.000 2.629 109 F HA -0.230 4.759 4.527 0.449 -0.193 0.377 109 F C -1.535 174.367 175.800 0.170 0.000 1.101 109 F CA 1.384 59.504 58.000 0.199 0.000 1.301 109 F CB 0.474 39.410 39.000 -0.107 0.000 1.062 109 F HN 0.045 8.575 8.300 0.385 0.000 0.583 110 N N 4.861 123.160 118.700 -0.670 0.000 3.439 110 N HA 0.141 4.388 4.740 -0.820 0.000 0.313 110 N C -0.581 174.572 175.510 -0.594 0.000 1.598 110 N CA -1.282 51.359 53.050 -0.682 0.000 0.830 110 N CB 1.314 39.622 38.487 -0.298 0.000 1.849 110 N HN -0.068 8.388 8.380 -0.370 -0.299 0.598 111 A N -2.205 120.416 122.820 -0.331 0.000 1.972 111 A HA -0.243 3.996 4.320 -0.135 0.000 0.219 111 A C 1.383 178.949 177.584 -0.030 0.000 1.169 111 A CA 3.109 55.056 52.037 -0.148 0.000 0.635 111 A CB -0.337 18.607 19.000 -0.095 0.000 0.810 111 A HN 0.156 8.117 8.150 -0.315 0.000 0.446 112 D N -1.868 118.516 120.400 -0.027 0.000 2.182 112 D HA -0.309 4.377 4.640 0.076 0.000 0.201 112 D C 2.134 178.520 176.300 0.143 0.000 0.986 112 D CA 3.310 57.345 54.000 0.057 0.000 0.847 112 D CB -0.629 40.191 40.800 0.034 0.000 0.942 112 D HN -0.398 8.100 8.370 -0.072 -0.171 0.467 113 D N -0.895 119.598 120.400 0.156 0.000 2.144 113 D HA -0.195 4.597 4.640 0.253 0.000 0.200 113 D C 2.239 178.773 176.300 0.391 0.000 0.978 113 D CA 3.365 57.551 54.000 0.310 0.000 0.833 113 D CB -0.108 41.017 40.800 0.543 0.000 0.961 113 D HN -0.530 8.008 8.370 0.088 -0.115 0.470 114 V N 0.505 120.623 119.914 0.340 0.000 2.307 114 V HA -0.505 3.855 4.120 0.400 0.000 0.245 114 V C 1.688 178.002 176.094 0.367 0.000 1.045 114 V CA 3.824 66.343 62.300 0.364 0.000 1.024 114 V CB -0.056 31.941 31.823 0.290 0.000 0.651 114 V HN -0.927 7.415 8.190 0.254 0.000 0.449 115 V N 0.039 120.103 119.914 0.250 0.000 2.287 115 V HA -0.590 3.643 4.120 0.188 0.000 0.248 115 V C 1.569 177.788 176.094 0.208 0.000 1.053 115 V CA 4.433 66.855 62.300 0.204 0.000 1.027 115 V CB -0.151 31.753 31.823 0.137 0.000 0.646 115 V HN -0.255 8.055 8.190 0.200 0.000 0.447 116 F N 0.726 120.728 119.950 0.088 0.000 2.091 116 F HA -0.388 4.146 4.527 0.012 0.000 0.299 116 F C 1.446 177.174 175.800 -0.120 0.000 1.103 116 F CA 3.457 61.456 58.000 -0.001 0.000 1.228 116 F CB 0.126 39.128 39.000 0.003 0.000 0.984 116 F HN -0.130 8.397 8.300 0.378 0.000 0.477 117 S N -0.640 115.128 115.700 0.113 0.000 2.382 117 S HA -0.342 3.987 4.470 -0.235 0.000 0.228 117 S C 2.340 176.764 174.600 -0.293 0.000 1.027 117 S CA 3.406 61.551 58.200 -0.092 0.000 0.991 117 S CB -0.599 62.666 63.200 0.108 0.000 0.823 117 S HN -0.460 8.050 8.310 0.332 0.000 0.469 118 F N 1.125 120.995 119.950 -0.134 0.000 2.149 118 F HA -0.195 4.337 4.527 0.008 0.000 0.294 118 F C 1.840 177.481 175.800 -0.265 0.000 1.095 118 F CA 3.954 61.907 58.000 -0.078 0.000 1.276 118 F CB 0.289 39.316 39.000 0.046 0.000 1.023 118 F HN -0.625 7.847 8.300 0.287 0.000 0.480 119 Q N -1.856 117.861 119.800 -0.139 0.000 2.167 119 Q HA -0.305 3.961 4.340 -0.123 0.000 0.202 119 Q C 2.463 178.076 176.000 -0.645 0.000 0.970 119 Q CA 2.444 58.089 55.803 -0.264 0.000 0.855 119 Q CB -0.557 28.112 28.738 -0.115 0.000 0.911 119 Q HN 0.086 8.297 8.270 -0.098 0.000 0.438 120 R N 0.339 120.178 120.500 -1.102 0.000 2.103 120 R HA -0.370 3.217 4.340 -1.255 0.000 0.242 120 R C 1.931 177.775 176.300 -0.761 0.000 1.142 120 R CA 3.838 59.271 56.100 -1.111 0.000 0.960 120 R CB -0.178 29.430 30.300 -1.152 0.000 0.858 120 R HN -0.109 7.480 8.270 -1.135 0.000 0.439 121 Q N -3.483 115.729 119.800 -0.980 0.000 2.163 121 Q HA -0.192 2.871 4.340 -2.129 0.000 0.198 121 Q C 1.604 177.004 176.000 -1.001 0.000 0.954 121 Q CA 2.290 57.201 55.803 -1.486 0.000 0.851 121 Q CB 0.034 27.710 28.738 -1.769 0.000 0.928 121 Q HN -0.621 7.117 8.270 -0.879 0.004 0.459 122 L N -2.459 118.384 121.223 -0.633 0.000 2.131 122 L HA -0.069 4.227 4.340 -0.073 0.000 0.206 122 L C -0.020 176.756 176.870 -0.157 0.000 1.087 122 L CA 1.227 55.956 54.840 -0.185 0.000 0.767 122 L CB 1.306 43.424 42.059 0.098 0.000 0.917 122 L HN -0.657 7.165 8.230 -0.544 0.082 0.441 123 D N -1.959 118.311 120.400 -0.216 0.000 2.373 123 D HA 0.335 4.883 4.640 -0.153 0.000 0.227 123 D C -1.160 174.891 176.300 -0.415 0.000 1.091 123 D CA -3.170 50.717 54.000 -0.189 0.000 0.840 123 D CB 1.056 41.826 40.800 -0.050 0.000 1.060 123 D HN -0.469 7.754 8.370 -0.246 0.000 0.502 124 P HA -0.039 3.255 4.420 -1.876 0.000 0.225 124 P C -0.472 176.619 177.300 -0.348 0.000 1.148 124 P CA 1.255 63.865 63.100 -0.817 0.000 0.779 124 P CB 0.325 31.805 31.700 -0.366 0.000 0.780 125 N N -5.285 113.316 118.700 -0.165 0.000 2.230 125 N HA 0.100 4.821 4.740 -0.031 0.000 0.202 125 N C -1.216 174.296 175.510 0.003 0.000 1.119 125 N CA -0.335 52.685 53.050 -0.050 0.000 0.851 125 N CB 1.080 39.540 38.487 -0.044 0.000 0.990 125 N HN -0.410 8.147 8.380 -0.162 -0.273 0.497 126 H N 4.389 123.421 119.070 -0.063 0.000 2.897 126 H HA 0.012 4.566 4.556 -0.004 0.000 0.347 126 H C -0.739 174.623 175.328 0.057 0.000 1.068 126 H CA 1.358 57.401 56.048 -0.009 0.000 1.426 126 H CB 1.307 31.036 29.762 -0.055 0.000 1.410 126 H HN -0.681 7.527 8.280 0.067 0.112 0.597 127 P HA -0.174 4.215 4.420 -0.053 0.000 0.218 127 P C -0.268 177.080 177.300 0.080 0.000 1.146 127 P CA 2.078 65.146 63.100 -0.054 0.000 0.813 127 P CB 0.251 31.903 31.700 -0.080 0.000 0.778 128 Y N -6.429 114.037 120.300 0.277 0.000 2.457 128 Y HA -0.052 4.588 4.550 0.151 0.000 0.263 128 Y C 0.591 176.593 175.900 0.169 0.000 1.164 128 Y CA 0.462 58.695 58.100 0.221 0.000 1.274 128 Y CB 0.219 38.819 38.460 0.232 0.000 1.097 128 Y HN -0.688 8.077 8.280 0.854 0.027 0.523 129 H N 1.352 120.547 119.070 0.208 0.000 2.387 129 H HA -0.236 4.527 4.556 0.139 -0.124 0.299 129 H C 0.213 175.663 175.328 0.203 0.000 1.099 129 H CA 3.644 59.787 56.048 0.157 0.000 1.315 129 H CB 0.383 30.188 29.762 0.072 0.000 1.380 129 H HN -0.563 7.802 8.280 0.403 0.156 0.513 130 N N -3.913 114.857 118.700 0.117 0.000 2.203 130 N HA 0.042 4.761 4.740 -0.034 0.000 0.207 130 N C -1.067 174.426 175.510 -0.030 0.000 1.130 130 N CA -0.050 53.012 53.050 0.019 0.000 0.861 130 N CB 0.791 39.312 38.487 0.057 0.000 1.005 130 N HN 0.126 8.583 8.380 0.144 0.010 0.507 131 V N 0.741 120.636 119.914 -0.032 0.000 2.673 131 V HA -0.321 3.743 4.120 -0.093 0.000 0.303 131 V C 0.366 176.439 176.094 -0.036 0.000 1.046 131 V CA 1.986 64.247 62.300 -0.066 0.000 1.126 131 V CB 0.330 32.081 31.823 -0.120 0.000 0.934 131 V HN -0.859 7.172 8.190 0.002 0.160 0.487 132 S N 3.428 119.107 115.700 -0.034 0.000 3.445 132 S HA -0.443 4.017 4.470 -0.017 0.000 0.319 132 S C -0.794 173.766 174.600 -0.066 0.000 1.209 132 S CA 0.632 58.815 58.200 -0.029 0.000 0.934 132 S CB -0.842 62.355 63.200 -0.005 0.000 0.999 132 S HN 0.780 9.067 8.310 -0.038 0.000 0.582 133 K N -5.786 114.570 120.400 -0.075 0.000 3.077 133 K HA -0.471 3.867 4.320 -0.080 -0.066 0.264 133 K C -0.497 176.000 176.600 -0.172 0.000 1.008 133 K CA 0.778 57.009 56.287 -0.093 0.000 0.740 133 K CB -2.305 30.157 32.500 -0.063 0.000 1.273 133 K HN -0.457 7.715 8.250 -0.062 0.040 0.477 134 A N -1.446 121.213 122.820 -0.268 0.000 2.483 134 A HA -0.101 3.944 4.320 -0.459 0.000 0.238 134 A C -0.141 177.039 177.584 -0.673 0.000 1.070 134 A CA 1.318 53.022 52.037 -0.555 0.000 0.770 134 A CB 0.841 19.355 19.000 -0.810 0.000 1.008 134 A HN -0.680 7.334 8.150 -0.221 0.003 0.497 135 T N -2.308 111.840 114.554 -0.678 0.000 3.058 135 T HA 0.085 4.287 4.350 -0.247 0.000 0.278 135 T C -0.180 174.389 174.700 -0.218 0.000 0.974 135 T CA -0.990 60.894 62.100 -0.361 0.000 0.893 135 T CB 1.176 69.948 68.868 -0.160 0.000 1.138 135 T HN 0.227 8.086 8.240 -0.636 0.000 0.529 136 Y N -2.121 118.154 120.300 -0.042 0.000 3.037 136 Y HA -0.308 4.505 4.550 0.048 -0.234 0.204 136 Y C -1.280 174.675 175.900 0.092 0.000 1.275 136 Y CA -0.789 57.325 58.100 0.024 0.000 1.066 136 Y CB -2.896 35.534 38.460 -0.050 0.000 1.305 136 Y HN 0.176 7.870 8.280 -0.976 0.000 0.499 137 P HA -0.231 4.229 4.420 0.066 0.000 0.216 137 P C 0.532 177.881 177.300 0.081 0.000 1.153 137 P CA 2.521 65.665 63.100 0.075 0.000 0.848 137 P CB 0.372 32.079 31.700 0.012 0.000 0.787 138 Y N -1.870 118.399 120.300 -0.053 0.000 2.337 138 Y HA -0.205 4.204 4.550 -0.235 0.000 0.293 138 Y C 1.552 177.049 175.900 -0.672 0.000 1.123 138 Y CA 1.108 59.007 58.100 -0.334 0.000 1.201 138 Y CB -0.570 37.656 38.460 -0.390 0.000 1.011 138 Y HN -0.145 8.269 8.280 0.224 0.000 0.545 139 F N 0.038 119.751 119.950 -0.396 0.000 2.161 139 F HA -0.565 3.574 4.527 -0.647 0.000 0.300 139 F C 1.035 176.765 175.800 -0.117 0.000 1.089 139 F CA 4.358 62.175 58.000 -0.305 0.000 1.282 139 F CB 0.106 39.167 39.000 0.103 0.000 1.010 139 F HN 0.084 8.479 8.300 0.159 0.000 0.485 140 K N -2.122 118.393 120.400 0.192 0.000 2.031 140 K HA -0.346 4.087 4.320 0.189 0.000 0.205 140 K C 2.785 179.401 176.600 0.027 0.000 1.049 140 K CA 3.175 59.547 56.287 0.142 0.000 0.939 140 K CB -0.183 32.411 32.500 0.156 0.000 0.717 140 K HN -0.477 7.903 8.250 0.231 0.008 0.438 141 A N 0.410 123.231 122.820 0.002 0.000 2.019 141 A HA -0.082 4.452 4.320 -0.024 -0.228 0.219 141 A C 1.557 179.136 177.584 -0.009 0.000 1.164 141 A CA 2.526 54.557 52.037 -0.009 0.000 0.644 141 A CB -0.262 18.724 19.000 -0.023 0.000 0.805 141 A HN -0.421 7.737 8.150 0.013 0.000 0.449 142 M N -6.186 113.347 119.600 -0.112 0.000 2.618 142 M HA 0.012 4.471 4.480 -0.034 0.000 0.240 142 M C -0.558 175.748 176.300 0.010 0.000 1.123 142 M CA -0.998 54.209 55.300 -0.156 0.000 1.060 142 M CB -0.527 31.699 32.600 -0.623 0.000 1.535 142 M HN -0.534 7.615 8.290 -0.206 0.018 0.507 143 K N -4.306 116.093 120.400 -0.003 0.000 3.069 143 K HA -0.429 3.977 4.320 0.052 -0.055 0.267 143 K C 0.319 176.997 176.600 0.129 0.000 1.082 143 K CA 1.392 57.717 56.287 0.063 0.000 0.782 143 K CB -3.208 29.330 32.500 0.063 0.000 1.230 143 K HN -0.241 7.797 8.250 -0.037 0.190 0.488 144 F N -1.511 118.238 119.950 -0.335 0.000 2.365 144 F HA -0.241 4.145 4.527 -0.234 0.000 0.300 144 F C 1.877 177.549 175.800 -0.213 0.000 1.090 144 F CA 1.089 58.826 58.000 -0.439 0.000 1.408 144 F CB -0.781 37.562 39.000 -1.095 0.000 1.060 144 F HN -0.499 7.726 8.300 -0.098 0.017 0.534 145 S N -3.787 111.991 115.700 0.131 0.000 2.402 145 S HA -0.251 4.420 4.470 0.335 0.000 0.229 145 S C 0.895 175.559 174.600 0.106 0.000 1.021 145 S CA 3.090 61.434 58.200 0.239 0.000 0.974 145 S CB 0.004 63.368 63.200 0.273 0.000 0.800 145 S HN 0.366 8.718 8.310 0.113 0.026 0.484 146 T N -3.444 111.145 114.554 0.057 0.000 3.051 146 T HA -0.018 4.340 4.350 0.013 0.000 0.255 146 T C 1.037 175.713 174.700 -0.040 0.000 1.085 146 T CA 1.165 63.271 62.100 0.010 0.000 1.109 146 T CB 1.187 70.058 68.868 0.004 0.000 0.921 146 T HN -0.675 7.602 8.240 0.062 0.000 0.488 147 L N 2.529 123.713 121.223 -0.064 0.000 2.072 147 L HA -0.153 4.097 4.340 -0.150 0.000 0.205 147 L C -1.469 175.265 176.870 -0.227 0.000 1.079 147 L CA 2.184 56.925 54.840 -0.165 0.000 0.752 147 L CB 0.692 42.614 42.059 -0.230 0.000 0.906 147 L HN -0.591 7.528 8.230 -0.031 0.093 0.436 148 L N -3.801 117.307 121.223 -0.192 0.000 2.278 148 L HA -0.100 4.074 4.340 -0.277 0.000 0.287 148 L C -0.105 176.708 176.870 -0.094 0.000 1.072 148 L CA 0.048 54.778 54.840 -0.183 0.000 0.819 148 L CB -0.652 41.350 42.059 -0.095 0.000 1.176 148 L HN -0.525 7.625 8.230 -0.132 0.000 0.435 149 K N 6.123 126.457 120.400 -0.111 0.000 2.044 149 K HA -0.116 4.174 4.320 -0.050 0.000 0.204 149 K C 0.136 176.705 176.600 -0.051 0.000 1.049 149 K CA 1.402 57.649 56.287 -0.067 0.000 0.945 149 K CB 1.350 33.809 32.500 -0.069 0.000 0.724 149 K HN 0.458 8.620 8.250 -0.147 0.000 0.440 150 S N -4.425 111.234 115.700 -0.069 0.000 2.537 150 S HA 0.223 4.671 4.470 -0.038 0.000 0.271 150 S C -2.174 172.372 174.600 -0.090 0.000 1.148 150 S CA -0.536 57.630 58.200 -0.055 0.000 0.868 150 S CB 3.083 66.260 63.200 -0.038 0.000 1.115 150 S HN -0.519 7.734 8.310 -0.094 0.000 0.461 151 V N 2.792 122.652 119.914 -0.090 0.000 2.409 151 V HA 0.245 4.394 4.120 -0.170 -0.131 0.290 151 V C -1.190 174.864 176.094 -0.067 0.000 1.017 151 V CA -0.628 61.581 62.300 -0.152 0.000 0.841 151 V CB 1.389 33.037 31.823 -0.292 0.000 1.003 151 V HN 0.402 8.558 8.190 -0.057 0.000 0.426 152 E N 7.474 127.651 120.200 -0.039 0.000 2.266 152 E HA 0.360 4.709 4.350 -0.001 0.000 0.268 152 E C -1.873 174.733 176.600 0.010 0.000 0.879 152 E CA -1.978 54.419 56.400 -0.006 0.000 0.762 152 E CB 4.230 33.928 29.700 -0.003 0.000 1.199 152 E HN 0.037 8.373 8.360 -0.039 0.000 0.422 153 K N 5.300 125.708 120.400 0.014 0.000 2.349 153 K HA -0.134 4.195 4.320 0.016 0.000 0.288 153 K C -0.548 176.056 176.600 0.007 0.000 1.058 153 K CA 0.821 57.115 56.287 0.011 0.000 0.953 153 K CB -0.113 32.389 32.500 0.003 0.000 0.997 153 K HN 0.508 8.767 8.250 0.015 0.000 0.477 154 V N 7.744 127.666 119.914 0.013 0.000 2.374 154 V HA -0.141 3.984 4.120 0.008 0.000 0.241 154 V C -0.148 175.945 176.094 -0.002 0.000 1.034 154 V CA 1.857 64.163 62.300 0.011 0.000 1.037 154 V CB 0.780 32.617 31.823 0.023 0.000 0.682 154 V HN 0.502 8.705 8.190 0.022 0.000 0.463 155 D N -3.591 116.802 120.400 -0.012 0.000 2.921 155 D HA 0.071 4.685 4.640 -0.045 0.000 0.329 155 D C -0.049 176.185 176.300 -0.109 0.000 1.293 155 D CA -0.950 53.023 54.000 -0.044 0.000 0.964 155 D CB 0.726 41.512 40.800 -0.023 0.000 1.435 155 D HN -0.653 7.714 8.370 -0.004 0.000 0.548 156 M N -2.096 117.374 119.600 -0.217 0.000 2.358 156 M HA -0.193 4.102 4.480 -0.307 0.000 0.264 156 M C 0.084 176.027 176.300 -0.594 0.000 1.064 156 M CA 1.596 56.634 55.300 -0.436 0.000 1.093 156 M CB 0.256 32.494 32.600 -0.603 0.000 1.401 156 M HN 0.289 8.463 8.290 -0.193 0.000 0.440 157 H N -5.947 113.092 119.070 -0.050 0.000 2.510 157 H HA 0.375 4.867 4.556 -0.106 0.000 0.266 157 H C -1.492 173.837 175.328 0.000 0.000 1.146 157 H CA -1.271 54.745 56.048 -0.053 0.000 0.993 157 H CB 0.186 29.929 29.762 -0.033 0.000 1.727 157 H HN -0.151 8.288 8.280 -0.157 -0.253 0.590 158 T N 2.397 116.993 114.554 0.070 0.000 3.071 158 T HA 0.675 5.329 4.350 0.142 -0.219 0.311 158 T C -2.089 172.665 174.700 0.091 0.000 1.042 158 T CA 0.053 62.214 62.100 0.101 0.000 1.028 158 T CB 2.849 71.765 68.868 0.080 0.000 1.068 158 T HN -0.510 7.740 8.240 0.010 -0.004 0.451 159 V N 6.274 126.283 119.914 0.159 0.000 2.540 159 V HA 0.535 4.866 4.120 0.093 -0.155 0.302 159 V C -2.386 173.832 176.094 0.206 0.000 1.035 159 V CA -1.737 60.655 62.300 0.153 0.000 0.873 159 V CB 3.620 35.535 31.823 0.153 0.000 0.992 159 V HN 0.559 8.883 8.190 0.224 0.000 0.428 160 K N 7.847 128.318 120.400 0.118 0.000 2.307 160 K HA 0.598 5.151 4.320 0.134 -0.153 0.263 160 K C -1.669 174.976 176.600 0.076 0.000 0.973 160 K CA -1.537 54.811 56.287 0.102 0.000 0.846 160 K CB 2.781 35.307 32.500 0.045 0.000 1.100 160 K HN 0.237 8.532 8.250 0.075 0.000 0.438 161 I N 8.215 128.867 120.570 0.136 0.000 2.354 161 I HA 0.570 4.896 4.170 -0.048 -0.185 0.292 161 I C -1.165 174.965 176.117 0.022 0.000 0.989 161 I CA -1.207 60.120 61.300 0.044 0.000 1.188 161 I CB 2.201 40.271 38.000 0.117 0.000 1.342 161 I HN 0.754 9.096 8.210 0.220 0.000 0.457 162 T N 9.312 123.831 114.554 -0.058 0.000 2.794 162 T HA 0.730 5.245 4.350 -0.033 -0.184 0.280 162 T C -0.714 173.897 174.700 -0.148 0.000 0.987 162 T CA -0.810 61.250 62.100 -0.068 0.000 0.993 162 T CB 1.565 70.403 68.868 -0.051 0.000 0.939 162 T HN 0.304 8.497 8.240 -0.078 0.000 0.449 163 L N 4.423 125.549 121.223 -0.162 0.000 2.334 163 L HA 0.380 4.690 4.340 -0.287 -0.143 0.272 163 L C -0.606 176.180 176.870 -0.140 0.000 1.020 163 L CA -1.223 53.478 54.840 -0.232 0.000 0.812 163 L CB 1.367 43.241 42.059 -0.308 0.000 1.264 163 L HN 0.388 8.553 8.230 -0.108 0.000 0.439 164 N N 0.415 119.034 118.700 -0.136 0.000 2.463 164 N HA -0.073 4.623 4.740 -0.074 0.000 0.181 164 N C -0.718 174.745 175.510 -0.079 0.000 1.078 164 N CA 1.315 54.311 53.050 -0.090 0.000 0.902 164 N CB 1.098 39.538 38.487 -0.079 0.000 0.970 164 N HN 0.248 8.531 8.380 -0.163 0.000 0.451 165 R N -2.861 117.582 120.500 -0.096 0.000 2.692 165 R HA 0.235 4.545 4.340 -0.050 0.000 0.269 165 R C -1.872 174.391 176.300 -0.061 0.000 1.030 165 R CA -1.379 54.680 56.100 -0.069 0.000 0.882 165 R CB 0.962 31.217 30.300 -0.074 0.000 1.250 165 R HN -0.677 7.469 8.270 -0.126 0.047 0.465 166 Q N 1.076 120.866 119.800 -0.016 0.000 2.392 166 Q HA -0.133 4.228 4.340 0.035 0.000 0.262 166 Q C -0.730 175.294 176.000 0.040 0.000 1.003 166 Q CA 0.712 56.530 55.803 0.026 0.000 0.888 166 Q CB 0.731 29.497 28.738 0.046 0.000 1.260 166 Q HN 0.193 8.457 8.270 -0.010 0.000 0.435 167 D N 1.899 122.353 120.400 0.089 0.000 2.319 167 D HA 0.182 5.036 4.640 0.136 -0.131 0.237 167 D C -0.172 176.267 176.300 0.232 0.000 1.353 167 D CA -0.312 53.766 54.000 0.131 0.000 0.992 167 D CB 1.244 42.079 40.800 0.058 0.000 1.368 167 D HN 0.099 8.545 8.370 0.128 0.000 0.564 168 A N 6.336 129.297 122.820 0.235 0.000 2.076 168 A HA -0.170 4.307 4.320 0.262 0.000 0.220 168 A C 0.337 178.098 177.584 0.295 0.000 1.160 168 A CA 2.478 54.673 52.037 0.263 0.000 0.653 168 A CB 0.176 19.327 19.000 0.251 0.000 0.801 168 A HN 0.538 8.817 8.150 0.214 0.000 0.455 169 T N -6.021 108.712 114.554 0.298 0.000 3.086 169 T HA 0.044 4.568 4.350 0.291 0.000 0.250 169 T C 0.721 175.582 174.700 0.269 0.000 1.074 169 T CA -0.544 61.731 62.100 0.291 0.000 0.988 169 T CB 0.783 69.824 68.868 0.288 0.000 0.988 169 T HN -0.456 8.171 8.240 0.287 -0.215 0.530 170 F N 3.664 123.658 119.950 0.073 0.000 2.102 170 F HA -0.334 4.193 4.527 0.001 0.000 0.298 170 F C 0.790 176.544 175.800 -0.075 0.000 1.105 170 F CA 3.233 61.194 58.000 -0.065 0.000 1.239 170 F CB 0.016 38.800 39.000 -0.360 0.000 0.991 170 F HN -0.523 7.948 8.300 0.377 0.055 0.474 171 L N -3.044 118.125 121.223 -0.091 0.000 2.017 171 L HA -0.439 3.644 4.340 -0.428 0.000 0.208 171 L C 1.614 178.333 176.870 -0.251 0.000 1.073 171 L CA 3.020 57.714 54.840 -0.243 0.000 0.745 171 L CB -0.555 41.455 42.059 -0.081 0.000 0.894 171 L HN -0.144 8.156 8.230 0.118 0.000 0.432 172 A N -3.314 119.471 122.820 -0.059 0.000 1.930 172 A HA -0.245 3.970 4.320 -0.175 0.000 0.217 172 A C 2.699 180.286 177.584 0.004 0.000 1.175 172 A CA 2.577 54.612 52.037 -0.003 0.000 0.627 172 A CB -0.796 18.360 19.000 0.261 0.000 0.815 172 A HN -0.091 8.086 8.150 0.044 0.000 0.443 173 S N 0.322 116.024 115.700 0.003 0.000 2.423 173 S HA -0.198 4.307 4.470 0.058 0.000 0.231 173 S C 1.974 176.483 174.600 -0.151 0.000 1.014 173 S CA 3.170 61.383 58.200 0.022 0.000 0.965 173 S CB -0.426 62.895 63.200 0.203 0.000 0.785 173 S HN -0.178 8.062 8.310 0.019 0.081 0.495 174 L N -1.265 119.752 121.223 -0.344 0.000 2.551 174 L HA -0.117 3.964 4.340 -0.432 0.000 0.228 174 L C 1.291 177.910 176.870 -0.418 0.000 1.153 174 L CA 1.177 55.743 54.840 -0.456 0.000 0.851 174 L CB -0.848 40.836 42.059 -0.626 0.000 0.959 174 L HN -0.491 7.375 8.230 -0.406 0.120 0.451 175 G N -2.751 105.830 108.800 -0.364 0.000 2.920 175 G HA2 -0.070 3.899 3.960 -0.344 0.000 0.208 175 G HA3 -0.070 3.605 3.960 -0.476 0.000 0.208 175 G C -0.861 173.955 174.900 -0.140 0.000 1.159 175 G CA -0.237 44.668 45.100 -0.325 0.000 0.784 175 G HN -0.596 7.334 8.290 -0.336 0.158 0.535 176 M N -0.083 119.385 119.600 -0.221 0.000 2.250 176 M HA -0.019 4.362 4.480 -0.164 0.000 0.344 176 M C 0.307 176.350 176.300 -0.429 0.000 1.150 176 M CA 0.500 55.649 55.300 -0.252 0.000 1.147 176 M CB 1.073 33.562 32.600 -0.184 0.000 1.498 176 M HN -0.684 7.280 8.290 -0.279 0.158 0.461 177 D N 2.471 122.584 120.400 -0.479 0.000 2.158 177 D HA -0.337 4.002 4.640 -0.501 0.000 0.197 177 D C 2.208 178.218 176.300 -0.485 0.000 0.995 177 D CA 4.537 58.159 54.000 -0.629 0.000 0.846 177 D CB -0.070 39.969 40.800 -1.268 0.000 0.941 177 D HN 0.652 8.731 8.370 -0.486 0.000 0.456 178 F N -5.007 114.698 119.950 -0.409 0.000 2.333 178 F HA -0.077 4.584 4.527 -0.049 -0.164 0.300 178 F C 0.234 175.941 175.800 -0.154 0.000 1.083 178 F CA 0.855 58.765 58.000 -0.150 0.000 1.395 178 F CB -0.199 38.788 39.000 -0.021 0.000 1.056 178 F HN -0.489 7.766 8.300 -0.049 0.016 0.529 179 I N -0.990 118.914 120.570 -1.110 0.000 3.805 179 I HA 0.165 3.898 4.170 -0.728 0.000 0.337 179 I C -1.337 174.447 176.117 -0.556 0.000 1.539 179 I CA -2.463 58.270 61.300 -0.945 0.000 1.176 179 I CB -0.310 36.926 38.000 -1.273 0.000 1.248 179 I HN -0.687 6.766 8.210 -1.202 0.036 0.437 180 S N 1.361 116.811 115.700 -0.416 0.000 2.566 180 S HA -0.095 4.321 4.470 -0.286 -0.117 0.280 180 S C -0.148 174.339 174.600 -0.189 0.000 1.343 180 S CA 1.365 59.361 58.200 -0.340 0.000 1.036 180 S CB 0.511 63.374 63.200 -0.562 0.000 0.866 180 S HN -0.532 7.460 8.310 -0.413 0.071 0.526 181 I N 3.298 123.825 120.570 -0.071 0.000 2.304 181 I HA -0.085 4.203 4.170 0.196 0.000 0.291 181 I C -1.077 175.236 176.117 0.327 0.000 1.018 181 I CA -2.110 59.280 61.300 0.150 0.000 1.260 181 I CB -1.841 36.229 38.000 0.118 0.000 1.390 181 I HN -0.255 7.913 8.210 -0.070 0.000 0.475 182 Y N 6.028 126.471 120.300 0.238 0.000 2.344 182 Y HA 0.007 4.850 4.550 0.489 0.000 0.330 182 Y C 0.725 176.747 175.900 0.203 0.000 1.330 182 Y CA -0.868 57.418 58.100 0.310 0.000 1.479 182 Y CB 1.830 40.422 38.460 0.221 0.000 1.428 182 Y HN -0.173 8.524 8.280 0.694 0.000 0.544 183 S N -0.965 114.737 115.700 0.005 0.000 2.410 183 S HA 0.054 4.226 4.470 -0.698 -0.121 0.304 183 S C 0.503 174.738 174.600 -0.608 0.000 1.095 183 S CA -2.001 55.828 58.200 -0.618 0.000 1.089 183 S CB -0.102 62.449 63.200 -1.082 0.000 0.968 183 S HN 0.350 8.718 8.310 0.097 0.000 0.480 184 A N 9.029 131.540 122.820 -0.515 0.000 1.933 184 A HA -0.291 3.306 4.320 -1.206 0.000 0.218 184 A C 1.178 178.501 177.584 -0.434 0.000 1.175 184 A CA 3.307 54.964 52.037 -0.634 0.000 0.628 184 A CB -0.350 18.516 19.000 -0.223 0.000 0.814 184 A HN 0.566 8.829 8.150 -0.286 -0.285 0.444 185 E N -0.484 119.549 120.200 -0.278 0.000 2.047 185 E HA -0.336 3.981 4.350 -0.056 0.000 0.191 185 E C 1.734 178.218 176.600 -0.193 0.000 0.987 185 E CA 2.779 59.118 56.400 -0.101 0.000 0.799 185 E CB -0.019 29.753 29.700 0.119 0.000 0.752 185 E HN -0.080 8.116 8.360 -0.272 0.000 0.449 186 Y N 0.347 120.157 120.300 -0.817 0.000 2.114 186 Y HA -0.442 3.157 4.550 -1.585 0.000 0.282 186 Y C 1.544 177.101 175.900 -0.571 0.000 1.165 186 Y CA 1.840 59.229 58.100 -1.184 0.000 1.148 186 Y CB -0.394 37.285 38.460 -1.301 0.000 0.972 186 Y HN -0.410 7.496 8.280 -0.623 0.000 0.504 187 A N -1.926 120.537 122.820 -0.596 0.000 1.902 187 A HA -0.348 3.629 4.320 -0.571 0.000 0.217 187 A C 2.064 179.544 177.584 -0.173 0.000 1.181 187 A CA 2.866 54.535 52.037 -0.614 0.000 0.623 187 A CB -0.800 17.453 19.000 -1.246 0.000 0.818 187 A HN -0.428 7.322 8.150 -0.667 0.000 0.443 188 D N -1.322 118.983 120.400 -0.159 0.000 2.097 188 D HA -0.262 4.413 4.640 0.059 0.000 0.195 188 D C 2.701 179.021 176.300 0.034 0.000 0.989 188 D CA 3.305 57.304 54.000 -0.003 0.000 0.827 188 D CB -0.439 40.358 40.800 -0.006 0.000 0.966 188 D HN -0.370 7.853 8.370 -0.246 0.000 0.456 189 K N -0.841 119.576 120.400 0.028 0.000 2.057 189 K HA -0.179 4.200 4.320 0.099 0.000 0.206 189 K C 2.603 179.243 176.600 0.066 0.000 1.050 189 K CA 2.391 58.735 56.287 0.094 0.000 0.935 189 K CB -0.171 32.463 32.500 0.224 0.000 0.715 189 K HN -0.287 7.960 8.250 -0.005 0.000 0.439 190 M N -2.068 117.530 119.600 -0.003 0.000 2.254 190 M HA -0.094 4.397 4.480 0.018 0.000 0.265 190 M C 1.796 178.113 176.300 0.028 0.000 1.066 190 M CA 0.644 55.935 55.300 -0.015 0.000 1.123 190 M CB -1.002 31.499 32.600 -0.166 0.000 1.388 190 M HN -0.278 7.968 8.290 -0.073 0.000 0.425 191 L N 0.820 122.089 121.223 0.076 0.000 2.056 191 L HA -0.275 4.051 4.340 -0.022 0.000 0.207 191 L C 2.079 178.960 176.870 0.020 0.000 1.078 191 L CA 3.024 57.888 54.840 0.038 0.000 0.749 191 L CB -0.766 41.354 42.059 0.102 0.000 0.901 191 L HN -0.255 8.042 8.230 0.112 0.000 0.433 192 A N -0.309 122.535 122.820 0.039 0.000 1.972 192 A HA -0.250 4.085 4.320 0.025 0.000 0.219 192 A C 1.090 178.692 177.584 0.030 0.000 1.169 192 A CA 2.633 54.690 52.037 0.033 0.000 0.635 192 A CB -0.658 18.369 19.000 0.044 0.000 0.810 192 A HN -0.233 7.949 8.150 0.052 0.000 0.446 193 A N -4.323 118.519 122.820 0.036 0.000 2.238 193 A HA 0.065 4.407 4.320 0.036 0.000 0.208 193 A C 0.256 177.853 177.584 0.021 0.000 1.177 193 A CA -0.406 51.652 52.037 0.036 0.000 0.804 193 A CB 0.022 19.054 19.000 0.054 0.000 0.823 193 A HN -0.580 7.484 8.150 0.041 0.111 0.482 194 G N -2.549 106.256 108.800 0.007 0.000 2.136 194 G HA2 -0.251 3.698 3.960 -0.018 0.000 0.242 194 G HA3 -0.251 3.708 3.960 -0.001 0.000 0.242 194 G C -0.162 174.731 174.900 -0.011 0.000 0.989 194 G CA 0.396 45.492 45.100 -0.007 0.000 0.682 194 G HN -0.454 7.660 8.290 0.005 0.179 0.522 195 K N -3.327 117.069 120.400 -0.008 0.000 3.146 195 K HA 0.651 5.074 4.320 -0.013 -0.110 0.168 195 K C -2.191 174.399 176.600 -0.017 0.000 1.075 195 K CA -3.404 52.879 56.287 -0.007 0.000 0.843 195 K CB 0.637 33.146 32.500 0.016 0.000 1.002 195 K HN -0.277 7.940 8.250 -0.002 0.032 0.597 196 P HA -0.135 4.327 4.420 0.070 0.000 0.220 196 P C 1.132 178.463 177.300 0.052 0.000 1.148 196 P CA 1.756 64.838 63.100 -0.030 0.000 0.803 196 P CB 0.224 31.704 31.700 -0.367 0.000 0.782 197 E N -2.309 117.896 120.200 0.008 0.000 2.333 197 E HA -0.258 4.131 4.350 0.066 0.000 0.198 197 E C 1.636 178.266 176.600 0.051 0.000 1.007 197 E CA 2.694 59.120 56.400 0.042 0.000 0.845 197 E CB -1.410 28.306 29.700 0.025 0.000 0.766 197 E HN 0.224 8.547 8.360 -0.019 0.026 0.507 198 T N 1.603 116.166 114.554 0.015 0.000 2.803 198 T HA -0.335 4.043 4.350 0.048 0.000 0.269 198 T C 1.636 176.318 174.700 -0.030 0.000 1.052 198 T CA 4.501 66.605 62.100 0.006 0.000 1.136 198 T CB 0.044 68.908 68.868 -0.006 0.000 0.864 198 T HN -0.532 7.656 8.240 0.002 0.053 0.467 199 I N -4.307 116.175 120.570 -0.147 0.000 2.676 199 I HA -0.205 3.860 4.170 -0.175 0.000 0.259 199 I C 0.070 176.296 176.117 0.182 0.000 1.194 199 I CA 2.552 63.767 61.300 -0.141 0.000 1.473 199 I CB -0.226 37.589 38.000 -0.309 0.000 1.096 199 I HN -0.753 7.366 8.210 -0.125 0.016 0.443 200 D N 0.050 120.550 120.400 0.166 0.000 2.162 200 D HA -0.070 4.751 4.640 0.301 0.000 0.205 200 D C 1.604 178.004 176.300 0.167 0.000 0.964 200 D CA 3.057 57.184 54.000 0.211 0.000 0.847 200 D CB 0.541 41.437 40.800 0.160 0.000 0.988 200 D HN -0.469 7.845 8.370 0.126 0.131 0.480 201 T N -4.857 109.760 114.554 0.106 0.000 3.043 201 T HA -0.052 4.384 4.350 0.143 0.000 0.263 201 T C 1.143 175.747 174.700 -0.160 0.000 1.094 201 T CA 2.123 64.263 62.100 0.067 0.000 1.127 201 T CB 0.811 69.735 68.868 0.093 0.000 0.905 201 T HN -0.647 7.651 8.240 0.097 0.000 0.490 202 T N 4.633 119.124 114.554 -0.106 0.000 3.317 202 T HA 0.433 4.436 4.350 -0.577 0.000 0.361 202 T C -2.577 172.089 174.700 -0.057 0.000 1.499 202 T CA -2.804 59.183 62.100 -0.190 0.000 1.529 202 T CB 0.518 69.450 68.868 0.107 0.000 0.997 202 T HN -0.500 7.715 8.240 0.017 0.035 0.624 203 P HA -0.084 4.441 4.420 0.175 0.000 0.268 203 P C -1.905 175.390 177.300 -0.008 0.000 1.204 203 P CA -0.250 62.830 63.100 -0.033 0.000 0.768 203 P CB 0.612 32.222 31.700 -0.151 0.000 0.842 204 I N 2.064 122.649 120.570 0.026 0.000 2.418 204 I HA 0.193 4.380 4.170 0.028 0.000 0.287 204 I C -0.761 175.297 176.117 -0.099 0.000 1.008 204 I CA -1.442 59.812 61.300 -0.076 0.000 1.104 204 I CB 2.124 39.859 38.000 -0.443 0.000 1.264 204 I HN 0.090 8.411 8.210 0.184 0.000 0.438 205 G N 2.812 111.441 108.800 -0.286 0.000 3.086 205 G HA2 0.625 4.674 3.960 0.149 0.000 0.282 205 G HA3 0.625 4.440 3.960 -0.549 -0.184 0.282 205 G C -1.521 172.962 174.900 -0.696 0.000 1.343 205 G CA -0.464 44.445 45.100 -0.318 0.000 0.895 205 G HN -0.268 7.845 8.290 -0.295 0.000 0.557 206 T N -1.879 112.369 114.554 -0.511 0.000 3.054 206 T HA 0.523 4.686 4.350 -0.538 -0.136 0.255 206 T C 0.441 175.186 174.700 0.075 0.000 1.035 206 T CA -1.618 60.226 62.100 -0.427 0.000 0.941 206 T CB 0.931 69.517 68.868 -0.470 0.000 1.026 206 T HN 0.382 8.447 8.240 -0.290 0.000 0.533 207 G N 1.639 110.443 108.800 0.006 0.000 2.651 207 G HA2 0.140 4.316 3.960 0.101 0.000 0.260 207 G HA3 0.140 4.088 3.960 0.004 0.014 0.260 207 G C -1.124 173.608 174.900 -0.280 0.000 1.216 207 G CA -1.756 43.358 45.100 0.024 0.000 0.913 207 G HN -0.539 7.602 8.290 -0.148 0.060 0.535 208 P HA -0.094 3.020 4.420 -2.177 0.000 0.223 208 P C -1.095 175.601 177.300 -1.007 0.000 1.151 208 P CA 1.274 63.434 63.100 -1.566 0.000 0.787 208 P CB 0.440 31.132 31.700 -1.680 0.000 0.788 209 F N -3.601 116.192 119.950 -0.262 0.000 2.579 209 F HA 0.708 5.295 4.527 -0.153 -0.152 0.324 209 F C -1.510 174.115 175.800 -0.292 0.000 1.058 209 F CA -1.590 56.298 58.000 -0.186 0.000 0.944 209 F CB 4.112 43.020 39.000 -0.152 0.000 1.245 209 F HN -0.492 7.703 8.300 -0.138 0.021 0.477 210 L N -5.300 115.800 121.223 -0.206 0.000 2.333 210 L HA 0.594 4.535 4.340 -0.664 0.000 0.269 210 L C -1.604 175.239 176.870 -0.044 0.000 1.010 210 L CA -1.434 53.097 54.840 -0.514 0.000 0.818 210 L CB 2.420 43.939 42.059 -0.900 0.000 1.306 210 L HN 0.561 8.755 8.230 -0.060 0.000 0.430 211 F N 2.886 122.743 119.950 -0.155 0.000 2.467 211 F HA -0.131 4.221 4.527 -0.291 0.000 0.362 211 F C -1.185 174.469 175.800 -0.244 0.000 1.090 211 F CA 0.647 58.520 58.000 -0.212 0.000 1.202 211 F CB 1.141 40.029 39.000 -0.187 0.000 1.113 211 F HN 0.407 8.785 8.300 0.131 0.000 0.541 212 A N 6.613 128.888 122.820 -0.909 0.000 2.606 212 A HA 0.210 4.259 4.320 -0.452 0.000 0.290 212 A C -2.033 175.048 177.584 -0.839 0.000 1.174 212 A CA -0.833 50.813 52.037 -0.652 0.000 0.958 212 A CB 2.012 20.783 19.000 -0.382 0.000 1.194 212 A HN 0.674 8.130 8.150 -1.157 0.000 0.526 213 G N -3.768 104.064 108.800 -1.614 0.000 2.484 213 G HA2 -0.262 3.213 3.960 -0.808 0.000 0.685 213 G HA3 -0.262 3.362 3.960 -0.561 0.000 0.685 213 G C -3.595 170.898 174.900 -0.678 0.000 1.294 213 G CA -0.342 44.167 45.100 -0.986 0.000 0.879 213 G HN -0.612 5.939 8.290 -2.899 0.000 0.646 214 Y N 1.579 121.709 120.300 -0.284 0.000 2.386 214 Y HA 0.684 5.352 4.550 -0.074 -0.162 0.334 214 Y C -1.974 173.941 175.900 0.025 0.000 1.002 214 Y CA -1.405 56.669 58.100 -0.043 0.000 1.068 214 Y CB 2.914 41.463 38.460 0.148 0.000 1.203 214 Y HN -0.005 8.279 8.280 0.008 0.000 0.443 215 Q N 7.820 127.328 119.800 -0.486 0.000 2.333 215 Q HA 0.402 4.494 4.340 -0.413 0.000 0.265 215 Q C -0.688 174.828 176.000 -0.807 0.000 0.989 215 Q CA -1.879 53.627 55.803 -0.495 0.000 0.842 215 Q CB 2.695 31.301 28.738 -0.219 0.000 1.262 215 Q HN 0.457 8.545 8.270 -0.304 0.000 0.451 216 V N 4.918 124.399 119.914 -0.722 0.000 2.644 216 V HA -0.507 3.187 4.120 -0.711 0.000 0.305 216 V C -0.148 175.854 176.094 -0.153 0.000 1.053 216 V CA 2.040 64.056 62.300 -0.472 0.000 1.186 216 V CB -0.146 31.607 31.823 -0.118 0.000 0.895 216 V HN 0.383 8.268 8.190 -0.509 0.000 0.490 217 D N 1.078 121.509 120.400 0.051 0.000 3.039 217 D HA -0.412 4.323 4.640 0.159 0.000 0.222 217 D C -0.873 175.462 176.300 0.059 0.000 1.179 217 D CA 2.320 56.377 54.000 0.095 0.000 0.880 217 D CB -2.146 38.691 40.800 0.062 0.000 1.115 217 D HN 0.355 8.848 8.370 0.205 0.000 0.416 218 Q N -5.577 114.241 119.800 0.030 0.000 2.618 218 Q HA 0.065 4.432 4.340 0.045 0.000 0.209 218 Q C -1.289 174.775 176.000 0.108 0.000 0.797 218 Q CA 1.313 57.138 55.803 0.037 0.000 0.888 218 Q CB 3.653 32.377 28.738 -0.023 0.000 1.244 218 Q HN -0.061 8.141 8.270 -0.022 0.055 0.626 219 K N -3.663 116.820 120.400 0.138 0.000 2.639 219 K HA 0.589 5.272 4.320 0.311 -0.176 0.279 219 K C -2.374 174.422 176.600 0.328 0.000 0.976 219 K CA -0.507 55.924 56.287 0.240 0.000 0.861 219 K CB 3.475 36.060 32.500 0.142 0.000 1.436 219 K HN -0.452 7.836 8.250 0.065 0.000 0.400 220 S N 0.332 116.266 115.700 0.389 0.000 2.578 220 S HA 0.918 5.618 4.470 0.120 -0.158 0.301 220 S C -0.450 174.063 174.600 -0.145 0.000 1.091 220 S CA -1.570 56.730 58.200 0.166 0.000 1.032 220 S CB 3.112 66.504 63.200 0.320 0.000 1.064 220 S HN 0.095 8.675 8.310 0.448 0.000 0.508 221 R N -0.150 119.984 120.500 -0.611 0.000 2.807 221 R HA 0.925 5.288 4.340 -0.201 -0.143 0.276 221 R C -1.132 174.585 176.300 -0.972 0.000 0.979 221 R CA -1.342 54.448 56.100 -0.516 0.000 0.928 221 R CB 4.235 34.343 30.300 -0.320 0.000 1.191 221 R HN 0.180 7.968 8.270 -0.803 0.000 0.471 222 Y N -2.702 117.493 120.300 -0.176 0.000 2.562 222 Y HA 0.874 5.492 4.550 -0.177 -0.174 0.345 222 Y C -1.094 174.775 175.900 -0.051 0.000 1.045 222 Y CA -1.702 56.308 58.100 -0.150 0.000 1.028 222 Y CB 4.500 42.845 38.460 -0.192 0.000 1.297 222 Y HN 0.568 8.867 8.280 0.031 0.000 0.463 223 L N -1.286 120.026 121.223 0.149 0.000 2.354 223 L HA 0.579 5.155 4.340 0.177 -0.129 0.264 223 L C -0.739 176.270 176.870 0.232 0.000 1.008 223 L CA -2.148 52.784 54.840 0.154 0.000 0.819 223 L CB 4.782 46.863 42.059 0.037 0.000 1.339 223 L HN 0.140 8.436 8.230 0.111 0.000 0.420 224 A N 0.248 123.199 122.820 0.218 0.000 2.548 224 A HA -0.106 4.235 4.320 -0.175 -0.126 0.247 224 A C -0.471 177.110 177.584 -0.005 0.000 1.067 224 A CA 0.307 52.351 52.037 0.012 0.000 0.757 224 A CB 0.427 19.425 19.000 -0.003 0.000 0.996 224 A HN 0.023 8.301 8.150 0.213 0.000 0.504 225 H N 5.963 124.900 119.070 -0.222 0.000 3.157 225 H HA 0.006 4.512 4.556 -0.083 0.000 0.260 225 H C 0.948 176.259 175.328 -0.028 0.000 1.232 225 H CA -1.098 54.885 56.048 -0.108 0.000 1.488 225 H CB -0.365 29.359 29.762 -0.063 0.000 1.548 225 H HN 0.018 8.197 8.280 -0.168 0.000 0.487 226 K N 6.328 126.755 120.400 0.044 0.000 2.152 226 K HA -0.297 4.001 4.320 -0.037 0.000 0.206 226 K C 0.284 176.800 176.600 -0.139 0.000 1.048 226 K CA 3.333 59.598 56.287 -0.036 0.000 0.933 226 K CB 0.047 32.556 32.500 0.014 0.000 0.721 226 K HN 0.183 8.514 8.250 0.135 0.000 0.447 227 E N -4.773 115.243 120.200 -0.306 0.000 2.419 227 E HA 0.037 4.284 4.350 -0.172 0.000 0.190 227 E C -0.490 175.805 176.600 -0.509 0.000 1.040 227 E CA -1.376 54.835 56.400 -0.315 0.000 0.900 227 E CB -0.590 29.038 29.700 -0.120 0.000 1.054 227 E HN -0.456 7.677 8.360 -0.342 0.022 0.462 228 Y N 1.684 121.513 120.300 -0.786 0.000 2.811 228 Y HA -0.311 3.912 4.550 -0.546 0.000 0.334 228 Y C 1.919 177.619 175.900 -0.333 0.000 1.247 228 Y CA 0.244 58.003 58.100 -0.568 0.000 1.526 228 Y CB 0.780 38.948 38.460 -0.487 0.000 1.284 228 Y HN -0.644 7.281 8.280 -0.475 0.070 0.586 229 W N 7.264 128.129 121.300 -0.726 0.000 2.392 229 W HA -0.245 4.212 4.660 -0.338 0.000 0.279 229 W C -0.902 175.294 176.519 -0.537 0.000 1.225 229 W CA 1.557 58.580 57.345 -0.536 0.000 1.233 229 W CB -0.779 28.416 29.460 -0.441 0.000 1.122 229 W HN 0.707 8.482 8.180 -0.675 0.000 0.561 230 K N -1.519 117.920 120.400 -1.601 0.000 2.374 230 K HA 0.015 3.987 4.320 -0.581 0.000 0.196 230 K C -0.261 176.133 176.600 -0.343 0.000 1.023 230 K CA -0.068 55.607 56.287 -1.021 0.000 1.103 230 K CB 0.625 32.220 32.500 -1.509 0.000 0.848 230 K HN -0.482 6.110 8.250 -2.716 0.029 0.528 231 G N -0.607 108.045 108.800 -0.247 0.000 2.906 231 G HA2 -0.307 3.622 3.960 -0.051 0.000 0.686 231 G HA3 -0.307 3.653 3.960 0.001 0.000 0.686 231 G C -1.915 173.059 174.900 0.124 0.000 1.170 231 G CA -0.637 44.448 45.100 -0.025 0.000 0.775 231 G HN -0.625 7.275 8.290 -0.377 0.164 0.630 232 K N 3.462 123.892 120.400 0.049 0.000 2.485 232 K HA -0.158 4.181 4.320 0.031 0.000 0.277 232 K C 0.003 176.636 176.600 0.054 0.000 0.990 232 K CA 0.594 56.904 56.287 0.038 0.000 0.994 232 K CB 0.783 33.275 32.500 -0.013 0.000 0.906 232 K HN 0.198 8.452 8.250 0.006 0.000 0.488 233 A N 5.365 128.187 122.820 0.003 0.000 2.466 233 A HA -0.075 4.144 4.320 -0.169 0.000 0.238 233 A C -0.038 177.507 177.584 -0.065 0.000 1.074 233 A CA 0.449 52.431 52.037 -0.092 0.000 0.774 233 A CB 0.596 19.430 19.000 -0.276 0.000 1.015 233 A HN 0.479 8.580 8.150 -0.081 0.000 0.498 234 D N -0.668 119.682 120.400 -0.084 0.000 2.277 234 D HA -0.097 4.529 4.640 -0.022 0.000 0.208 234 D C 0.099 176.427 176.300 0.047 0.000 0.962 234 D CA 2.047 56.032 54.000 -0.025 0.000 0.865 234 D CB 0.356 41.128 40.800 -0.047 0.000 0.939 234 D HN 0.337 8.616 8.370 -0.152 0.000 0.510 235 I N -1.018 119.618 120.570 0.111 0.000 2.331 235 I HA -0.143 4.115 4.170 0.147 0.000 0.292 235 I C -1.120 175.135 176.117 0.230 0.000 0.998 235 I CA 0.005 61.417 61.300 0.186 0.000 1.267 235 I CB 0.825 38.961 38.000 0.226 0.000 1.386 235 I HN -0.540 7.717 8.210 0.119 0.024 0.476 236 D N 4.474 124.972 120.400 0.163 0.000 2.213 236 D HA -0.015 4.702 4.640 0.128 0.000 0.205 236 D C -0.134 176.268 176.300 0.171 0.000 0.961 236 D CA 2.212 56.296 54.000 0.140 0.000 0.853 236 D CB 1.395 42.247 40.800 0.086 0.000 0.967 236 D HN -0.104 8.348 8.370 0.136 0.000 0.496 237 R N -1.936 118.663 120.500 0.165 0.000 2.604 237 R HA 0.481 5.048 4.340 0.147 -0.139 0.281 237 R C -2.858 173.522 176.300 0.134 0.000 1.020 237 R CA -0.767 55.415 56.100 0.137 0.000 0.899 237 R CB 3.732 34.085 30.300 0.090 0.000 1.205 237 R HN -0.643 7.725 8.270 0.163 0.000 0.450 238 L N 4.602 125.894 121.223 0.116 0.000 2.385 238 L HA 0.718 5.334 4.340 0.184 -0.166 0.273 238 L C -1.848 175.192 176.870 0.283 0.000 0.990 238 L CA -1.259 53.665 54.840 0.140 0.000 0.821 238 L CB 3.789 45.768 42.059 -0.134 0.000 1.279 238 L HN 0.301 8.608 8.230 0.128 0.000 0.412 239 I N 0.568 121.342 120.570 0.339 0.000 2.418 239 I HA 0.430 4.917 4.170 0.313 -0.129 0.287 239 I C -1.400 175.037 176.117 0.533 0.000 1.008 239 I CA -2.500 59.005 61.300 0.340 0.000 1.104 239 I CB 1.895 40.004 38.000 0.181 0.000 1.264 239 I HN 0.493 8.906 8.210 0.338 0.000 0.438 240 F N 7.607 127.708 119.950 0.252 0.000 2.406 240 F HA 0.256 5.083 4.527 0.176 -0.194 0.358 240 F C -0.660 175.248 175.800 0.179 0.000 1.161 240 F CA -1.606 56.529 58.000 0.224 0.000 1.185 240 F CB 0.351 39.537 39.000 0.310 0.000 1.421 240 F HN 0.428 9.165 8.300 0.729 0.000 0.576 241 E N 2.761 123.101 120.200 0.235 0.000 2.257 241 E HA 0.118 4.684 4.350 0.168 -0.116 0.278 241 E C -0.639 176.040 176.600 0.131 0.000 1.049 241 E CA -0.558 55.934 56.400 0.153 0.000 0.876 241 E CB 0.711 30.459 29.700 0.081 0.000 1.035 241 E HN -0.095 8.372 8.360 0.179 0.000 0.419 242 I N 6.792 127.451 120.570 0.149 0.000 2.308 242 I HA 0.022 4.441 4.170 0.124 -0.175 0.293 242 I C -0.570 175.595 176.117 0.079 0.000 1.078 242 I CA 0.459 61.836 61.300 0.129 0.000 1.292 242 I CB -0.120 37.981 38.000 0.169 0.000 1.423 242 I HN 0.249 8.555 8.210 0.160 0.000 0.493 243 V N 8.246 128.194 119.914 0.057 0.000 2.276 243 V HA 0.445 4.586 4.120 0.034 0.000 0.268 243 V C -1.704 174.410 176.094 0.034 0.000 1.032 243 V CA -2.892 59.429 62.300 0.036 0.000 0.810 243 V CB 1.651 33.486 31.823 0.021 0.000 1.060 243 V HN 0.470 8.693 8.190 0.055 0.000 0.446 244 P HA 0.115 4.764 4.420 0.032 -0.210 0.223 244 P C -0.189 177.120 177.300 0.015 0.000 1.151 244 P CA 0.919 64.034 63.100 0.025 0.000 0.787 244 P CB 0.112 31.824 31.700 0.019 0.000 0.788 245 D N -1.110 119.297 120.400 0.012 0.000 2.313 245 D HA 0.079 4.718 4.640 -0.002 0.000 0.239 245 D C 0.042 176.352 176.300 0.017 0.000 1.142 245 D CA -1.627 52.376 54.000 0.006 0.000 0.847 245 D CB 0.461 41.263 40.800 0.002 0.000 1.082 245 D HN -0.142 8.207 8.370 0.014 0.030 0.480 246 A N 7.860 130.689 122.820 0.015 0.000 1.948 246 A HA -0.357 3.985 4.320 0.037 0.000 0.220 246 A C 1.485 179.096 177.584 0.044 0.000 1.177 246 A CA 3.022 55.075 52.037 0.026 0.000 0.636 246 A CB -0.202 18.803 19.000 0.008 0.000 0.815 246 A HN 0.660 8.813 8.150 0.005 0.000 0.449 247 T N 0.851 115.427 114.554 0.036 0.000 2.746 247 T HA -0.355 4.056 4.350 0.101 0.000 0.267 247 T C 1.712 176.451 174.700 0.065 0.000 1.039 247 T CA 4.366 66.504 62.100 0.064 0.000 1.142 247 T CB -0.107 68.781 68.868 0.033 0.000 0.866 247 T HN -0.382 8.101 8.240 0.019 -0.231 0.444 248 A N 1.155 123.994 122.820 0.032 0.000 1.930 248 A HA -0.218 4.104 4.320 0.002 0.000 0.217 248 A C 1.927 179.523 177.584 0.020 0.000 1.175 248 A CA 2.774 54.819 52.037 0.014 0.000 0.627 248 A CB -0.828 18.175 19.000 0.005 0.000 0.815 248 A HN -0.554 7.610 8.150 0.024 0.000 0.443 249 R N -1.494 119.029 120.500 0.039 0.000 2.081 249 R HA -0.326 4.022 4.340 0.014 0.000 0.235 249 R C 2.244 178.592 176.300 0.079 0.000 1.131 249 R CA 3.494 59.617 56.100 0.038 0.000 0.960 249 R CB -0.135 30.186 30.300 0.035 0.000 0.856 249 R HN -0.425 7.789 8.270 0.042 0.081 0.436 250 Y N 0.238 120.510 120.300 -0.045 0.000 2.181 250 Y HA -0.321 4.195 4.550 -0.057 0.000 0.288 250 Y C 1.166 177.035 175.900 -0.050 0.000 1.146 250 Y CA 1.523 59.592 58.100 -0.052 0.000 1.164 250 Y CB -0.316 38.113 38.460 -0.051 0.000 0.982 250 Y HN -0.427 7.978 8.280 0.208 0.000 0.515 251 A N -1.564 121.183 122.820 -0.121 0.000 1.902 251 A HA -0.312 3.796 4.320 -0.353 0.000 0.217 251 A C 2.054 179.537 177.584 -0.169 0.000 1.181 251 A CA 2.877 54.786 52.037 -0.215 0.000 0.623 251 A CB -0.645 18.288 19.000 -0.112 0.000 0.818 251 A HN -0.357 7.788 8.150 -0.008 0.000 0.443 252 K N -1.293 119.049 120.400 -0.097 0.000 2.057 252 K HA -0.292 3.976 4.320 -0.086 0.000 0.206 252 K C 2.191 178.731 176.600 -0.100 0.000 1.050 252 K CA 2.938 59.175 56.287 -0.084 0.000 0.935 252 K CB -0.064 32.403 32.500 -0.055 0.000 0.715 252 K HN -0.430 7.781 8.250 -0.065 0.000 0.439 253 L N 0.370 121.540 121.223 -0.088 0.000 2.042 253 L HA -0.289 4.165 4.340 -0.091 -0.168 0.210 253 L C 1.961 178.760 176.870 -0.118 0.000 1.076 253 L CA 2.785 57.575 54.840 -0.082 0.000 0.749 253 L CB -0.225 41.832 42.059 -0.004 0.000 0.893 253 L HN -0.298 7.894 8.230 -0.064 0.000 0.432 254 Q N -2.634 117.047 119.800 -0.198 0.000 2.124 254 Q HA -0.350 3.887 4.340 -0.172 0.000 0.202 254 Q C 2.567 178.477 176.000 -0.150 0.000 0.977 254 Q CA 2.846 58.519 55.803 -0.215 0.000 0.850 254 Q CB 0.038 28.555 28.738 -0.367 0.000 0.901 254 Q HN -0.415 7.698 8.270 -0.261 0.000 0.429 255 A N -4.256 118.480 122.820 -0.140 0.000 2.206 255 A HA -0.046 4.215 4.320 -0.100 0.000 0.211 255 A C 0.073 177.603 177.584 -0.091 0.000 1.158 255 A CA 0.487 52.461 52.037 -0.105 0.000 0.761 255 A CB -0.133 18.810 19.000 -0.095 0.000 0.801 255 A HN -0.422 7.557 8.150 -0.151 0.081 0.473 256 G N -2.440 106.301 108.800 -0.098 0.000 2.143 256 G HA2 -0.293 3.603 3.960 -0.106 0.000 0.249 256 G HA3 -0.293 3.614 3.960 -0.088 0.000 0.249 256 G C -0.047 174.792 174.900 -0.101 0.000 0.981 256 G CA 0.026 45.067 45.100 -0.098 0.000 0.665 256 G HN -0.645 7.401 8.290 -0.107 0.180 0.528 257 A N -2.401 120.362 122.820 -0.094 0.000 2.218 257 A HA 0.124 4.396 4.320 -0.080 0.000 0.209 257 A C -0.410 177.114 177.584 -0.100 0.000 1.168 257 A CA 0.086 52.072 52.037 -0.085 0.000 0.804 257 A CB 0.886 19.846 19.000 -0.066 0.000 0.834 257 A HN -0.017 8.036 8.150 -0.093 0.041 0.482 258 c N -2.248 116.277 118.600 -0.124 0.000 2.626 258 c HA 0.218 4.689 4.570 -0.166 0.000 0.310 258 c C -0.319 173.630 174.090 -0.235 0.000 1.191 258 c CA -0.493 55.741 56.329 -0.159 0.000 1.517 258 c CB 2.970 45.414 42.510 -0.111 0.000 2.102 258 c HN -0.728 7.391 8.230 -0.121 0.039 0.479 259 D N 1.488 121.649 120.400 -0.399 0.000 2.392 259 D HA 0.180 4.585 4.640 -0.391 0.000 0.206 259 D C -0.956 175.100 176.300 -0.405 0.000 1.046 259 D CA 1.588 55.254 54.000 -0.556 0.000 0.865 259 D CB 2.760 42.845 40.800 -1.191 0.000 0.969 259 D HN 0.486 8.589 8.370 -0.445 0.000 0.509 260 L N -1.398 119.664 121.223 -0.268 0.000 2.505 260 L HA 0.736 5.219 4.340 -0.112 -0.210 0.259 260 L C -2.939 173.865 176.870 -0.109 0.000 0.952 260 L CA -0.305 54.459 54.840 -0.125 0.000 0.840 260 L CB 4.001 46.045 42.059 -0.026 0.000 1.358 260 L HN -0.918 7.152 8.230 -0.266 0.000 0.409 261 I N -2.345 118.173 120.570 -0.087 0.000 3.042 261 I HA 1.027 5.344 4.170 -0.095 -0.205 0.310 261 I C -2.200 173.845 176.117 -0.119 0.000 1.117 261 I CA -2.804 58.445 61.300 -0.084 0.000 1.003 261 I CB 4.289 42.268 38.000 -0.035 0.000 1.228 261 I HN -0.210 7.958 8.210 -0.071 0.000 0.443 262 D N -0.340 119.967 120.400 -0.154 0.000 2.272 262 D HA 0.323 4.758 4.640 -0.342 0.000 0.247 262 D C -0.086 176.122 176.300 -0.153 0.000 0.990 262 D CA -2.271 51.540 54.000 -0.316 0.000 0.931 262 D CB 2.218 42.691 40.800 -0.544 0.000 1.195 262 D HN -0.350 7.948 8.370 -0.119 0.000 0.477 263 F N -5.979 113.967 119.950 -0.008 0.000 2.738 263 F HA -0.289 4.232 4.527 -0.010 0.000 0.232 263 F C -1.745 174.018 175.800 -0.063 0.000 1.025 263 F CA -0.845 57.137 58.000 -0.030 0.000 0.895 263 F CB -1.542 37.425 39.000 -0.054 0.000 0.839 263 F HN 0.459 8.465 8.300 -0.490 0.000 0.850 264 P HA -0.041 4.352 4.420 -0.045 0.000 0.272 264 P C -0.752 176.500 177.300 -0.079 0.000 1.223 264 P CA -0.373 62.690 63.100 -0.062 0.000 0.784 264 P CB 0.679 32.268 31.700 -0.185 0.000 0.923 265 N N 0.638 119.276 118.700 -0.104 0.000 2.416 265 N HA -0.185 4.501 4.740 -0.090 0.000 0.246 265 N C 1.496 176.913 175.510 -0.155 0.000 1.260 265 N CA 0.096 53.080 53.050 -0.110 0.000 0.897 265 N CB 0.322 38.754 38.487 -0.092 0.000 1.110 265 N HN 0.231 8.553 8.380 -0.098 0.000 0.439 266 A N 3.133 125.876 122.820 -0.128 0.000 1.865 266 A HA -0.276 3.958 4.320 -0.144 0.000 0.217 266 A C 1.551 179.044 177.584 -0.151 0.000 1.191 266 A CA 3.494 55.452 52.037 -0.131 0.000 0.623 266 A CB -0.279 18.664 19.000 -0.095 0.000 0.826 266 A HN 0.496 8.580 8.150 -0.110 0.000 0.444 267 A N -3.195 119.548 122.820 -0.129 0.000 1.972 267 A HA -0.184 4.073 4.320 -0.104 0.000 0.219 267 A C 2.032 179.509 177.584 -0.179 0.000 1.169 267 A CA 2.915 54.881 52.037 -0.119 0.000 0.635 267 A CB -1.059 17.895 19.000 -0.076 0.000 0.810 267 A HN 0.287 8.370 8.150 -0.112 0.000 0.446 268 D N -0.895 119.342 120.400 -0.272 0.000 2.149 268 D HA -0.178 4.162 4.640 -0.501 0.000 0.201 268 D C 2.029 177.987 176.300 -0.570 0.000 0.972 268 D CA 2.879 56.546 54.000 -0.555 0.000 0.835 268 D CB -0.348 39.966 40.800 -0.810 0.000 0.966 268 D HN -0.710 7.514 8.370 -0.243 0.000 0.476 269 L N 0.202 121.172 121.223 -0.422 0.000 2.042 269 L HA -0.356 3.703 4.340 -0.468 0.000 0.210 269 L C 1.446 178.123 176.870 -0.321 0.000 1.076 269 L CA 3.229 57.816 54.840 -0.421 0.000 0.749 269 L CB -0.139 41.654 42.059 -0.444 0.000 0.893 269 L HN -0.204 7.810 8.230 -0.359 0.000 0.432 270 E N -2.562 117.499 120.200 -0.231 0.000 2.085 270 E HA -0.409 3.861 4.350 -0.133 0.000 0.194 270 E C 2.717 179.244 176.600 -0.121 0.000 0.994 270 E CA 2.789 59.102 56.400 -0.146 0.000 0.801 270 E CB -0.713 28.926 29.700 -0.101 0.000 0.743 270 E HN -0.450 7.777 8.360 -0.222 0.000 0.453 271 K N -1.911 118.407 120.400 -0.136 0.000 2.057 271 K HA -0.213 4.086 4.320 -0.034 0.000 0.206 271 K C 2.787 179.356 176.600 -0.053 0.000 1.050 271 K CA 2.614 58.863 56.287 -0.064 0.000 0.935 271 K CB 0.017 32.513 32.500 -0.007 0.000 0.715 271 K HN -0.893 7.173 8.250 -0.176 0.079 0.439 272 M N -2.308 117.211 119.600 -0.134 0.000 2.476 272 M HA -0.256 4.230 4.480 0.010 0.000 0.262 272 M C 0.883 177.143 176.300 -0.066 0.000 1.079 272 M CA 2.815 58.067 55.300 -0.080 0.000 1.104 272 M CB 0.014 32.519 32.600 -0.160 0.000 1.409 272 M HN -0.393 7.669 8.290 -0.236 0.086 0.467 273 K N -4.603 115.746 120.400 -0.086 0.000 2.152 273 K HA -0.221 4.075 4.320 -0.040 0.000 0.206 273 K C 1.344 177.931 176.600 -0.021 0.000 1.048 273 K CA 2.048 58.306 56.287 -0.048 0.000 0.933 273 K CB 0.237 32.711 32.500 -0.043 0.000 0.721 273 K HN -0.513 7.638 8.250 -0.113 0.031 0.447 274 T N -7.214 107.329 114.554 -0.018 0.000 3.170 274 T HA 0.158 4.504 4.350 -0.006 0.000 0.288 274 T C -0.703 173.997 174.700 0.000 0.000 0.992 274 T CA -1.601 60.494 62.100 -0.007 0.000 0.909 274 T CB 0.880 69.745 68.868 -0.005 0.000 1.133 274 T HN -0.715 7.493 8.240 -0.022 0.019 0.530 275 D N 4.764 125.169 120.400 0.008 0.000 2.343 275 D HA 0.198 4.851 4.640 0.023 0.000 0.255 275 D C 0.273 176.579 176.300 0.009 0.000 1.187 275 D CA -2.551 51.464 54.000 0.024 0.000 0.875 275 D CB 1.288 42.129 40.800 0.069 0.000 1.136 275 D HN -0.705 7.545 8.370 0.004 0.122 0.469 276 P HA 0.039 4.455 4.420 -0.007 0.000 0.226 276 P C 0.164 177.458 177.300 -0.010 0.000 1.153 276 P CA 1.027 64.123 63.100 -0.006 0.000 0.777 276 P CB 0.337 32.032 31.700 -0.008 0.000 0.794 277 K N -2.378 118.017 120.400 -0.010 0.000 2.444 277 K HA 0.059 4.364 4.320 -0.024 0.000 0.193 277 K C -0.919 175.674 176.600 -0.013 0.000 1.024 277 K CA 0.789 57.064 56.287 -0.020 0.000 1.077 277 K CB 0.662 33.141 32.500 -0.036 0.000 0.833 277 K HN -0.351 8.159 8.250 -0.005 -0.263 0.517 278 V N -1.835 118.078 119.914 -0.001 0.000 2.540 278 V HA 0.320 4.597 4.120 -0.002 -0.159 0.302 278 V C -1.296 174.785 176.094 -0.023 0.000 1.035 278 V CA -2.000 60.301 62.300 0.001 0.000 0.873 278 V CB 2.697 34.538 31.823 0.029 0.000 0.992 278 V HN -0.650 7.479 8.190 0.001 0.062 0.428 279 N N 6.987 125.665 118.700 -0.036 0.000 2.589 279 N HA 0.113 4.789 4.740 -0.107 0.000 0.232 279 N C -1.833 173.578 175.510 -0.165 0.000 1.015 279 N CA -1.946 51.042 53.050 -0.104 0.000 0.931 279 N CB 0.543 38.984 38.487 -0.076 0.000 1.150 279 N HN 0.230 8.598 8.380 -0.021 0.000 0.512 280 L N 6.570 127.709 121.223 -0.140 0.000 2.261 280 L HA 0.133 4.483 4.340 0.015 0.000 0.289 280 L C -1.112 175.711 176.870 -0.078 0.000 1.059 280 L CA -0.751 54.062 54.840 -0.045 0.000 0.816 280 L CB 0.623 42.691 42.059 0.015 0.000 1.191 280 L HN 0.332 8.493 8.230 -0.114 0.000 0.431 281 H N 7.236 126.405 119.070 0.166 0.000 2.548 281 H HA 0.297 4.926 4.556 0.121 0.000 0.331 281 H C -1.127 174.288 175.328 0.146 0.000 1.093 281 H CA -0.226 55.913 56.048 0.151 0.000 1.367 281 H CB 1.581 31.453 29.762 0.183 0.000 1.455 281 H HN 0.173 8.584 8.280 0.217 0.000 0.519 282 S N 1.030 116.825 115.700 0.158 0.000 2.564 282 S HA 1.011 5.626 4.470 -0.138 -0.228 0.274 282 S C -1.579 172.972 174.600 -0.083 0.000 1.124 282 S CA -1.380 56.788 58.200 -0.054 0.000 0.869 282 S CB 3.537 66.675 63.200 -0.104 0.000 1.105 282 S HN 0.205 8.603 8.310 0.146 0.000 0.472 283 Q N -0.274 119.420 119.800 -0.177 0.000 2.472 283 Q HA 0.289 4.572 4.340 -0.096 0.000 0.281 283 Q C -1.891 174.019 176.000 -0.150 0.000 0.997 283 Q CA -1.257 54.472 55.803 -0.123 0.000 0.828 283 Q CB 3.191 31.875 28.738 -0.090 0.000 1.443 283 Q HN 0.190 8.295 8.270 -0.274 0.000 0.390 284 S N 2.154 117.789 115.700 -0.109 0.000 2.537 284 S HA -0.206 4.208 4.470 -0.094 0.000 0.286 284 S C 0.705 175.263 174.600 -0.069 0.000 1.299 284 S CA 1.094 59.239 58.200 -0.091 0.000 1.067 284 S CB 0.260 63.407 63.200 -0.088 0.000 0.864 284 S HN 0.317 8.572 8.310 -0.093 0.000 0.494 285 G N 1.626 110.408 108.800 -0.030 0.000 2.432 285 G HA2 0.048 4.175 3.960 -0.003 0.000 0.257 285 G HA3 0.048 4.040 3.960 0.054 0.000 0.257 285 G C -1.132 173.802 174.900 0.057 0.000 1.238 285 G CA -0.550 44.562 45.100 0.020 0.000 0.838 285 G HN 0.104 8.383 8.290 -0.019 0.000 0.547 286 L N 4.683 125.966 121.223 0.100 0.000 2.480 286 L HA 0.200 4.618 4.340 0.129 0.000 0.243 286 L C -1.843 175.269 176.870 0.402 0.000 1.315 286 L CA -1.013 53.951 54.840 0.206 0.000 1.231 286 L CB -1.151 41.056 42.059 0.246 0.000 1.444 286 L HN 0.371 8.650 8.230 0.081 0.000 0.409 287 N N -0.152 118.783 118.700 0.391 0.000 2.934 287 N HA 0.626 5.878 4.740 0.633 -0.132 0.253 287 N C -2.528 173.345 175.510 0.605 0.000 1.466 287 N CA -1.200 52.149 53.050 0.499 0.000 0.858 287 N CB 3.192 41.856 38.487 0.295 0.000 1.459 287 N HN -0.635 7.891 8.380 0.302 0.035 0.532 288 I N -1.630 119.298 120.570 0.596 0.000 2.610 288 I HA 0.582 5.152 4.170 0.397 -0.162 0.289 288 I C -2.809 173.576 176.117 0.447 0.000 1.163 288 I CA -1.776 59.836 61.300 0.521 0.000 1.044 288 I CB 4.039 42.428 38.000 0.648 0.000 1.251 288 I HN 0.111 8.668 8.210 0.578 0.000 0.424 289 A N 8.314 131.300 122.820 0.278 0.000 2.305 289 A HA 0.711 5.273 4.320 0.188 -0.129 0.322 289 A C -1.926 175.762 177.584 0.172 0.000 1.187 289 A CA -2.265 49.888 52.037 0.195 0.000 0.825 289 A CB 2.419 21.513 19.000 0.157 0.000 1.164 289 A HN 0.606 8.865 8.150 0.183 0.000 0.498 290 Y N -2.350 117.873 120.300 -0.128 0.000 2.597 290 Y HA 0.844 5.426 4.550 -0.136 -0.114 0.340 290 Y C -2.509 173.213 175.900 -0.297 0.000 1.097 290 Y CA -2.639 55.302 58.100 -0.266 0.000 1.037 290 Y CB 3.095 41.134 38.460 -0.702 0.000 1.305 290 Y HN 0.393 8.468 8.280 -0.342 0.000 0.463 291 I N 0.453 120.915 120.570 -0.179 0.000 2.315 291 I HA 0.534 4.751 4.170 -0.305 -0.230 0.291 291 I C -0.522 175.383 176.117 -0.353 0.000 1.006 291 I CA -2.635 58.495 61.300 -0.283 0.000 1.265 291 I CB 0.029 37.873 38.000 -0.260 0.000 1.387 291 I HN -0.072 8.096 8.210 -0.070 0.000 0.475 292 A N 8.076 130.745 122.820 -0.251 0.000 2.301 292 A HA 0.280 4.475 4.320 -0.207 0.000 0.298 292 A C -1.673 175.780 177.584 -0.219 0.000 1.185 292 A CA -1.562 50.368 52.037 -0.177 0.000 0.830 292 A CB 2.021 21.034 19.000 0.021 0.000 1.112 292 A HN 0.380 8.452 8.150 -0.129 0.000 0.508 293 F N 0.797 120.828 119.950 0.135 0.000 2.404 293 F HA 0.178 4.532 4.527 -0.287 0.000 0.339 293 F C 0.147 175.936 175.800 -0.020 0.000 1.105 293 F CA -1.320 56.646 58.000 -0.056 0.000 1.087 293 F CB 1.718 40.765 39.000 0.079 0.000 1.143 293 F HN -0.124 8.258 8.300 0.137 0.000 0.491 294 N N 2.684 121.400 118.700 0.027 0.000 2.421 294 N HA 0.021 4.810 4.740 0.082 0.000 0.260 294 N C 1.117 176.747 175.510 0.200 0.000 1.173 294 N CA -0.614 52.479 53.050 0.071 0.000 0.960 294 N CB -0.349 38.123 38.487 -0.024 0.000 1.273 294 N HN 0.118 8.386 8.380 -0.186 0.000 0.497 295 T N 1.607 116.308 114.554 0.245 0.000 3.163 295 T HA -0.060 4.633 4.350 0.278 -0.176 0.260 295 T C 1.167 175.973 174.700 0.177 0.000 1.156 295 T CA 1.489 63.745 62.100 0.261 0.000 1.072 295 T CB 0.007 69.085 68.868 0.349 0.000 0.937 295 T HN 0.285 8.677 8.240 0.253 0.000 0.528 296 E N 0.448 120.730 120.200 0.137 0.000 2.476 296 E HA 0.097 4.494 4.350 0.079 0.000 0.196 296 E C -1.087 175.564 176.600 0.085 0.000 1.029 296 E CA -0.508 55.945 56.400 0.089 0.000 0.896 296 E CB 0.441 30.176 29.700 0.059 0.000 1.012 296 E HN -0.514 8.128 8.360 0.135 -0.201 0.475 297 K N 0.333 120.810 120.400 0.128 0.000 2.545 297 K HA 0.188 4.560 4.320 0.087 0.000 0.252 297 K C -2.293 174.385 176.600 0.130 0.000 0.948 297 K CA -1.450 54.915 56.287 0.130 0.000 0.827 297 K CB 2.280 34.875 32.500 0.158 0.000 1.128 297 K HN -0.544 7.747 8.250 0.168 0.060 0.429 298 A N 6.788 129.626 122.820 0.030 0.000 2.531 298 A HA -0.016 4.460 4.320 -0.103 -0.218 0.236 298 A C -0.577 176.871 177.584 -0.226 0.000 1.062 298 A CA -0.683 51.306 52.037 -0.081 0.000 0.760 298 A CB -0.652 18.317 19.000 -0.051 0.000 0.995 298 A HN 0.576 8.743 8.150 0.029 0.000 0.501 299 P HA 0.175 4.400 4.420 -0.325 0.000 0.262 299 P C -0.717 176.233 177.300 -0.583 0.000 1.304 299 P CA 0.254 62.963 63.100 -0.651 0.000 0.859 299 P CB 0.839 31.769 31.700 -1.282 0.000 1.310 300 F N 0.345 120.167 119.950 -0.215 0.000 2.748 300 F HA -0.191 4.170 4.527 -0.276 0.000 0.299 300 F C 0.309 176.065 175.800 -0.075 0.000 1.154 300 F CA 1.597 59.497 58.000 -0.167 0.000 1.446 300 F CB -1.142 37.837 39.000 -0.035 0.000 1.112 300 F HN -0.283 7.763 8.300 -0.315 0.065 0.584 301 D N -3.338 117.106 120.400 0.075 0.000 2.363 301 D HA -0.159 4.696 4.640 0.119 -0.143 0.220 301 D C 0.543 176.865 176.300 0.037 0.000 0.994 301 D CA -0.126 53.919 54.000 0.075 0.000 0.890 301 D CB -0.496 40.339 40.800 0.057 0.000 0.906 301 D HN -0.339 7.995 8.370 0.025 0.052 0.530 302 N N 1.188 119.883 118.700 -0.009 0.000 2.414 302 N HA 0.065 4.812 4.740 0.011 0.000 0.256 302 N C 0.383 175.883 175.510 -0.016 0.000 1.029 302 N CA -0.945 52.100 53.050 -0.007 0.000 0.948 302 N CB 0.973 39.456 38.487 -0.006 0.000 1.102 302 N HN -0.781 7.527 8.380 -0.049 0.043 0.496 303 V N 7.808 127.733 119.914 0.018 0.000 2.469 303 V HA -0.453 3.680 4.120 0.022 0.000 0.251 303 V C 1.056 177.146 176.094 -0.007 0.000 1.064 303 V CA 2.886 65.200 62.300 0.023 0.000 1.066 303 V CB 0.138 31.997 31.823 0.061 0.000 0.667 303 V HN 0.750 8.959 8.190 0.032 0.000 0.461 304 K N -1.645 118.758 120.400 0.005 0.000 2.097 304 K HA -0.257 4.086 4.320 0.038 0.000 0.206 304 K C 2.420 179.005 176.600 -0.026 0.000 1.049 304 K CA 3.275 59.572 56.287 0.016 0.000 0.933 304 K CB -0.175 32.346 32.500 0.037 0.000 0.717 304 K HN -0.374 8.154 8.250 0.013 -0.270 0.442 305 V N -0.110 119.759 119.914 -0.075 0.000 2.358 305 V HA -0.536 3.518 4.120 -0.109 0.000 0.246 305 V C 1.541 177.457 176.094 -0.297 0.000 1.047 305 V CA 4.292 66.493 62.300 -0.165 0.000 1.035 305 V CB -0.212 31.450 31.823 -0.268 0.000 0.658 305 V HN -0.538 7.613 8.190 -0.064 0.000 0.452 306 R N -1.413 118.878 120.500 -0.347 0.000 2.096 306 R HA -0.377 3.307 4.340 -1.093 0.000 0.235 306 R C 2.660 178.765 176.300 -0.325 0.000 1.127 306 R CA 3.808 59.566 56.100 -0.570 0.000 0.968 306 R CB -0.400 29.688 30.300 -0.354 0.000 0.861 306 R HN -0.698 7.421 8.270 -0.250 0.000 0.440 307 Q N -0.984 118.673 119.800 -0.238 0.000 2.079 307 Q HA -0.362 3.545 4.340 -0.721 0.000 0.200 307 Q C 2.194 178.063 176.000 -0.218 0.000 0.974 307 Q CA 3.242 58.823 55.803 -0.370 0.000 0.840 307 Q CB -0.200 28.474 28.738 -0.105 0.000 0.898 307 Q HN -0.160 8.011 8.270 -0.164 0.000 0.430 308 A N 0.343 123.146 122.820 -0.028 0.000 1.883 308 A HA -0.347 4.128 4.320 0.258 0.000 0.217 308 A C 1.870 179.471 177.584 0.029 0.000 1.186 308 A CA 3.293 55.377 52.037 0.079 0.000 0.624 308 A CB -0.523 18.481 19.000 0.006 0.000 0.822 308 A HN -0.262 7.857 8.150 -0.053 0.000 0.444 309 L N -4.912 116.250 121.223 -0.102 0.000 2.376 309 L HA -0.368 3.885 4.340 -0.144 0.000 0.219 309 L C 2.094 179.155 176.870 0.319 0.000 1.133 309 L CA 2.175 56.988 54.840 -0.045 0.000 0.816 309 L CB -0.744 41.142 42.059 -0.290 0.000 0.933 309 L HN -0.305 7.812 8.230 -0.188 0.000 0.449 310 N N -0.184 118.591 118.700 0.124 0.000 2.109 310 N HA -0.277 4.597 4.740 0.224 0.000 0.188 310 N C 2.418 177.997 175.510 0.115 0.000 1.034 310 N CA 3.597 56.674 53.050 0.046 0.000 0.846 310 N CB 0.015 38.231 38.487 -0.451 0.000 1.010 310 N HN -0.848 7.403 8.380 -0.036 0.107 0.425 311 Y N -0.012 120.347 120.300 0.099 0.000 2.256 311 Y HA -0.132 4.747 4.550 0.245 -0.182 0.288 311 Y C 2.197 178.244 175.900 0.244 0.000 1.155 311 Y CA 3.078 61.288 58.100 0.183 0.000 1.203 311 Y CB -0.584 37.945 38.460 0.114 0.000 0.980 311 Y HN -0.181 8.067 8.280 -0.053 0.000 0.530 312 A N -3.220 119.839 122.820 0.399 0.000 2.067 312 A HA -0.173 4.359 4.320 0.353 0.000 0.219 312 A C -0.387 177.518 177.584 0.536 0.000 1.158 312 A CA 1.315 53.603 52.037 0.417 0.000 0.661 312 A CB 0.070 19.304 19.000 0.389 0.000 0.801 312 A HN -0.504 7.824 8.150 0.345 0.028 0.452 313 V N -2.292 117.906 119.914 0.473 0.000 2.439 313 V HA -0.076 4.389 4.120 0.249 -0.196 0.282 313 V C -1.128 175.045 176.094 0.131 0.000 1.039 313 V CA -0.602 61.875 62.300 0.294 0.000 0.913 313 V CB 1.194 33.160 31.823 0.240 0.000 0.983 313 V HN -0.713 7.700 8.190 0.443 0.043 0.460 314 D N 7.469 127.704 120.400 -0.275 0.000 2.441 314 D HA 0.139 4.385 4.640 -0.657 0.000 0.221 314 D C 0.040 176.198 176.300 -0.236 0.000 1.156 314 D CA -1.523 52.091 54.000 -0.643 0.000 0.896 314 D CB -0.077 40.011 40.800 -1.186 0.000 1.028 314 D HN -0.028 8.471 8.370 -0.244 -0.275 0.509 315 K N 4.404 124.750 120.400 -0.090 0.000 2.148 315 K HA -0.440 3.861 4.320 -0.031 0.000 0.204 315 K C 1.667 178.240 176.600 -0.045 0.000 1.050 315 K CA 3.219 59.484 56.287 -0.035 0.000 0.942 315 K CB 0.021 32.527 32.500 0.011 0.000 0.724 315 K HN -0.003 8.222 8.250 -0.042 0.000 0.446 316 N N -1.253 117.416 118.700 -0.052 0.000 2.104 316 N HA -0.339 4.392 4.740 -0.016 0.000 0.190 316 N C 1.345 176.833 175.510 -0.036 0.000 1.024 316 N CA 3.155 56.186 53.050 -0.031 0.000 0.853 316 N CB -0.253 38.224 38.487 -0.017 0.000 1.008 316 N HN -0.420 8.004 8.380 -0.059 -0.080 0.424 317 A N -1.624 121.149 122.820 -0.079 0.000 1.972 317 A HA -0.205 4.089 4.320 -0.042 0.000 0.219 317 A C 1.978 179.545 177.584 -0.027 0.000 1.169 317 A CA 2.888 54.887 52.037 -0.063 0.000 0.635 317 A CB -0.542 18.393 19.000 -0.109 0.000 0.810 317 A HN -0.599 7.705 8.150 -0.128 -0.231 0.446 318 I N -0.561 119.999 120.570 -0.018 0.000 2.286 318 I HA -0.412 3.773 4.170 0.025 0.000 0.245 318 I C 1.917 178.117 176.117 0.139 0.000 1.104 318 I CA 3.530 64.855 61.300 0.042 0.000 1.397 318 I CB -0.054 37.970 38.000 0.042 0.000 1.072 318 I HN -0.942 7.136 8.210 -0.039 0.109 0.417 319 I N 0.292 120.915 120.570 0.088 0.000 2.208 319 I HA -0.559 3.725 4.170 0.189 0.000 0.245 319 I C 2.202 178.399 176.117 0.134 0.000 1.097 319 I CA 2.916 64.281 61.300 0.109 0.000 1.363 319 I CB -1.729 36.266 38.000 -0.008 0.000 1.051 319 I HN -0.196 8.032 8.210 0.031 0.000 0.413 320 D N -0.453 119.987 120.400 0.067 0.000 2.084 320 D HA -0.309 4.363 4.640 0.053 0.000 0.196 320 D C 2.014 178.340 176.300 0.043 0.000 0.985 320 D CA 3.408 57.437 54.000 0.048 0.000 0.826 320 D CB -0.371 40.442 40.800 0.020 0.000 0.978 320 D HN -0.424 7.972 8.370 0.043 0.000 0.456 321 A N -1.687 121.150 122.820 0.027 0.000 1.898 321 A HA -0.067 4.247 4.320 -0.011 0.000 0.214 321 A C 2.012 179.582 177.584 -0.023 0.000 1.183 321 A CA 2.806 54.840 52.037 -0.005 0.000 0.622 321 A CB 0.164 19.150 19.000 -0.023 0.000 0.824 321 A HN -0.385 7.782 8.150 0.028 0.000 0.444 322 V N -2.825 117.085 119.914 -0.008 0.000 2.374 322 V HA -0.369 3.656 4.120 -0.157 0.000 0.241 322 V C 1.840 177.819 176.094 -0.191 0.000 1.034 322 V CA 3.375 65.598 62.300 -0.129 0.000 1.037 322 V CB 0.546 32.257 31.823 -0.188 0.000 0.682 322 V HN -0.290 7.928 8.190 0.046 0.000 0.463 323 Y N -5.058 115.235 120.300 -0.013 0.000 2.517 323 Y HA -0.126 4.438 4.550 0.023 0.000 0.281 323 Y C 0.272 176.187 175.900 0.025 0.000 1.125 323 Y CA 1.311 59.420 58.100 0.016 0.000 1.283 323 Y CB 0.737 39.214 38.460 0.028 0.000 1.042 323 Y HN -0.969 7.504 8.280 0.322 0.000 0.547 324 R N -3.482 117.094 120.500 0.127 0.000 3.627 324 R HA -0.427 4.121 4.340 0.056 -0.174 0.281 324 R C -0.022 176.337 176.300 0.099 0.000 1.140 324 R CA 0.720 56.866 56.100 0.076 0.000 0.761 324 R CB -3.300 27.018 30.300 0.030 0.000 1.181 324 R HN -0.465 7.835 8.270 0.112 0.037 0.472 325 G N -6.335 102.542 108.800 0.129 0.000 2.217 325 G HA2 -0.350 3.660 3.960 0.083 0.000 0.246 325 G HA3 -0.350 3.660 3.960 0.084 0.000 0.246 325 G C -0.266 174.712 174.900 0.130 0.000 0.990 325 G CA 0.030 45.192 45.100 0.103 0.000 0.627 325 G HN -0.213 8.148 8.290 0.158 0.023 0.522 326 A N 3.451 126.391 122.820 0.200 0.000 3.091 326 A HA 0.214 4.659 4.320 0.207 0.000 0.264 326 A C -1.543 176.184 177.584 0.238 0.000 1.673 326 A CA -0.674 51.513 52.037 0.251 0.000 1.362 326 A CB -1.103 18.134 19.000 0.394 0.000 1.137 326 A HN -0.387 7.726 8.150 0.217 0.168 0.617 327 G N -0.957 107.898 108.800 0.092 0.000 2.320 327 G HA2 0.167 4.190 3.960 -0.014 0.000 0.297 327 G HA3 0.167 4.017 3.960 -0.183 0.000 0.297 327 G C -2.994 171.841 174.900 -0.109 0.000 1.344 327 G CA 0.418 45.485 45.100 -0.054 0.000 0.851 327 G HN -0.691 7.590 8.290 0.070 0.051 0.567 328 V N -2.064 117.764 119.914 -0.144 0.000 2.841 328 V HA 0.393 4.471 4.120 -0.070 0.000 0.310 328 V C -1.822 174.202 176.094 -0.117 0.000 1.090 328 V CA -3.020 59.236 62.300 -0.073 0.000 0.930 328 V CB 3.837 35.674 31.823 0.023 0.000 1.014 328 V HN 0.354 8.446 8.190 -0.163 0.000 0.425 329 A N 5.451 128.222 122.820 -0.081 0.000 2.540 329 A HA 0.187 4.601 4.320 -0.130 -0.172 0.239 329 A C -0.746 176.824 177.584 -0.024 0.000 1.061 329 A CA 0.719 52.713 52.037 -0.072 0.000 0.758 329 A CB 0.074 19.066 19.000 -0.014 0.000 0.991 329 A HN 0.243 8.361 8.150 -0.054 0.000 0.502 330 A N 3.148 125.909 122.820 -0.098 0.000 2.310 330 A HA 0.187 4.516 4.320 0.014 0.000 0.299 330 A C -0.752 176.885 177.584 0.089 0.000 1.147 330 A CA -1.031 50.947 52.037 -0.098 0.000 0.818 330 A CB 1.899 20.640 19.000 -0.432 0.000 1.096 330 A HN -0.088 7.886 8.150 -0.118 0.105 0.495 331 K N 0.390 120.909 120.400 0.199 0.000 2.435 331 K HA 0.173 4.552 4.320 0.099 0.000 0.199 331 K C -1.049 175.599 176.600 0.079 0.000 1.153 331 K CA 0.468 56.830 56.287 0.126 0.000 0.974 331 K CB 1.445 34.011 32.500 0.110 0.000 0.997 331 K HN 0.543 8.991 8.250 0.330 0.000 0.547 332 N N -2.436 116.359 118.700 0.157 0.000 2.455 332 N HA 0.345 5.076 4.740 -0.015 0.000 0.278 332 N C -2.309 173.326 175.510 0.208 0.000 1.291 332 N CA -1.857 51.230 53.050 0.062 0.000 0.780 332 N CB 2.187 40.599 38.487 -0.124 0.000 1.520 332 N HN -0.572 7.995 8.380 0.311 0.000 0.486 333 P HA -0.020 4.649 4.420 0.416 0.000 0.229 333 P C -1.294 176.130 177.300 0.205 0.000 1.160 333 P CA 0.945 64.197 63.100 0.254 0.000 0.777 333 P CB 0.605 32.357 31.700 0.087 0.000 0.814 334 L N -0.567 120.664 121.223 0.014 0.000 2.350 334 L HA 0.192 4.103 4.340 -0.715 0.000 0.275 334 L C -1.990 174.822 176.870 -0.097 0.000 1.099 334 L CA -2.451 52.231 54.840 -0.264 0.000 0.808 334 L CB 0.184 42.117 42.059 -0.209 0.000 1.149 334 L HN -0.538 7.669 8.230 0.006 0.027 0.442 335 P HA 0.385 4.017 4.420 -1.313 0.000 0.277 335 P C -1.434 175.415 177.300 -0.753 0.000 1.240 335 P CA -2.193 60.478 63.100 -0.714 0.000 0.798 335 P CB -0.348 31.080 31.700 -0.453 0.000 0.979 336 P HA -0.119 2.616 4.420 -2.810 0.000 0.221 336 P C -0.182 176.682 177.300 -0.728 0.000 1.145 336 P CA 1.697 63.945 63.100 -1.419 0.000 0.795 336 P CB 0.068 31.275 31.700 -0.821 0.000 0.775 337 T N -8.345 105.943 114.554 -0.443 0.000 3.122 337 T HA 0.037 4.272 4.350 -0.192 0.000 0.250 337 T C 0.078 174.705 174.700 -0.122 0.000 1.067 337 T CA -1.018 60.949 62.100 -0.222 0.000 0.966 337 T CB 0.282 69.056 68.868 -0.156 0.000 1.002 337 T HN -0.279 7.637 8.240 -0.450 0.054 0.542 338 I N 2.033 122.506 120.570 -0.162 0.000 2.525 338 I HA 0.218 4.394 4.170 0.009 0.000 0.301 338 I C -0.931 175.187 176.117 0.001 0.000 0.992 338 I CA -1.984 59.265 61.300 -0.084 0.000 1.162 338 I CB 2.787 40.655 38.000 -0.220 0.000 1.332 338 I HN -0.680 7.325 8.210 -0.256 0.051 0.458 339 W N 4.928 126.256 121.300 0.047 0.000 2.137 339 W HA -0.017 4.692 4.660 0.081 0.000 0.344 339 W C -0.398 176.185 176.519 0.108 0.000 1.286 339 W CA 0.104 57.499 57.345 0.083 0.000 1.240 339 W CB -0.052 29.466 29.460 0.097 0.000 1.141 339 W HN 0.231 8.550 8.180 0.231 0.000 0.579 340 G N 0.368 109.385 108.800 0.362 0.000 2.199 340 G HA2 -0.525 3.640 3.960 0.342 0.000 0.254 340 G HA3 -0.525 3.457 3.960 0.037 0.000 0.254 340 G C -1.970 172.988 174.900 0.096 0.000 0.982 340 G CA -0.060 45.164 45.100 0.207 0.000 0.632 340 G HN 0.393 8.966 8.290 0.471 0.000 0.529 341 Y N 1.855 122.127 120.300 -0.047 0.000 2.717 341 Y HA -0.373 4.239 4.550 -0.115 -0.131 0.330 341 Y C -1.179 174.712 175.900 -0.016 0.000 1.217 341 Y CA 1.089 59.145 58.100 -0.074 0.000 1.506 341 Y CB 0.417 38.820 38.460 -0.094 0.000 1.268 341 Y HN -0.892 7.441 8.280 0.207 0.071 0.561 342 N N 7.082 125.464 118.700 -0.530 0.000 2.500 342 N HA 0.022 4.671 4.740 -0.151 0.000 0.236 342 N C 0.306 175.569 175.510 -0.412 0.000 1.022 342 N CA -1.310 51.537 53.050 -0.338 0.000 0.935 342 N CB 0.026 38.359 38.487 -0.256 0.000 1.147 342 N HN -0.242 7.955 8.380 -0.763 -0.274 0.512 343 N N 5.380 124.009 118.700 -0.120 0.000 2.512 343 N HA -0.147 4.627 4.740 0.057 0.000 0.183 343 N C 0.331 175.831 175.510 -0.017 0.000 1.073 343 N CA 2.034 55.094 53.050 0.016 0.000 0.911 343 N CB 0.053 38.618 38.487 0.130 0.000 0.964 343 N HN 0.465 8.832 8.380 -0.022 0.000 0.447 344 E N -2.736 117.431 120.200 -0.055 0.000 2.442 344 E HA -0.003 4.336 4.350 -0.019 0.000 0.195 344 E C 0.090 176.650 176.600 -0.066 0.000 1.030 344 E CA -0.819 55.556 56.400 -0.041 0.000 0.869 344 E CB 0.388 30.067 29.700 -0.034 0.000 0.857 344 E HN -0.527 8.014 8.360 -0.074 -0.226 0.505 345 I N 1.400 121.902 120.570 -0.112 0.000 2.588 345 I HA -0.074 4.026 4.170 -0.117 0.000 0.283 345 I C -0.611 175.454 176.117 -0.086 0.000 1.119 345 I CA -0.000 61.225 61.300 -0.125 0.000 1.419 345 I CB -0.258 37.633 38.000 -0.182 0.000 1.394 345 I HN -0.868 7.216 8.210 -0.149 0.037 0.562 346 T N 3.136 117.637 114.554 -0.088 0.000 2.888 346 T HA 0.262 4.599 4.350 -0.022 0.000 0.284 346 T C 0.091 174.736 174.700 -0.092 0.000 1.017 346 T CA -2.277 59.788 62.100 -0.058 0.000 1.022 346 T CB 2.134 70.976 68.868 -0.044 0.000 1.013 346 T HN -0.168 8.007 8.240 -0.110 0.000 0.465 347 G N 1.142 109.927 108.800 -0.025 0.000 2.667 347 G HA2 -0.056 3.899 3.960 -0.008 0.000 0.250 347 G HA3 -0.056 3.944 3.960 0.067 0.000 0.250 347 G C -1.037 173.829 174.900 -0.056 0.000 1.212 347 G CA -1.007 44.094 45.100 0.001 0.000 0.874 347 G HN -0.017 8.281 8.290 0.013 0.000 0.561 348 Y N -0.474 119.805 120.300 -0.035 0.000 2.526 348 Y HA -0.246 4.231 4.550 -0.121 0.000 0.330 348 Y C 0.306 176.242 175.900 0.059 0.000 1.156 348 Y CA 0.809 58.834 58.100 -0.124 0.000 1.419 348 Y CB 0.266 38.480 38.460 -0.410 0.000 1.250 348 Y HN 0.253 8.677 8.280 0.241 0.000 0.540 349 E N 3.613 124.001 120.200 0.313 0.000 2.404 349 E HA -0.183 4.325 4.350 0.262 0.000 0.261 349 E C -1.169 175.693 176.600 0.438 0.000 1.074 349 E CA -0.884 55.714 56.400 0.330 0.000 0.917 349 E CB 0.958 30.826 29.700 0.280 0.000 0.965 349 E HN 0.119 8.687 8.360 0.348 0.000 0.433 350 Y N 4.058 124.493 120.300 0.224 0.000 2.531 350 Y HA 0.068 4.905 4.550 0.240 -0.143 0.347 350 Y C -0.612 175.405 175.900 0.195 0.000 1.024 350 Y CA -0.611 57.614 58.100 0.209 0.000 1.306 350 Y CB -0.179 38.368 38.460 0.145 0.000 1.149 350 Y HN 0.157 8.685 8.280 0.413 0.000 0.527 351 S N 8.140 123.815 115.700 -0.041 0.000 2.423 351 S HA 0.434 4.700 4.470 -0.341 0.000 0.213 351 S C -2.025 172.496 174.600 -0.131 0.000 1.131 351 S CA -3.157 54.936 58.200 -0.179 0.000 1.155 351 S CB 1.190 64.346 63.200 -0.074 0.000 1.202 351 S HN 0.529 8.946 8.310 0.179 0.000 0.441 352 P HA -0.230 4.206 4.420 0.027 0.000 0.218 352 P C 0.911 178.175 177.300 -0.060 0.000 1.148 352 P CA 1.957 65.019 63.100 -0.062 0.000 0.822 352 P CB 0.349 32.013 31.700 -0.059 0.000 0.784 353 E N -1.995 118.144 120.200 -0.101 0.000 2.038 353 E HA -0.357 3.954 4.350 -0.065 0.000 0.195 353 E C 1.990 178.523 176.600 -0.113 0.000 1.000 353 E CA 3.282 59.629 56.400 -0.090 0.000 0.803 353 E CB -0.442 29.201 29.700 -0.093 0.000 0.750 353 E HN 0.362 8.629 8.360 -0.131 0.014 0.448 354 K N -1.409 118.877 120.400 -0.190 0.000 2.097 354 K HA -0.285 3.883 4.320 -0.254 0.000 0.206 354 K C 2.273 178.751 176.600 -0.204 0.000 1.049 354 K CA 2.813 58.911 56.287 -0.315 0.000 0.933 354 K CB -0.099 31.954 32.500 -0.745 0.000 0.717 354 K HN -0.691 7.437 8.250 -0.204 0.000 0.442 355 A N -0.171 122.605 122.820 -0.072 0.000 1.883 355 A HA -0.396 3.990 4.320 0.110 0.000 0.217 355 A C 1.716 179.305 177.584 0.009 0.000 1.186 355 A CA 3.403 55.469 52.037 0.049 0.000 0.624 355 A CB -0.714 18.349 19.000 0.105 0.000 0.822 355 A HN -0.295 7.821 8.150 -0.057 0.000 0.444 356 K N -2.096 118.298 120.400 -0.010 0.000 2.057 356 K HA -0.369 3.953 4.320 0.004 0.000 0.207 356 K C 2.491 179.090 176.600 -0.002 0.000 1.049 356 K CA 3.224 59.508 56.287 -0.004 0.000 0.931 356 K CB -0.235 32.260 32.500 -0.009 0.000 0.714 356 K HN -0.317 7.921 8.250 -0.020 0.000 0.440 357 Q N -0.197 119.589 119.800 -0.025 0.000 2.061 357 Q HA -0.257 4.074 4.340 -0.014 0.000 0.204 357 Q C 2.298 178.298 176.000 -0.001 0.000 0.984 357 Q CA 2.683 58.473 55.803 -0.022 0.000 0.846 357 Q CB -0.629 28.080 28.738 -0.048 0.000 0.902 357 Q HN -0.586 7.658 8.270 -0.044 0.000 0.421 358 L N -1.354 119.872 121.223 0.006 0.000 2.046 358 L HA -0.356 4.005 4.340 0.035 0.000 0.208 358 L C 2.415 179.320 176.870 0.058 0.000 1.077 358 L CA 2.920 57.782 54.840 0.038 0.000 0.747 358 L CB -0.200 41.901 42.059 0.070 0.000 0.896 358 L HN -0.448 7.776 8.230 -0.010 0.000 0.432 359 L N -2.194 119.068 121.223 0.064 0.000 2.083 359 L HA -0.473 3.966 4.340 0.166 0.000 0.209 359 L C 1.936 178.890 176.870 0.141 0.000 1.083 359 L CA 3.324 58.240 54.840 0.127 0.000 0.752 359 L CB -0.681 41.435 42.059 0.096 0.000 0.899 359 L HN -0.158 8.100 8.230 0.046 0.000 0.433 360 K N -0.331 120.111 120.400 0.071 0.000 2.057 360 K HA -0.360 3.988 4.320 0.047 0.000 0.207 360 K C 2.778 179.386 176.600 0.013 0.000 1.049 360 K CA 3.503 59.813 56.287 0.039 0.000 0.931 360 K CB -0.324 32.187 32.500 0.017 0.000 0.714 360 K HN -0.143 8.131 8.250 0.051 0.006 0.440 361 E N -1.098 119.112 120.200 0.016 0.000 2.204 361 E HA -0.247 4.096 4.350 -0.011 0.000 0.195 361 E C 1.550 178.145 176.600 -0.007 0.000 0.990 361 E CA 2.221 58.622 56.400 0.001 0.000 0.821 361 E CB -0.261 29.445 29.700 0.010 0.000 0.750 361 E HN -0.430 7.944 8.360 0.024 0.000 0.477 362 A N -4.165 118.673 122.820 0.029 0.000 2.238 362 A HA 0.010 4.332 4.320 0.004 0.000 0.208 362 A C 0.178 177.667 177.584 -0.159 0.000 1.177 362 A CA 0.308 52.364 52.037 0.033 0.000 0.804 362 A CB 0.117 19.235 19.000 0.197 0.000 0.823 362 A HN -0.475 7.587 8.150 0.065 0.127 0.482 363 G N -2.251 106.431 108.800 -0.197 0.000 2.130 363 G HA2 -0.280 3.531 3.960 -0.248 0.000 0.216 363 G HA3 -0.280 3.373 3.960 -0.512 0.000 0.216 363 G C -0.373 174.187 174.900 -0.567 0.000 0.999 363 G CA -0.171 44.693 45.100 -0.394 0.000 0.686 363 G HN -0.469 7.585 8.290 -0.093 0.180 0.515 364 F N -1.298 118.657 119.950 0.008 0.000 2.679 364 F HA 0.268 4.825 4.527 0.050 0.000 0.354 364 F C 0.090 175.910 175.800 0.032 0.000 1.423 364 F CA -2.277 55.752 58.000 0.048 0.000 1.141 364 F CB 0.050 39.128 39.000 0.130 0.000 1.168 364 F HN -0.069 8.270 8.300 0.065 0.000 0.530 365 E N 2.927 123.197 120.200 0.116 0.000 2.153 365 E HA -0.299 4.095 4.350 0.073 0.000 0.194 365 E C -0.101 176.547 176.600 0.079 0.000 0.988 365 E CA 2.626 59.071 56.400 0.075 0.000 0.811 365 E CB -0.077 29.641 29.700 0.030 0.000 0.746 365 E HN 0.322 8.715 8.360 0.055 0.000 0.466 366 N N -3.155 115.605 118.700 0.100 0.000 2.370 366 N HA 0.026 4.801 4.740 0.059 0.000 0.198 366 N C 0.119 175.694 175.510 0.108 0.000 1.156 366 N CA -0.193 52.910 53.050 0.088 0.000 0.839 366 N CB -0.386 38.148 38.487 0.079 0.000 0.989 366 N HN -0.004 8.429 8.380 0.110 0.014 0.468 367 G N -0.037 108.847 108.800 0.140 0.000 2.645 367 G HA2 -0.363 3.592 3.960 -0.009 0.000 0.246 367 G HA3 -0.363 3.780 3.960 -0.073 -0.227 0.246 367 G C -2.329 172.671 174.900 0.166 0.000 1.322 367 G CA 0.349 45.470 45.100 0.036 0.000 0.898 367 G HN -0.268 7.934 8.290 0.176 0.194 0.573 368 F N -5.479 114.434 119.950 -0.062 0.000 2.817 368 F HA 0.314 4.842 4.527 0.002 0.000 0.317 368 F C -3.078 172.697 175.800 -0.042 0.000 1.168 368 F CA -1.453 56.501 58.000 -0.077 0.000 0.911 368 F CB 1.302 40.132 39.000 -0.284 0.000 1.337 368 F HN -0.556 7.431 8.300 -0.522 0.000 0.464 369 E N 0.138 120.505 120.200 0.278 0.000 2.191 369 E HA 0.787 5.418 4.350 0.120 -0.208 0.274 369 E C -0.613 176.196 176.600 0.348 0.000 0.948 369 E CA -0.973 55.553 56.400 0.209 0.000 0.802 369 E CB 2.386 32.178 29.700 0.154 0.000 1.137 369 E HN 0.131 8.685 8.360 0.323 0.000 0.397 370 T N 3.031 117.782 114.554 0.327 0.000 2.645 370 T HA 0.320 4.900 4.350 0.383 0.000 0.300 370 T C -2.405 172.513 174.700 0.363 0.000 1.210 370 T CA -2.040 60.314 62.100 0.424 0.000 1.034 370 T CB 1.229 70.503 68.868 0.677 0.000 1.537 370 T HN 0.502 8.899 8.240 0.262 0.000 0.492 371 D N 0.828 121.480 120.400 0.420 0.000 2.342 371 D HA 0.717 5.681 4.640 0.262 -0.167 0.243 371 D C -1.096 175.461 176.300 0.428 0.000 1.019 371 D CA -0.893 53.320 54.000 0.355 0.000 0.864 371 D CB 3.303 44.312 40.800 0.349 0.000 1.315 371 D HN -0.126 8.535 8.370 0.485 0.000 0.468 372 I N 0.735 121.481 120.570 0.292 0.000 2.382 372 I HA 0.149 4.674 4.170 0.325 -0.161 0.286 372 I C -0.846 175.417 176.117 0.244 0.000 1.002 372 I CA -1.104 60.343 61.300 0.247 0.000 1.135 372 I CB 2.128 40.143 38.000 0.025 0.000 1.288 372 I HN 0.256 8.583 8.210 0.195 0.000 0.448 373 W N 7.829 129.137 121.300 0.014 0.000 2.238 373 W HA 0.308 5.233 4.660 0.093 -0.210 0.321 373 W C -0.500 176.009 176.519 -0.017 0.000 1.293 373 W CA -0.684 56.698 57.345 0.062 0.000 1.204 373 W CB 0.602 30.122 29.460 0.100 0.000 1.167 373 W HN 0.729 9.280 8.180 0.617 0.000 0.553 374 V N 2.728 122.715 119.914 0.121 0.000 2.409 374 V HA 0.275 4.307 4.120 -0.147 0.000 0.291 374 V C -1.884 173.976 176.094 -0.390 0.000 1.020 374 V CA -1.880 60.342 62.300 -0.130 0.000 0.848 374 V CB 2.357 34.074 31.823 -0.176 0.000 0.990 374 V HN 0.445 8.698 8.190 0.105 0.000 0.430 375 Q N 7.782 127.285 119.800 -0.496 0.000 2.313 375 Q HA 0.005 3.427 4.340 -1.529 0.000 0.266 375 Q C -1.506 174.197 176.000 -0.495 0.000 0.989 375 Q CA -1.356 53.996 55.803 -0.752 0.000 0.890 375 Q CB 1.180 29.702 28.738 -0.360 0.000 1.200 375 Q HN -0.221 7.829 8.270 -0.367 0.000 0.396 376 P HA 0.080 4.341 4.420 -0.266 0.000 0.235 376 P C -1.287 175.868 177.300 -0.243 0.000 1.177 376 P CA 0.725 63.665 63.100 -0.267 0.000 0.785 376 P CB 0.346 31.957 31.700 -0.149 0.000 0.885 377 V N -7.107 112.619 119.914 -0.312 0.000 2.914 377 V HA 0.327 4.251 4.120 -0.326 0.000 0.314 377 V C -1.814 174.003 176.094 -0.462 0.000 1.084 377 V CA -2.267 59.797 62.300 -0.394 0.000 0.963 377 V CB 3.695 35.201 31.823 -0.528 0.000 1.025 377 V HN -0.704 7.291 8.190 -0.325 0.000 0.432 378 V N 3.421 123.033 119.914 -0.503 0.000 2.488 378 V HA -0.006 3.792 4.120 -0.537 0.000 0.277 378 V C -0.752 174.864 176.094 -0.797 0.000 1.046 378 V CA 0.225 62.133 62.300 -0.653 0.000 0.986 378 V CB 0.519 31.860 31.823 -0.804 0.000 0.989 378 V HN 0.274 8.182 8.190 -0.469 0.000 0.475 379 R N 6.298 126.453 120.500 -0.574 0.000 3.076 379 R HA 0.316 4.533 4.340 -0.205 0.000 0.239 379 R C 0.934 177.195 176.300 -0.065 0.000 1.392 379 R CA -1.607 54.323 56.100 -0.283 0.000 1.044 379 R CB 2.314 32.501 30.300 -0.189 0.000 1.389 379 R HN 0.157 8.149 8.270 -0.463 0.000 0.498 380 A N -0.067 122.843 122.820 0.149 0.000 1.940 380 A HA -0.207 4.372 4.320 0.431 0.000 0.219 380 A C 1.372 179.066 177.584 0.183 0.000 1.176 380 A CA 3.081 55.261 52.037 0.238 0.000 0.631 380 A CB -0.482 18.591 19.000 0.123 0.000 0.814 380 A HN 0.453 8.668 8.150 0.110 0.000 0.446 381 S N -5.175 110.607 115.700 0.136 0.000 2.593 381 S HA -0.110 4.498 4.470 0.229 0.000 0.217 381 S C -0.711 174.023 174.600 0.224 0.000 0.966 381 S CA -0.388 57.930 58.200 0.198 0.000 0.914 381 S CB 0.378 63.708 63.200 0.217 0.000 0.776 381 S HN -0.051 8.295 8.310 0.100 0.025 0.523 382 N N 0.546 119.277 118.700 0.052 0.000 2.655 382 N HA 0.246 4.887 4.740 -0.164 0.000 0.277 382 N C -2.581 172.758 175.510 -0.286 0.000 1.177 382 N CA -1.729 51.252 53.050 -0.114 0.000 0.882 382 N CB 1.987 40.426 38.487 -0.079 0.000 1.481 382 N HN -0.932 7.395 8.380 -0.006 0.049 0.547 383 P HA 0.030 4.258 4.420 -0.321 0.000 0.241 383 P C -1.534 175.567 177.300 -0.332 0.000 1.191 383 P CA 0.333 63.235 63.100 -0.329 0.000 0.771 383 P CB 0.339 31.885 31.700 -0.257 0.000 0.929 384 N N -0.870 117.622 118.700 -0.346 0.000 2.946 384 N HA 0.228 4.808 4.740 -0.267 0.000 0.213 384 N C -2.481 172.876 175.510 -0.255 0.000 1.440 384 N CA -1.573 51.310 53.050 -0.279 0.000 0.745 384 N CB 0.480 38.821 38.487 -0.243 0.000 1.471 384 N HN -0.438 7.955 8.380 -0.387 -0.245 0.569 385 P HA -0.246 4.040 4.420 -0.222 0.000 0.216 385 P C 0.742 177.913 177.300 -0.215 0.000 1.150 385 P CA 2.366 65.325 63.100 -0.236 0.000 0.837 385 P CB 0.459 32.001 31.700 -0.262 0.000 0.786 386 R N -2.918 117.457 120.500 -0.207 0.000 2.075 386 R HA -0.390 3.841 4.340 -0.183 0.000 0.232 386 R C 1.798 178.001 176.300 -0.161 0.000 1.126 386 R CA 3.537 59.528 56.100 -0.181 0.000 0.963 386 R CB -0.263 29.935 30.300 -0.170 0.000 0.858 386 R HN -0.190 7.951 8.270 -0.215 0.000 0.435 387 R N -0.567 119.837 120.500 -0.159 0.000 2.081 387 R HA -0.230 4.205 4.340 -0.125 -0.170 0.235 387 R C 2.271 178.489 176.300 -0.136 0.000 1.131 387 R CA 2.300 58.318 56.100 -0.138 0.000 0.960 387 R CB -0.746 29.473 30.300 -0.136 0.000 0.856 387 R HN -0.491 7.954 8.270 -0.170 -0.277 0.436 388 M N -0.537 118.974 119.600 -0.149 0.000 2.117 388 M HA -0.350 4.066 4.480 -0.106 0.000 0.262 388 M C 1.430 177.630 176.300 -0.167 0.000 1.065 388 M CA 3.806 59.026 55.300 -0.133 0.000 1.114 388 M CB -0.034 32.493 32.600 -0.122 0.000 1.361 388 M HN -0.481 7.709 8.290 -0.165 0.000 0.408 389 A N -1.728 120.981 122.820 -0.186 0.000 1.933 389 A HA -0.349 3.819 4.320 -0.255 0.000 0.218 389 A C 1.940 179.403 177.584 -0.203 0.000 1.175 389 A CA 3.159 55.068 52.037 -0.213 0.000 0.628 389 A CB -1.154 17.734 19.000 -0.186 0.000 0.814 389 A HN -0.088 7.953 8.150 -0.181 0.000 0.444 390 E N -0.629 119.476 120.200 -0.158 0.000 2.110 390 E HA -0.288 3.987 4.350 -0.124 0.000 0.193 390 E C 2.745 179.267 176.600 -0.130 0.000 0.988 390 E CA 2.869 59.191 56.400 -0.130 0.000 0.804 390 E CB -0.146 29.491 29.700 -0.105 0.000 0.745 390 E HN -0.486 7.700 8.360 -0.150 0.084 0.458 391 L N -1.032 120.109 121.223 -0.136 0.000 2.072 391 L HA -0.317 3.966 4.340 -0.095 0.000 0.205 391 L C 2.048 178.820 176.870 -0.164 0.000 1.079 391 L CA 3.143 57.910 54.840 -0.121 0.000 0.752 391 L CB -0.076 41.922 42.059 -0.103 0.000 0.906 391 L HN -0.541 7.606 8.230 -0.138 0.000 0.436 392 V N -0.289 119.470 119.914 -0.259 0.000 2.343 392 V HA -0.582 3.315 4.120 -0.371 0.000 0.247 392 V C 1.766 177.522 176.094 -0.563 0.000 1.051 392 V CA 4.554 66.577 62.300 -0.462 0.000 1.036 392 V CB -0.279 31.166 31.823 -0.630 0.000 0.654 392 V HN -0.321 7.718 8.190 -0.253 0.000 0.451 393 Q N 0.203 119.764 119.800 -0.398 0.000 2.077 393 Q HA -0.471 3.735 4.340 -0.223 0.000 0.206 393 Q C 2.167 178.130 176.000 -0.063 0.000 0.989 393 Q CA 3.596 59.272 55.803 -0.213 0.000 0.853 393 Q CB -0.287 28.375 28.738 -0.128 0.000 0.907 393 Q HN 0.119 8.181 8.270 -0.348 0.000 0.418 394 S N -0.843 114.819 115.700 -0.063 0.000 2.368 394 S HA -0.332 4.339 4.470 0.016 -0.191 0.225 394 S C 2.013 176.648 174.600 0.059 0.000 1.030 394 S CA 2.721 60.922 58.200 0.001 0.000 0.999 394 S CB -0.310 62.881 63.200 -0.015 0.000 0.844 394 S HN -0.477 7.775 8.310 -0.096 0.000 0.459 395 D N 1.596 122.029 120.400 0.054 0.000 2.117 395 D HA -0.192 4.560 4.640 0.187 0.000 0.197 395 D C 2.232 178.725 176.300 0.322 0.000 0.987 395 D CA 3.051 57.158 54.000 0.177 0.000 0.829 395 D CB -0.456 40.447 40.800 0.173 0.000 0.961 395 D HN -0.536 7.823 8.370 -0.017 0.000 0.460 396 W N -1.911 119.425 121.300 0.060 0.000 2.388 396 W HA -0.199 4.485 4.660 0.039 0.000 0.294 396 W C 2.350 178.857 176.519 -0.019 0.000 1.212 396 W CA 0.895 58.256 57.345 0.027 0.000 1.271 396 W CB -0.703 28.773 29.460 0.027 0.000 1.126 396 W HN -0.089 8.251 8.180 0.267 0.000 0.535 397 E N -1.238 119.093 120.200 0.217 0.000 2.130 397 E HA -0.359 4.155 4.350 0.079 -0.117 0.196 397 E C 2.646 179.294 176.600 0.080 0.000 0.998 397 E CA 3.126 59.590 56.400 0.105 0.000 0.806 397 E CB -0.467 29.278 29.700 0.075 0.000 0.738 397 E HN -0.354 8.134 8.360 0.212 0.000 0.459 398 K N -3.376 117.088 120.400 0.107 0.000 2.362 398 K HA -0.207 4.153 4.320 0.067 0.000 0.200 398 K C 0.986 177.625 176.600 0.065 0.000 1.046 398 K CA 1.698 58.038 56.287 0.087 0.000 0.952 398 K CB -0.214 32.355 32.500 0.116 0.000 0.753 398 K HN -0.489 7.832 8.250 0.138 0.012 0.466 399 V N -10.563 109.388 119.914 0.062 0.000 3.214 399 V HA 0.273 4.404 4.120 0.018 0.000 0.330 399 V C -0.178 175.893 176.094 -0.038 0.000 1.403 399 V CA -1.504 60.806 62.300 0.017 0.000 1.143 399 V CB 0.089 31.924 31.823 0.021 0.000 1.098 399 V HN -0.729 7.367 8.190 0.085 0.145 0.463 400 G N -0.881 107.895 108.800 -0.039 0.000 2.176 400 G HA2 -0.313 3.623 3.960 -0.039 0.000 0.232 400 G HA3 -0.313 3.608 3.960 -0.065 0.000 0.232 400 G C -0.825 173.967 174.900 -0.179 0.000 0.986 400 G CA 0.178 45.234 45.100 -0.072 0.000 0.643 400 G HN -0.484 7.634 8.290 -0.009 0.166 0.522 401 V N 2.176 121.951 119.914 -0.232 0.000 2.318 401 V HA 0.174 4.087 4.120 -0.653 -0.185 0.271 401 V C -0.620 175.405 176.094 -0.115 0.000 1.030 401 V CA -0.569 61.470 62.300 -0.435 0.000 0.844 401 V CB 0.181 31.595 31.823 -0.681 0.000 1.015 401 V HN -0.442 7.662 8.190 -0.144 0.000 0.460 402 K N 8.521 128.866 120.400 -0.092 0.000 2.118 402 K HA 0.283 4.635 4.320 0.053 0.000 0.267 402 K C -1.165 175.492 176.600 0.095 0.000 0.991 402 K CA -0.455 55.849 56.287 0.028 0.000 0.916 402 K CB 1.657 34.171 32.500 0.023 0.000 1.041 402 K HN -0.075 8.085 8.250 -0.150 0.000 0.455 403 S N -0.186 115.587 115.700 0.121 0.000 2.570 403 S HA 0.816 5.638 4.470 0.180 -0.244 0.270 403 S C -1.063 173.594 174.600 0.095 0.000 1.149 403 S CA -2.235 56.060 58.200 0.159 0.000 0.837 403 S CB 3.389 66.734 63.200 0.241 0.000 1.124 403 S HN -0.064 8.304 8.310 0.096 0.000 0.465 404 K N 0.252 120.707 120.400 0.091 0.000 2.156 404 K HA 0.370 4.698 4.320 0.013 0.000 0.254 404 K C -1.471 175.135 176.600 0.011 0.000 0.950 404 K CA -1.986 54.320 56.287 0.031 0.000 0.849 404 K CB 2.035 34.543 32.500 0.013 0.000 1.100 404 K HN -0.013 8.310 8.250 0.122 0.000 0.434 405 L N 2.014 123.211 121.223 -0.043 0.000 2.349 405 L HA 0.491 4.995 4.340 -0.056 -0.197 0.275 405 L C 0.558 177.332 176.870 -0.161 0.000 1.115 405 L CA -0.661 54.128 54.840 -0.084 0.000 0.820 405 L CB 0.462 42.459 42.059 -0.104 0.000 1.135 405 L HN 0.170 8.370 8.230 -0.050 0.000 0.445 406 V N 4.848 124.619 119.914 -0.238 0.000 2.656 406 V HA 0.235 4.093 4.120 -0.436 0.000 0.307 406 V C -1.819 173.967 176.094 -0.514 0.000 1.051 406 V CA -0.937 61.084 62.300 -0.466 0.000 0.893 406 V CB 3.246 34.668 31.823 -0.670 0.000 0.999 406 V HN 0.347 8.423 8.190 -0.190 0.000 0.426 407 S N 2.836 118.164 115.700 -0.621 0.000 2.607 407 S HA 0.287 4.625 4.470 -0.220 0.000 0.273 407 S C -1.860 172.340 174.600 -0.667 0.000 1.148 407 S CA -1.332 56.606 58.200 -0.436 0.000 0.833 407 S CB 2.150 65.175 63.200 -0.292 0.000 1.130 407 S HN -0.113 7.775 8.310 -0.704 0.000 0.470 408 Y N -0.314 119.968 120.300 -0.030 0.000 2.655 408 Y HA 0.181 4.708 4.550 -0.038 0.000 0.336 408 Y C -1.318 174.607 175.900 0.041 0.000 1.154 408 Y CA -1.241 56.863 58.100 0.007 0.000 1.055 408 Y CB 3.428 41.921 38.460 0.056 0.000 1.295 408 Y HN 0.253 8.627 8.280 0.158 0.000 0.465 409 E N 1.478 121.807 120.200 0.215 0.000 2.436 409 E HA -0.125 4.307 4.350 0.137 0.000 0.262 409 E C 0.686 177.440 176.600 0.257 0.000 1.063 409 E CA 0.295 56.801 56.400 0.177 0.000 0.944 409 E CB 0.786 30.566 29.700 0.133 0.000 0.950 409 E HN 0.384 8.871 8.360 0.210 0.000 0.444 410 W N 4.113 125.444 121.300 0.051 0.000 2.317 410 W HA -0.294 4.414 4.660 0.079 0.000 0.318 410 W C 1.273 177.871 176.519 0.131 0.000 1.227 410 W CA 2.894 60.284 57.345 0.075 0.000 1.269 410 W CB -0.025 29.445 29.460 0.016 0.000 1.155 410 W HN 0.704 9.104 8.180 0.366 0.000 0.484 411 G N -3.403 105.356 108.800 -0.068 0.000 2.418 411 G HA2 -0.424 3.277 3.960 -0.433 0.000 0.217 411 G HA3 -0.424 3.474 3.960 -0.105 0.000 0.217 411 G C 0.727 175.516 174.900 -0.184 0.000 1.158 411 G CA 2.234 47.198 45.100 -0.227 0.000 0.771 411 G HN 0.190 8.553 8.290 0.120 0.000 0.545 412 D N 2.263 122.631 120.400 -0.053 0.000 2.144 412 D HA -0.213 4.361 4.640 -0.110 0.000 0.200 412 D C 1.318 177.567 176.300 -0.086 0.000 0.978 412 D CA 2.277 56.237 54.000 -0.066 0.000 0.833 412 D CB -0.118 40.690 40.800 0.012 0.000 0.961 412 D HN -0.756 7.622 8.370 0.014 0.000 0.470 413 Y N 0.936 121.188 120.300 -0.079 0.000 2.128 413 Y HA -0.443 4.204 4.550 0.162 0.000 0.284 413 Y C 1.701 177.542 175.900 -0.098 0.000 1.154 413 Y CA 3.822 61.948 58.100 0.042 0.000 1.149 413 Y CB 0.153 38.697 38.460 0.140 0.000 0.976 413 Y HN -0.070 8.338 8.280 0.213 0.000 0.505 414 I N -2.448 117.931 120.570 -0.318 0.000 2.286 414 I HA -0.467 3.339 4.170 -0.606 0.000 0.245 414 I C 1.810 177.673 176.117 -0.423 0.000 1.104 414 I CA 1.717 62.709 61.300 -0.514 0.000 1.397 414 I CB -1.069 36.541 38.000 -0.649 0.000 1.072 414 I HN -0.390 7.621 8.210 -0.331 0.000 0.417 415 K N 0.941 121.155 120.400 -0.311 0.000 2.032 415 K HA -0.481 3.706 4.320 -0.222 0.000 0.209 415 K C 2.348 178.803 176.600 -0.241 0.000 1.048 415 K CA 4.065 60.210 56.287 -0.237 0.000 0.927 415 K CB -0.083 32.309 32.500 -0.179 0.000 0.712 415 K HN -0.236 7.838 8.250 -0.293 0.000 0.441 416 R N -2.952 117.401 120.500 -0.246 0.000 2.096 416 R HA -0.227 4.007 4.340 -0.177 0.000 0.235 416 R C 2.514 178.623 176.300 -0.318 0.000 1.127 416 R CA 3.351 59.326 56.100 -0.208 0.000 0.968 416 R CB -0.115 30.093 30.300 -0.154 0.000 0.861 416 R HN -0.296 7.826 8.270 -0.247 0.000 0.440 417 T N 1.932 116.197 114.554 -0.481 0.000 2.708 417 T HA -0.351 3.492 4.350 -0.847 0.000 0.266 417 T C 2.165 176.523 174.700 -0.571 0.000 1.037 417 T CA 4.701 66.361 62.100 -0.733 0.000 1.146 417 T CB -0.246 68.010 68.868 -1.020 0.000 0.865 417 T HN -0.415 7.550 8.240 -0.459 0.000 0.435 418 K N 0.995 121.121 120.400 -0.456 0.000 2.147 418 K HA -0.352 3.848 4.320 -0.199 0.000 0.205 418 K C 1.793 178.289 176.600 -0.173 0.000 1.049 418 K CA 3.420 59.557 56.287 -0.248 0.000 0.936 418 K CB -0.321 32.079 32.500 -0.167 0.000 0.722 418 K HN -0.073 7.900 8.250 -0.460 0.000 0.446 419 A N -3.851 118.859 122.820 -0.185 0.000 2.168 419 A HA -0.018 4.244 4.320 -0.096 0.000 0.215 419 A C 0.380 177.889 177.584 -0.124 0.000 1.152 419 A CA 0.921 52.883 52.037 -0.126 0.000 0.716 419 A CB -0.274 18.660 19.000 -0.110 0.000 0.794 419 A HN -0.476 7.441 8.150 -0.217 0.103 0.465 420 G N -2.432 106.255 108.800 -0.189 0.000 2.131 420 G HA2 -0.369 3.468 3.960 -0.205 0.000 0.223 420 G HA3 -0.369 3.524 3.960 -0.112 0.000 0.223 420 G C 0.738 175.527 174.900 -0.186 0.000 0.990 420 G CA -0.018 44.978 45.100 -0.174 0.000 0.671 420 G HN -0.385 7.583 8.290 -0.253 0.170 0.521 421 E N -1.102 118.961 120.200 -0.229 0.000 2.274 421 E HA -0.296 4.044 4.350 -0.015 0.000 0.194 421 E C 0.594 177.030 176.600 -0.273 0.000 0.996 421 E CA 0.815 57.148 56.400 -0.112 0.000 0.840 421 E CB 0.001 29.748 29.700 0.079 0.000 0.772 421 E HN -0.354 7.850 8.360 -0.260 0.000 0.491 422 L N -5.700 115.009 121.223 -0.856 0.000 2.473 422 L HA -0.021 3.082 4.340 -2.062 0.000 0.268 422 L C 0.402 176.997 176.870 -0.458 0.000 1.215 422 L CA 0.728 54.790 54.840 -1.296 0.000 0.823 422 L CB 0.588 41.842 42.059 -1.342 0.000 1.099 422 L HN -0.769 6.922 8.230 -0.848 0.031 0.483 423 T N -4.384 110.001 114.554 -0.282 0.000 3.082 423 T HA 0.068 4.388 4.350 -0.050 0.000 0.235 423 T C -0.502 173.917 174.700 -0.470 0.000 0.991 423 T CA 0.394 62.427 62.100 -0.112 0.000 1.220 423 T CB 0.489 69.531 68.868 0.291 0.000 0.909 423 T HN 0.147 8.204 8.240 -0.304 0.000 0.424 424 A N -0.543 122.147 122.820 -0.218 0.000 2.549 424 A HA 1.031 5.463 4.320 -0.204 -0.235 0.297 424 A C -2.134 175.458 177.584 0.013 0.000 1.061 424 A CA -1.183 50.776 52.037 -0.130 0.000 0.690 424 A CB 3.270 22.338 19.000 0.112 0.000 1.287 424 A HN -0.720 7.426 8.150 -0.007 0.000 0.402 425 G N -1.120 107.676 108.800 -0.007 0.000 2.646 425 G HA2 0.694 4.795 3.960 0.013 0.000 0.291 425 G HA3 0.694 4.641 3.960 -0.022 0.000 0.291 425 G C -2.562 172.137 174.900 -0.334 0.000 1.445 425 G CA 0.123 45.192 45.100 -0.052 0.000 0.814 425 G HN -0.159 8.111 8.290 -0.033 0.000 0.495 426 T N -0.519 113.725 114.554 -0.517 0.000 2.780 426 T HA 0.637 4.875 4.350 -0.472 -0.171 0.294 426 T C -0.958 173.186 174.700 -0.927 0.000 0.949 426 T CA -0.864 60.899 62.100 -0.561 0.000 1.074 426 T CB 1.043 69.695 68.868 -0.361 0.000 0.910 426 T HN -0.137 7.871 8.240 -0.387 0.000 0.501 427 Y N 2.976 122.941 120.300 -0.558 0.000 2.715 427 Y HA 0.165 4.635 4.550 -0.133 0.000 0.331 427 Y C -1.733 173.781 175.900 -0.644 0.000 1.197 427 Y CA -0.954 56.835 58.100 -0.519 0.000 1.079 427 Y CB 4.312 42.447 38.460 -0.542 0.000 1.298 427 Y HN 0.198 8.016 8.280 -0.770 0.000 0.477 428 G N -2.777 106.036 108.800 0.021 0.000 2.673 428 G HA2 0.516 4.823 3.960 0.313 0.000 0.292 428 G HA3 0.516 4.585 3.960 0.181 0.000 0.292 428 G C -3.112 172.090 174.900 0.502 0.000 1.450 428 G CA 0.006 45.257 45.100 0.252 0.000 0.837 428 G HN 0.004 8.442 8.290 0.247 0.000 0.505 429 W N 0.690 122.159 121.300 0.281 0.000 3.259 429 W HA 0.356 5.075 4.660 0.099 0.000 0.331 429 W C -3.046 173.542 176.519 0.115 0.000 1.144 429 W CA -0.660 56.776 57.345 0.152 0.000 1.227 429 W CB 3.490 33.015 29.460 0.109 0.000 1.371 429 W HN 0.248 8.769 8.180 0.569 0.000 0.491 430 S N 4.585 120.001 115.700 -0.473 0.000 2.472 430 S HA 0.778 5.389 4.470 -0.036 -0.162 0.303 430 S C 0.468 174.586 174.600 -0.802 0.000 1.099 430 S CA -0.986 56.996 58.200 -0.362 0.000 1.077 430 S CB 1.953 65.012 63.200 -0.234 0.000 1.031 430 S HN -0.005 7.883 8.310 -0.704 0.000 0.487 431 G N 2.136 110.684 108.800 -0.421 0.000 2.527 431 G HA2 0.028 3.747 3.960 -0.580 0.000 0.248 431 G HA3 0.028 3.921 3.960 -0.111 0.000 0.248 431 G C -1.551 173.174 174.900 -0.292 0.000 1.231 431 G CA -0.038 44.825 45.100 -0.394 0.000 0.838 431 G HN 0.053 8.333 8.290 -0.017 0.000 0.570 432 D N 0.051 120.212 120.400 -0.398 0.000 2.498 432 D HA 0.152 4.222 4.640 -0.950 0.000 0.223 432 D C -0.703 174.900 176.300 -1.163 0.000 1.125 432 D CA 0.892 54.454 54.000 -0.729 0.000 0.835 432 D CB 2.477 43.134 40.800 -0.239 0.000 1.086 432 D HN 0.255 8.834 8.370 -0.252 -0.360 0.510 433 N N -2.833 115.506 118.700 -0.601 0.000 2.118 433 N HA 0.043 4.579 4.740 -0.340 0.000 0.226 433 N C 0.136 175.723 175.510 0.128 0.000 1.305 433 N CA -0.938 51.990 53.050 -0.204 0.000 0.890 433 N CB 1.746 40.299 38.487 0.110 0.000 1.118 433 N HN -0.894 7.290 8.380 -0.326 0.000 0.511 434 G N -0.867 108.049 108.800 0.193 0.000 2.176 434 G HA2 -0.339 3.890 3.960 0.448 0.000 0.253 434 G HA3 -0.339 3.883 3.960 0.436 0.000 0.253 434 G C -1.361 173.737 174.900 0.329 0.000 0.979 434 G CA 0.351 45.686 45.100 0.392 0.000 0.641 434 G HN 0.148 8.496 8.290 0.096 0.000 0.530 435 D N 0.671 121.227 120.400 0.260 0.000 2.248 435 D HA 0.502 5.255 4.640 0.189 0.000 0.246 435 D C -1.129 175.154 176.300 -0.029 0.000 1.027 435 D CA -3.172 50.931 54.000 0.171 0.000 0.853 435 D CB 2.612 43.578 40.800 0.276 0.000 1.243 435 D HN -0.570 8.170 8.370 0.236 -0.228 0.462 436 P HA -0.125 4.138 4.420 -0.262 0.000 0.223 436 P C 0.702 177.776 177.300 -0.376 0.000 1.151 436 P CA 1.609 64.391 63.100 -0.530 0.000 0.787 436 P CB 0.387 31.413 31.700 -1.124 0.000 0.788 437 D N -1.694 118.528 120.400 -0.296 0.000 2.178 437 D HA -0.344 4.225 4.640 -0.118 0.000 0.201 437 D C 0.942 177.275 176.300 0.054 0.000 0.980 437 D CA 3.465 57.428 54.000 -0.061 0.000 0.842 437 D CB 0.052 40.936 40.800 0.140 0.000 0.948 437 D HN 0.033 8.566 8.370 -0.245 -0.311 0.472 438 N N -2.992 115.778 118.700 0.117 0.000 2.521 438 N HA -0.131 4.697 4.740 0.147 0.000 0.188 438 N C 0.125 175.712 175.510 0.129 0.000 1.146 438 N CA 1.798 54.944 53.050 0.161 0.000 0.893 438 N CB 0.165 38.757 38.487 0.176 0.000 0.975 438 N HN -0.547 7.885 8.380 0.122 0.021 0.451 439 F N 0.135 120.109 119.950 0.039 0.000 2.208 439 F HA -0.087 4.369 4.527 -0.118 0.000 0.282 439 F C 1.467 177.130 175.800 -0.228 0.000 1.071 439 F CA 3.785 61.739 58.000 -0.077 0.000 1.228 439 F CB 0.728 39.725 39.000 -0.005 0.000 1.088 439 F HN -0.541 7.826 8.300 0.360 0.149 0.512 440 L N -2.259 119.014 121.223 0.083 0.000 2.056 440 L HA -0.480 4.021 4.340 0.267 0.000 0.207 440 L C 2.275 179.181 176.870 0.060 0.000 1.078 440 L CA 3.471 58.382 54.840 0.118 0.000 0.749 440 L CB -0.484 41.621 42.059 0.075 0.000 0.901 440 L HN -0.318 7.955 8.230 0.071 0.000 0.433 441 S N -0.390 115.321 115.700 0.017 0.000 2.345 441 S HA -0.120 4.391 4.470 0.068 0.000 0.219 441 S C -0.037 174.498 174.600 -0.108 0.000 1.031 441 S CA 5.187 63.400 58.200 0.021 0.000 0.984 441 S CB -1.814 61.435 63.200 0.082 0.000 0.874 441 S HN -0.123 8.201 8.310 0.023 0.000 0.451 442 P HA -0.190 4.069 4.420 -0.268 0.000 0.216 442 P C 0.443 177.389 177.300 -0.590 0.000 1.150 442 P CA 2.837 65.694 63.100 -0.405 0.000 0.837 442 P CB 0.166 31.500 31.700 -0.611 0.000 0.786 443 L N -5.823 114.953 121.223 -0.745 0.000 2.249 443 L HA -0.098 3.683 4.340 -0.931 0.000 0.207 443 L C 1.627 177.893 176.870 -1.007 0.000 1.090 443 L CA 2.035 56.261 54.840 -1.024 0.000 0.802 443 L CB 0.630 41.864 42.059 -1.375 0.000 0.947 443 L HN -0.675 7.138 8.230 -0.667 0.017 0.453 444 F N -6.371 113.444 119.950 -0.225 0.000 2.817 444 F HA 0.125 4.632 4.527 -0.033 0.000 0.333 444 F C -0.262 175.557 175.800 0.032 0.000 1.085 444 F CA -0.727 57.225 58.000 -0.080 0.000 1.170 444 F CB 2.174 41.084 39.000 -0.150 0.000 1.066 444 F HN -0.465 7.691 8.300 -0.241 0.000 0.564 445 G N -1.545 107.319 108.800 0.106 0.000 2.398 445 G HA2 -0.047 4.103 3.960 0.097 0.000 0.246 445 G HA3 -0.047 3.960 3.960 0.078 0.000 0.246 445 G C 0.468 175.399 174.900 0.052 0.000 1.289 445 G CA -0.123 45.029 45.100 0.086 0.000 0.869 445 G HN -0.655 7.652 8.290 0.028 0.000 0.543 446 S N 6.353 122.070 115.700 0.027 0.000 2.383 446 S HA -0.409 4.056 4.470 -0.009 0.000 0.229 446 S C 2.028 176.639 174.600 0.018 0.000 1.030 446 S CA 3.236 61.437 58.200 0.000 0.000 1.002 446 S CB 0.204 63.385 63.200 -0.031 0.000 0.829 446 S HN -0.192 8.381 8.310 0.015 -0.255 0.467 447 E N -2.681 117.545 120.200 0.043 0.000 2.333 447 E HA -0.189 4.183 4.350 0.037 0.000 0.198 447 E C 0.729 177.342 176.600 0.021 0.000 1.007 447 E CA 1.719 58.144 56.400 0.042 0.000 0.845 447 E CB -0.848 28.891 29.700 0.065 0.000 0.766 447 E HN 0.550 8.933 8.360 0.066 0.018 0.507 448 N N -2.816 115.885 118.700 0.001 0.000 2.235 448 N HA 0.158 4.886 4.740 -0.019 0.000 0.209 448 N C -1.025 174.464 175.510 -0.034 0.000 1.122 448 N CA -0.187 52.845 53.050 -0.031 0.000 0.845 448 N CB 1.334 39.771 38.487 -0.083 0.000 1.004 448 N HN -0.523 7.701 8.380 0.004 0.158 0.499 449 V N -0.096 119.813 119.914 -0.009 0.000 2.599 449 V HA -0.438 3.837 4.120 0.001 -0.155 0.300 449 V C 0.825 176.918 176.094 -0.002 0.000 1.034 449 V CA 2.678 64.978 62.300 0.001 0.000 1.115 449 V CB -0.297 31.533 31.823 0.011 0.000 0.934 449 V HN -0.814 7.333 8.190 -0.000 0.043 0.485 450 G N 5.611 114.410 108.800 -0.002 0.000 2.217 450 G HA2 -0.300 3.867 3.960 -0.024 0.000 0.246 450 G HA3 -0.300 3.654 3.960 -0.010 0.000 0.246 450 G C -0.975 173.923 174.900 -0.003 0.000 0.990 450 G CA 0.611 45.705 45.100 -0.010 0.000 0.627 450 G HN 0.712 9.005 8.290 0.004 0.000 0.522 451 N N 0.099 118.798 118.700 -0.001 0.000 2.648 451 N HA 0.263 5.006 4.740 0.004 0.000 0.234 451 N C -0.659 174.848 175.510 -0.006 0.000 1.034 451 N CA 0.635 53.681 53.050 -0.007 0.000 1.205 451 N CB 1.501 39.973 38.487 -0.025 0.000 1.573 451 N HN -0.112 8.074 8.380 -0.011 0.187 0.615 452 S N -3.575 112.041 115.700 -0.141 0.000 2.603 452 S HA 0.062 4.301 4.470 -0.384 0.000 0.232 452 S C -0.460 173.765 174.600 -0.626 0.000 1.016 452 S CA -0.003 57.966 58.200 -0.385 0.000 0.976 452 S CB 1.622 64.583 63.200 -0.399 0.000 0.921 452 S HN -0.460 7.761 8.310 -0.147 0.000 0.516 453 N N 3.935 122.435 118.700 -0.333 0.000 2.918 453 N HA 0.193 4.846 4.740 -0.396 -0.150 0.247 453 N C -0.344 175.121 175.510 -0.075 0.000 1.117 453 N CA -1.955 50.937 53.050 -0.263 0.000 1.005 453 N CB -0.813 37.600 38.487 -0.124 0.000 1.297 453 N HN -0.655 7.606 8.380 -0.198 0.000 0.513 454 Y N 3.749 123.947 120.300 -0.170 0.000 2.352 454 Y HA -0.237 4.147 4.550 -0.277 0.000 0.292 454 Y C 1.022 176.844 175.900 -0.130 0.000 1.136 454 Y CA 0.422 58.366 58.100 -0.260 0.000 1.227 454 Y CB -0.817 37.303 38.460 -0.568 0.000 0.991 454 Y HN -0.333 7.707 8.280 -0.400 0.000 0.545 455 A N -4.166 118.768 122.820 0.190 0.000 2.209 455 A HA -0.044 4.536 4.320 0.203 -0.138 0.212 455 A C -0.891 176.828 177.584 0.225 0.000 1.158 455 A CA -0.098 52.092 52.037 0.255 0.000 0.742 455 A CB -0.095 19.171 19.000 0.443 0.000 0.790 455 A HN -0.238 8.016 8.150 0.209 0.022 0.472 456 R N -7.795 112.802 120.500 0.161 0.000 3.525 456 R HA -0.453 3.939 4.340 0.088 0.000 0.276 456 R C -1.559 174.856 176.300 0.192 0.000 1.116 456 R CA 0.547 56.723 56.100 0.127 0.000 0.745 456 R CB -3.248 27.099 30.300 0.078 0.000 1.185 456 R HN -0.577 7.672 8.270 0.128 0.098 0.454 457 F N 1.302 121.298 119.950 0.077 0.000 2.471 457 F HA -0.048 4.532 4.527 0.088 0.000 0.365 457 F C -0.877 174.951 175.800 0.048 0.000 1.095 457 F CA -0.217 57.836 58.000 0.087 0.000 1.174 457 F CB 1.213 40.302 39.000 0.150 0.000 1.105 457 F HN -0.782 7.993 8.300 0.370 -0.254 0.535 458 K N 7.093 127.249 120.400 -0.407 0.000 2.507 458 K HA 0.267 4.414 4.320 -0.289 0.000 0.253 458 K C -1.586 174.679 176.600 -0.558 0.000 0.969 458 K CA -1.170 54.896 56.287 -0.368 0.000 0.908 458 K CB 1.413 33.812 32.500 -0.170 0.000 1.127 458 K HN 0.143 8.153 8.250 -0.401 0.000 0.437 459 N N 6.010 124.360 118.700 -0.583 0.000 2.540 459 N HA 0.422 4.919 4.740 -0.406 0.000 0.275 459 N C -1.890 173.469 175.510 -0.251 0.000 1.053 459 N CA -2.903 49.861 53.050 -0.478 0.000 0.876 459 N CB 2.077 40.181 38.487 -0.638 0.000 1.284 459 N HN 0.089 8.181 8.380 -0.479 0.000 0.518 460 P HA -0.218 4.112 4.420 -0.149 0.000 0.216 460 P C 0.829 178.051 177.300 -0.130 0.000 1.150 460 P CA 2.093 65.108 63.100 -0.141 0.000 0.837 460 P CB 0.487 32.125 31.700 -0.103 0.000 0.786 461 E N -1.555 118.581 120.200 -0.107 0.000 2.072 461 E HA -0.291 4.014 4.350 -0.076 0.000 0.191 461 E C 2.076 178.627 176.600 -0.081 0.000 0.985 461 E CA 2.847 59.200 56.400 -0.080 0.000 0.801 461 E CB -0.149 29.518 29.700 -0.055 0.000 0.750 461 E HN -0.528 7.845 8.360 -0.108 -0.077 0.452 462 L N -0.325 120.852 121.223 -0.077 0.000 2.027 462 L HA -0.331 3.990 4.340 -0.033 0.000 0.206 462 L C 1.543 178.358 176.870 -0.092 0.000 1.074 462 L CA 3.077 57.890 54.840 -0.046 0.000 0.745 462 L CB -0.248 41.826 42.059 0.024 0.000 0.898 462 L HN -0.257 8.224 8.230 -0.085 -0.301 0.433 463 D N -0.840 119.458 120.400 -0.170 0.000 2.133 463 D HA -0.392 4.062 4.640 -0.311 0.000 0.195 463 D C 2.132 178.111 176.300 -0.534 0.000 0.997 463 D CA 3.497 57.278 54.000 -0.366 0.000 0.840 463 D CB -0.637 39.932 40.800 -0.385 0.000 0.947 463 D HN -0.246 8.026 8.370 -0.163 0.000 0.452 464 A N -0.342 122.299 122.820 -0.299 0.000 1.902 464 A HA -0.252 3.953 4.320 -0.192 0.000 0.217 464 A C 1.875 179.410 177.584 -0.081 0.000 1.181 464 A CA 3.046 54.978 52.037 -0.175 0.000 0.623 464 A CB -0.322 18.621 19.000 -0.095 0.000 0.818 464 A HN -0.395 7.619 8.150 -0.226 0.000 0.443 465 L N -1.933 119.248 121.223 -0.070 0.000 2.012 465 L HA -0.455 3.859 4.340 -0.043 0.000 0.210 465 L C 2.353 179.224 176.870 0.002 0.000 1.073 465 L CA 3.216 58.032 54.840 -0.039 0.000 0.748 465 L CB -0.270 41.767 42.059 -0.036 0.000 0.891 465 L HN -0.705 7.477 8.230 -0.081 0.000 0.431 466 L N -3.057 118.197 121.223 0.051 0.000 2.093 466 L HA -0.490 3.996 4.340 0.243 0.000 0.208 466 L C 2.374 179.401 176.870 0.261 0.000 1.085 466 L CA 3.163 58.116 54.840 0.189 0.000 0.755 466 L CB -0.683 41.501 42.059 0.209 0.000 0.904 466 L HN -0.294 7.940 8.230 0.006 0.000 0.435 467 H N -1.860 117.247 119.070 0.061 0.000 2.357 467 H HA -0.382 4.214 4.556 0.067 0.000 0.301 467 H C 2.079 177.432 175.328 0.041 0.000 1.082 467 H CA 2.506 58.585 56.048 0.052 0.000 1.342 467 H CB 0.233 30.014 29.762 0.032 0.000 1.389 467 H HN -0.254 8.119 8.280 0.154 0.000 0.511 468 K N -0.898 119.590 120.400 0.147 0.000 2.025 468 K HA -0.295 4.069 4.320 0.074 0.000 0.207 468 K C 2.407 179.034 176.600 0.046 0.000 1.049 468 K CA 2.489 58.818 56.287 0.069 0.000 0.933 468 K CB 0.169 32.683 32.500 0.023 0.000 0.714 468 K HN -0.478 7.847 8.250 0.126 0.000 0.438 469 A N -0.711 122.114 122.820 0.009 0.000 1.930 469 A HA -0.247 4.028 4.320 -0.075 0.000 0.217 469 A C 1.755 179.411 177.584 0.119 0.000 1.175 469 A CA 2.844 54.847 52.037 -0.055 0.000 0.627 469 A CB -0.406 18.341 19.000 -0.423 0.000 0.815 469 A HN -0.383 7.771 8.150 0.007 0.000 0.443 470 V N -2.731 117.299 119.914 0.193 0.000 2.759 470 V HA -0.306 4.009 4.120 0.325 0.000 0.256 470 V C 0.448 176.656 176.094 0.189 0.000 1.080 470 V CA 2.187 64.634 62.300 0.246 0.000 1.101 470 V CB 0.041 31.998 31.823 0.224 0.000 0.698 470 V HN -0.589 7.711 8.190 0.184 0.000 0.477 471 G N -3.368 105.513 108.800 0.134 0.000 2.986 471 G HA2 0.053 4.083 3.960 0.118 0.000 0.213 471 G HA3 0.053 4.062 3.960 0.082 0.000 0.213 471 G C -0.343 174.617 174.900 0.101 0.000 1.156 471 G CA -0.619 44.546 45.100 0.107 0.000 0.763 471 G HN -0.760 7.564 8.290 0.118 0.037 0.547 472 L N -0.322 120.963 121.223 0.104 0.000 2.417 472 L HA 0.116 4.494 4.340 0.064 0.000 0.268 472 L C -0.023 176.904 176.870 0.096 0.000 1.158 472 L CA -0.191 54.698 54.840 0.082 0.000 0.819 472 L CB 0.877 42.974 42.059 0.063 0.000 1.112 472 L HN -0.883 7.415 8.230 0.114 0.000 0.458 473 S N -0.696 115.044 115.700 0.067 0.000 2.503 473 S HA -0.115 4.404 4.470 0.082 0.000 0.217 473 S C -0.034 174.587 174.600 0.035 0.000 0.999 473 S CA 0.223 58.460 58.200 0.061 0.000 0.914 473 S CB 0.427 63.655 63.200 0.046 0.000 0.782 473 S HN 0.052 8.393 8.310 0.053 0.000 0.520 474 D N 3.178 123.594 120.400 0.027 0.000 2.374 474 D HA 0.102 4.738 4.640 -0.007 0.000 0.240 474 D C -0.002 176.296 176.300 -0.003 0.000 1.229 474 D CA -0.849 53.155 54.000 0.006 0.000 0.895 474 D CB 0.315 41.120 40.800 0.008 0.000 1.046 474 D HN -0.227 8.163 8.370 0.034 0.000 0.498 475 K N 7.717 128.079 120.400 -0.064 0.000 2.097 475 K HA -0.418 3.817 4.320 -0.141 0.000 0.206 475 K C 1.335 177.884 176.600 -0.084 0.000 1.049 475 K CA 2.952 59.134 56.287 -0.174 0.000 0.933 475 K CB 0.077 32.342 32.500 -0.392 0.000 0.717 475 K HN 0.352 8.555 8.250 -0.077 0.000 0.442 476 A N -3.259 119.536 122.820 -0.043 0.000 1.902 476 A HA -0.304 4.035 4.320 0.032 0.000 0.217 476 A C 1.875 179.492 177.584 0.054 0.000 1.181 476 A CA 3.299 55.346 52.037 0.016 0.000 0.623 476 A CB -0.801 18.202 19.000 0.005 0.000 0.818 476 A HN -0.240 8.017 8.150 -0.053 -0.138 0.443 477 E N -1.260 118.962 120.200 0.036 0.000 2.107 477 E HA -0.226 4.138 4.350 0.024 0.000 0.191 477 E C 2.236 178.854 176.600 0.030 0.000 0.982 477 E CA 2.179 58.595 56.400 0.028 0.000 0.809 477 E CB -0.258 29.450 29.700 0.013 0.000 0.756 477 E HN -0.596 7.954 8.360 0.022 -0.177 0.459 478 R N -0.956 119.592 120.500 0.080 0.000 2.091 478 R HA -0.450 3.833 4.340 -0.096 0.000 0.238 478 R C 2.359 178.747 176.300 0.147 0.000 1.136 478 R CA 3.618 59.772 56.100 0.090 0.000 0.959 478 R CB -0.191 30.344 30.300 0.392 0.000 0.856 478 R HN -0.325 8.000 8.270 0.091 0.000 0.437 479 A N -1.192 121.875 122.820 0.412 0.000 1.902 479 A HA -0.238 4.475 4.320 0.656 0.000 0.217 479 A C 2.184 179.893 177.584 0.207 0.000 1.181 479 A CA 3.226 55.545 52.037 0.470 0.000 0.623 479 A CB -0.867 18.407 19.000 0.457 0.000 0.818 479 A HN -0.009 8.362 8.150 0.368 0.000 0.443 480 K N -2.049 118.414 120.400 0.105 0.000 2.097 480 K HA -0.194 4.345 4.320 0.056 -0.186 0.206 480 K C 2.595 179.191 176.600 -0.007 0.000 1.049 480 K CA 1.971 58.285 56.287 0.044 0.000 0.933 480 K CB -0.750 31.764 32.500 0.023 0.000 0.717 480 K HN -0.709 7.601 8.250 0.101 0.000 0.442 481 I N 0.298 120.819 120.570 -0.082 0.000 2.202 481 I HA -0.394 3.714 4.170 -0.103 0.000 0.242 481 I C 2.380 178.412 176.117 -0.142 0.000 1.091 481 I CA 4.012 65.214 61.300 -0.164 0.000 1.368 481 I CB 0.158 37.984 38.000 -0.289 0.000 1.058 481 I HN -0.649 7.505 8.210 -0.094 0.000 0.410 482 Y N -1.942 118.375 120.300 0.028 0.000 2.274 482 Y HA -0.487 4.040 4.550 -0.039 0.000 0.290 482 Y C 2.478 178.342 175.900 -0.061 0.000 1.145 482 Y CA 2.274 60.357 58.100 -0.029 0.000 1.203 482 Y CB -1.370 37.054 38.460 -0.061 0.000 0.984 482 Y HN -0.364 7.734 8.280 -0.305 0.000 0.533 483 E N -0.611 119.646 120.200 0.094 0.000 2.077 483 E HA -0.430 3.908 4.350 -0.019 0.000 0.193 483 E C 2.260 178.844 176.600 -0.026 0.000 0.989 483 E CA 3.069 59.476 56.400 0.011 0.000 0.800 483 E CB -0.349 29.363 29.700 0.020 0.000 0.746 483 E HN -0.349 8.067 8.360 0.107 0.008 0.452 484 Q N -0.391 119.397 119.800 -0.019 0.000 2.084 484 Q HA -0.322 3.994 4.340 -0.040 0.000 0.202 484 Q C 2.170 178.143 176.000 -0.045 0.000 0.978 484 Q CA 2.940 58.721 55.803 -0.035 0.000 0.844 484 Q CB -0.027 28.691 28.738 -0.034 0.000 0.898 484 Q HN -0.550 7.713 8.270 -0.012 0.000 0.426 485 A N -1.257 121.547 122.820 -0.027 0.000 1.940 485 A HA -0.356 3.935 4.320 -0.048 0.000 0.219 485 A C 2.292 179.806 177.584 -0.117 0.000 1.176 485 A CA 3.054 55.065 52.037 -0.043 0.000 0.631 485 A CB -0.935 18.085 19.000 0.035 0.000 0.814 485 A HN -0.156 7.911 8.150 -0.003 0.082 0.446 486 Q N -2.235 117.494 119.800 -0.119 0.000 2.172 486 Q HA -0.298 3.899 4.340 -0.239 0.000 0.200 486 Q C 2.500 178.399 176.000 -0.168 0.000 0.964 486 Q CA 2.952 58.645 55.803 -0.183 0.000 0.855 486 Q CB -0.086 28.536 28.738 -0.192 0.000 0.918 486 Q HN -0.416 7.700 8.270 -0.082 0.104 0.444 487 V N 0.699 120.539 119.914 -0.123 0.000 2.295 487 V HA -0.534 3.518 4.120 -0.113 0.000 0.246 487 V C 1.452 177.489 176.094 -0.095 0.000 1.049 487 V CA 4.048 66.286 62.300 -0.103 0.000 1.024 487 V CB -0.252 31.527 31.823 -0.073 0.000 0.648 487 V HN -0.842 7.193 8.190 -0.104 0.092 0.447 488 L N -0.092 121.077 121.223 -0.088 0.000 2.042 488 L HA -0.298 4.020 4.340 -0.037 0.000 0.210 488 L C 1.818 178.624 176.870 -0.105 0.000 1.076 488 L CA 3.013 57.814 54.840 -0.065 0.000 0.749 488 L CB 0.061 42.093 42.059 -0.044 0.000 0.893 488 L HN -0.693 7.485 8.230 -0.087 0.000 0.432 489 L N -2.933 118.157 121.223 -0.223 0.000 2.093 489 L HA -0.470 3.595 4.340 -0.459 0.000 0.208 489 L C 2.067 178.784 176.870 -0.254 0.000 1.085 489 L CA 3.006 57.606 54.840 -0.400 0.000 0.755 489 L CB -0.566 41.092 42.059 -0.668 0.000 0.904 489 L HN -0.287 7.804 8.230 -0.232 0.000 0.435 490 K N -0.422 119.885 120.400 -0.155 0.000 2.025 490 K HA -0.445 3.881 4.320 0.011 0.000 0.207 490 K C 1.953 178.589 176.600 0.060 0.000 1.049 490 K CA 3.550 59.807 56.287 -0.050 0.000 0.933 490 K CB -0.033 32.388 32.500 -0.131 0.000 0.714 490 K HN -0.453 7.696 8.250 -0.167 0.000 0.438 491 E N -2.788 117.419 120.200 0.011 0.000 2.077 491 E HA -0.313 4.101 4.350 0.107 0.000 0.193 491 E C 2.546 179.208 176.600 0.104 0.000 0.989 491 E CA 2.366 58.808 56.400 0.070 0.000 0.800 491 E CB -0.138 29.581 29.700 0.031 0.000 0.746 491 E HN -0.659 7.680 8.360 -0.034 0.000 0.452 492 Q N -4.291 115.544 119.800 0.058 0.000 2.389 492 Q HA -0.007 4.408 4.340 0.125 0.000 0.204 492 Q C 0.099 176.124 176.000 0.042 0.000 0.944 492 Q CA -0.489 55.369 55.803 0.091 0.000 0.908 492 Q CB 0.664 29.527 28.738 0.208 0.000 1.002 492 Q HN -0.512 7.766 8.270 0.012 0.000 0.493 493 A N -1.160 121.667 122.820 0.011 0.000 2.511 493 A HA -0.234 4.140 4.320 0.089 0.000 0.297 493 A C -1.570 176.101 177.584 0.144 0.000 1.476 493 A CA 0.377 52.460 52.037 0.076 0.000 0.757 493 A CB -1.825 17.207 19.000 0.053 0.000 1.072 493 A HN -0.247 7.907 8.150 0.006 0.000 0.413 494 P HA -0.083 4.480 4.420 0.238 0.000 0.225 494 P C -1.268 176.383 177.300 0.585 0.000 1.148 494 P CA 1.328 64.489 63.100 0.102 0.000 0.779 494 P CB 0.901 32.303 31.700 -0.496 0.000 0.780 495 W N -5.705 115.690 121.300 0.159 0.000 2.992 495 W HA 0.731 5.471 4.660 -0.097 -0.138 0.342 495 W C -0.225 176.349 176.519 0.090 0.000 1.176 495 W CA -2.436 54.943 57.345 0.056 0.000 1.118 495 W CB 3.354 32.871 29.460 0.094 0.000 1.457 495 W HN -0.705 7.644 8.180 0.355 0.044 0.573 496 I N 1.875 122.559 120.570 0.188 0.000 2.307 496 I HA 0.073 4.604 4.170 0.289 -0.188 0.289 496 I C -0.667 175.623 176.117 0.288 0.000 1.021 496 I CA -1.203 60.241 61.300 0.239 0.000 1.224 496 I CB 0.583 38.681 38.000 0.162 0.000 1.376 496 I HN 0.167 8.338 8.210 -0.066 0.000 0.470 497 N N 8.129 127.032 118.700 0.338 0.000 2.438 497 N HA -0.125 4.856 4.740 0.401 0.000 0.267 497 N C -0.242 175.358 175.510 0.149 0.000 1.222 497 N CA 1.093 54.324 53.050 0.302 0.000 0.930 497 N CB -0.193 38.444 38.487 0.251 0.000 1.083 497 N HN 0.485 9.064 8.380 0.332 0.000 0.476 498 V N 4.337 124.307 119.914 0.094 0.000 2.484 498 V HA -0.070 4.068 4.120 0.031 0.000 0.236 498 V C -0.699 175.333 176.094 -0.103 0.000 1.062 498 V CA 2.028 64.338 62.300 0.016 0.000 1.081 498 V CB 0.952 32.791 31.823 0.028 0.000 0.751 498 V HN 0.157 8.423 8.190 0.127 0.000 0.484 499 A N -5.515 117.198 122.820 -0.178 0.000 2.606 499 A HA 0.566 4.823 4.320 -0.389 -0.171 0.293 499 A C -2.577 174.776 177.584 -0.385 0.000 1.082 499 A CA -0.870 50.947 52.037 -0.367 0.000 0.685 499 A CB 2.960 21.579 19.000 -0.634 0.000 1.284 499 A HN -0.608 7.481 8.150 -0.101 0.000 0.408 500 H N 0.528 119.556 119.070 -0.070 0.000 2.466 500 H HA 0.826 5.558 4.556 0.078 -0.129 0.338 500 H C 0.277 175.576 175.328 -0.049 0.000 1.091 500 H CA -1.841 54.208 56.048 0.002 0.000 1.207 500 H CB 2.565 32.329 29.762 0.004 0.000 1.466 500 H HN 0.131 8.256 8.280 -0.258 0.000 0.493 501 S N 1.680 117.478 115.700 0.163 0.000 2.707 501 S HA 0.316 4.877 4.470 0.151 0.000 0.276 501 S C -0.758 173.893 174.600 0.084 0.000 1.179 501 S CA -1.355 56.952 58.200 0.179 0.000 0.992 501 S CB 1.719 65.110 63.200 0.318 0.000 1.030 501 S HN 0.129 8.843 8.310 0.210 -0.277 0.554 502 I N -0.486 120.109 120.570 0.041 0.000 2.353 502 I HA 0.208 4.387 4.170 -0.169 -0.111 0.293 502 I C -0.234 175.721 176.117 -0.268 0.000 0.992 502 I CA -2.336 58.852 61.300 -0.187 0.000 1.268 502 I CB -0.409 37.365 38.000 -0.377 0.000 1.387 502 I HN -0.498 7.786 8.210 0.123 0.000 0.478 503 N N 7.556 126.088 118.700 -0.281 0.000 2.444 503 N HA 0.055 4.749 4.740 -0.078 0.000 0.271 503 N C -1.694 173.609 175.510 -0.345 0.000 1.069 503 N CA -0.015 52.919 53.050 -0.194 0.000 0.965 503 N CB 1.299 39.725 38.487 -0.102 0.000 1.092 503 N HN 0.251 8.484 8.380 -0.246 0.000 0.476 504 F N 2.139 122.108 119.950 0.032 0.000 2.480 504 F HA 0.488 5.234 4.527 0.060 -0.182 0.329 504 F C -0.778 175.035 175.800 0.022 0.000 1.091 504 F CA -1.712 56.309 58.000 0.035 0.000 0.972 504 F CB 3.362 42.373 39.000 0.018 0.000 1.150 504 F HN 0.298 8.680 8.300 0.136 0.000 0.467 505 A N 1.987 124.981 122.820 0.290 0.000 2.646 505 A HA 0.758 5.148 4.320 0.117 0.000 0.312 505 A C -3.010 174.714 177.584 0.233 0.000 1.245 505 A CA -2.993 49.172 52.037 0.213 0.000 0.755 505 A CB 1.195 20.360 19.000 0.276 0.000 1.132 505 A HN 0.583 8.941 8.150 0.346 0.000 0.458 506 P HA 0.305 4.778 4.420 0.087 0.000 0.287 506 P C -1.290 176.035 177.300 0.040 0.000 1.281 506 P CA -0.617 62.527 63.100 0.073 0.000 0.781 506 P CB 0.079 31.789 31.700 0.015 0.000 0.903 507 T N -0.417 114.167 114.554 0.050 0.000 2.916 507 T HA 0.663 5.151 4.350 -0.053 -0.170 0.292 507 T C -0.117 174.569 174.700 -0.024 0.000 1.064 507 T CA -3.071 59.029 62.100 0.000 0.000 1.011 507 T CB 3.241 72.145 68.868 0.061 0.000 1.152 507 T HN 0.111 8.387 8.240 0.060 0.000 0.510 508 S N 0.756 116.409 115.700 -0.078 0.000 2.624 508 S HA 0.202 4.637 4.470 -0.059 0.000 0.263 508 S C 1.786 176.364 174.600 -0.037 0.000 1.287 508 S CA -0.769 57.386 58.200 -0.075 0.000 0.990 508 S CB 1.495 64.618 63.200 -0.130 0.000 0.950 508 S HN 0.007 8.239 8.310 -0.130 0.000 0.561 509 K N 0.052 120.433 120.400 -0.032 0.000 2.288 509 K HA -0.204 4.117 4.320 0.001 0.000 0.201 509 K C 0.983 177.583 176.600 0.000 0.000 1.048 509 K CA 1.464 57.745 56.287 -0.010 0.000 0.956 509 K CB -0.412 32.079 32.500 -0.015 0.000 0.746 509 K HN 0.642 8.868 8.250 -0.041 0.000 0.461 510 R N -5.054 115.435 120.500 -0.018 0.000 2.275 510 R HA -0.079 4.263 4.340 0.005 0.000 0.199 510 R C -0.085 176.229 176.300 0.024 0.000 0.989 510 R CA 0.587 56.684 56.100 -0.006 0.000 1.016 510 R CB -0.354 29.929 30.300 -0.028 0.000 0.918 510 R HN -0.308 7.906 8.270 -0.040 0.032 0.473 511 V N 1.464 121.398 119.914 0.035 0.000 2.572 511 V HA -0.125 4.208 4.120 0.133 -0.133 0.291 511 V C -0.357 175.823 176.094 0.143 0.000 1.039 511 V CA 1.128 63.496 62.300 0.113 0.000 1.055 511 V CB 0.157 32.064 31.823 0.140 0.000 0.969 511 V HN -0.830 7.332 8.190 0.011 0.035 0.482 512 Q N 8.021 127.910 119.800 0.149 0.000 2.375 512 Q HA 0.254 4.674 4.340 0.134 0.000 0.271 512 Q C -0.623 175.458 176.000 0.135 0.000 1.074 512 Q CA -1.277 54.603 55.803 0.128 0.000 0.808 512 Q CB 3.687 32.474 28.738 0.082 0.000 1.327 512 Q HN 0.314 8.676 8.270 0.154 0.000 0.441 513 D N -1.440 119.033 120.400 0.122 0.000 3.076 513 D HA -0.393 4.287 4.640 0.067 0.000 0.218 513 D C -1.424 174.926 176.300 0.084 0.000 1.156 513 D CA 1.656 55.704 54.000 0.081 0.000 0.921 513 D CB -0.897 39.928 40.800 0.041 0.000 1.113 513 D HN 0.505 8.950 8.370 0.125 0.000 0.418 514 Y N -0.866 119.438 120.300 0.007 0.000 2.411 514 Y HA 0.022 4.541 4.550 -0.051 0.000 0.333 514 Y C -0.504 175.302 175.900 -0.158 0.000 1.186 514 Y CA 0.669 58.728 58.100 -0.068 0.000 1.381 514 Y CB 0.704 39.123 38.460 -0.068 0.000 1.273 514 Y HN -0.403 8.001 8.280 0.273 0.039 0.546 515 K N 7.184 126.930 120.400 -1.090 0.000 2.443 515 K HA 0.296 4.202 4.320 -0.690 0.000 0.252 515 K C -1.203 174.744 176.600 -1.088 0.000 0.933 515 K CA -1.550 54.230 56.287 -0.844 0.000 0.792 515 K CB 2.545 34.826 32.500 -0.365 0.000 1.185 515 K HN 0.290 7.850 8.250 -1.151 0.000 0.425 516 Q N 3.276 122.666 119.800 -0.684 0.000 2.361 516 Q HA -0.195 3.976 4.340 -0.282 0.000 0.276 516 Q C 0.106 175.959 176.000 -0.245 0.000 1.022 516 Q CA 0.458 56.061 55.803 -0.334 0.000 0.898 516 Q CB 0.861 29.515 28.738 -0.141 0.000 1.246 516 Q HN 0.281 8.222 8.270 -0.548 0.000 0.410 517 S N 2.159 117.771 115.700 -0.147 0.000 2.565 517 S HA 0.228 4.565 4.470 -0.221 0.000 0.276 517 S C 0.526 174.951 174.600 -0.291 0.000 1.326 517 S CA -3.244 54.848 58.200 -0.180 0.000 1.045 517 S CB 0.387 63.589 63.200 0.004 0.000 0.918 517 S HN 0.197 8.462 8.310 -0.075 0.000 0.505 518 P HA -0.052 4.177 4.420 -0.318 0.000 0.222 518 P C -0.509 176.541 177.300 -0.417 0.000 1.147 518 P CA 1.675 64.460 63.100 -0.526 0.000 0.790 518 P CB 0.160 31.415 31.700 -0.742 0.000 0.780 519 F N -5.701 114.185 119.950 -0.107 0.000 2.776 519 F HA 0.185 4.625 4.527 -0.146 0.000 0.300 519 F C 1.440 177.035 175.800 -0.341 0.000 1.116 519 F CA -1.669 56.224 58.000 -0.179 0.000 1.375 519 F CB -0.065 38.868 39.000 -0.112 0.000 1.109 519 F HN -0.662 7.174 8.300 -0.719 0.033 0.585 520 G N -2.443 106.266 108.800 -0.151 0.000 2.218 520 G HA2 -0.348 3.546 3.960 -0.111 0.000 0.216 520 G HA3 -0.348 3.478 3.960 -0.224 0.000 0.216 520 G C -0.986 173.825 174.900 -0.149 0.000 0.994 520 G CA -0.151 44.841 45.100 -0.180 0.000 0.637 520 G HN -0.478 7.620 8.290 -0.127 0.117 0.505 521 Y N 0.329 120.696 120.300 0.112 0.000 2.426 521 Y HA -0.207 4.517 4.550 0.142 -0.089 0.344 521 Y C -0.024 175.962 175.900 0.145 0.000 1.256 521 Y CA 0.509 58.697 58.100 0.146 0.000 1.451 521 Y CB 0.124 38.703 38.460 0.199 0.000 1.342 521 Y HN -0.856 7.382 8.280 -0.069 0.000 0.600 522 T N 3.336 118.094 114.554 0.341 0.000 2.811 522 T HA 0.094 4.616 4.350 0.288 0.000 0.309 522 T C -1.606 173.278 174.700 0.305 0.000 1.005 522 T CA -0.184 62.071 62.100 0.259 0.000 0.955 522 T CB 0.322 69.243 68.868 0.088 0.000 0.970 522 T HN -0.076 8.727 8.240 0.370 -0.341 0.496 523 Y N 8.558 128.966 120.300 0.180 0.000 2.328 523 Y HA 0.090 4.718 4.550 0.130 0.000 0.333 523 Y C -1.951 174.029 175.900 0.133 0.000 0.958 523 Y CA -0.314 57.870 58.100 0.141 0.000 1.167 523 Y CB 1.849 40.388 38.460 0.132 0.000 1.151 523 Y HN 0.233 8.754 8.280 0.402 0.000 0.470 524 L N 5.818 126.817 121.223 -0.373 0.000 2.731 524 L HA 0.167 4.420 4.340 -0.144 0.000 0.240 524 L C -0.727 176.055 176.870 -0.146 0.000 1.120 524 L CA -0.761 53.918 54.840 -0.268 0.000 0.913 524 L CB 1.109 42.873 42.059 -0.491 0.000 1.213 524 L HN 0.450 8.382 8.230 -0.497 0.000 0.515 525 Y N 0.964 120.984 120.300 -0.467 0.000 2.544 525 Y HA -0.269 4.207 4.550 -0.124 0.000 0.330 525 Y C 0.564 176.394 175.900 -0.117 0.000 1.136 525 Y CA 2.430 60.360 58.100 -0.283 0.000 1.417 525 Y CB 0.184 38.380 38.460 -0.441 0.000 1.229 525 Y HN -0.440 7.397 8.280 -0.739 0.000 0.532 526 G N 6.206 114.654 108.800 -0.587 0.000 2.213 526 G HA2 -0.391 3.283 3.960 -0.477 0.000 0.236 526 G HA3 -0.391 3.413 3.960 -0.260 0.000 0.236 526 G C -0.663 174.152 174.900 -0.141 0.000 0.991 526 G CA -0.315 44.561 45.100 -0.373 0.000 0.629 526 G HN 0.209 8.084 8.290 -0.692 0.000 0.517 527 T N 4.392 118.901 114.554 -0.074 0.000 2.913 527 T HA 0.143 4.635 4.350 0.053 -0.110 0.287 527 T C -1.530 173.189 174.700 0.030 0.000 1.008 527 T CA 1.958 64.075 62.100 0.027 0.000 1.067 527 T CB 1.522 70.435 68.868 0.075 0.000 0.996 527 T HN -0.519 7.602 8.240 -0.090 0.065 0.513 528 K N 2.047 122.493 120.400 0.077 0.000 2.395 528 K HA 0.439 4.799 4.320 0.067 0.000 0.245 528 K C -1.654 175.017 176.600 0.118 0.000 1.017 528 K CA -2.268 54.064 56.287 0.075 0.000 0.852 528 K CB 3.988 36.512 32.500 0.039 0.000 1.311 528 K HN 0.293 8.603 8.250 0.100 0.000 0.452 529 L N -0.368 120.912 121.223 0.096 0.000 2.381 529 L HA 0.655 5.216 4.340 0.086 -0.170 0.274 529 L C -0.411 176.487 176.870 0.047 0.000 0.988 529 L CA -1.248 53.640 54.840 0.081 0.000 0.824 529 L CB 2.797 44.907 42.059 0.085 0.000 1.263 529 L HN 0.353 8.630 8.230 0.079 0.000 0.410 530 A N 3.965 126.807 122.820 0.035 0.000 2.259 530 A HA 0.167 4.500 4.320 0.023 0.000 0.278 530 A C -1.963 175.628 177.584 0.011 0.000 1.107 530 A CA -0.934 51.117 52.037 0.022 0.000 0.828 530 A CB 1.544 20.556 19.000 0.021 0.000 1.111 530 A HN 0.257 8.429 8.150 0.037 0.000 0.498 531 D N 0.000 120.404 120.400 0.007 0.000 6.856 531 D HA 0.000 4.640 4.640 -0.000 0.000 0.175 531 D CA 0.000 54.001 54.000 0.001 0.000 0.868 531 D CB 0.000 40.801 40.800 0.002 0.000 0.688 531 D HN 0.000 8.375 8.370 0.009 0.000 0.683