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 2p9l_1_A DATA FIRST_RESID 2 DATA SEQUENCE AGRLPACVVD CGTGYTKLGY AGNTEPQFII PSCIAIKEXX XXXXXXXXXV DATA SEQUENCE MKGVDDLDFF IGDEAIEKPT YATKWPIRHG IVEDWDLMER FMEQVIFKYL DATA SEQUENCE RAEPEDHYFL LTEPPLNTPE NREYTAEIMF ESFNVPGLYI AVQAVLALAA DATA SEQUENCE SWTSXQVGER TLTGTVIDSG DGVTHVIPVA EGYVIGSCIK HIPIAGRDIT DATA SEQUENCE YFIQQLLRDR EVGIPPEQSL ETAKAVKERY SYVCPDLVKE FNKYDTDGSK DATA SEQUENCE WIKQYTGINA ISKKEFSIDV GYERFLGPEI FFHPEFANPD FTQPISEVVD DATA SEQUENCE EVIQNCPIDV RRPLYKNIVL SGGSTMFRDF GRRLQRDLKR TVDARLKLSE DATA SEQUENCE ELSXXXXKPK PIDVQVITHH MQRYAVWFGG SMLASTPEFY QVCHTKKDYE DATA SEQUENCE EIGPSICRHN PVFGV VARS RESID RESNAME ATOMNAME SS_SHIFT SHIFT RC_SHIFT HM_SHIFT EF_SHIFT SIGMA FORMAT %4d %4s %4s %9.3f %9.3f %9.3f %9.3f %9.3f %9.3f 2 A HA 0.000 4.320 4.320 0.000 0.000 0.244 2 A C 0.000 177.304 177.584 -0.466 0.000 1.274 2 A CA 0.000 51.499 52.037 -0.897 0.000 0.836 2 A CB 0.000 18.748 19.000 -0.419 0.000 0.831 3 G N 0.782 109.351 108.800 -0.386 0.000 2.531 3 G HA2 0.477 4.436 3.960 -0.001 0.000 0.253 3 G HA3 0.477 4.436 3.960 -0.001 0.000 0.253 3 G C 0.729 175.550 174.900 -0.132 0.000 1.439 3 G CA 0.103 45.080 45.100 -0.205 0.000 1.056 3 G HN 1.225 9.515 8.290 0.000 0.000 0.555 4 R N -1.269 119.177 120.500 -0.091 0.000 2.189 4 R HA 0.166 4.505 4.340 -0.001 0.000 0.218 4 R C 0.709 176.979 176.300 -0.051 0.000 1.074 4 R CA 0.613 56.674 56.100 -0.065 0.000 0.991 4 R CB -0.538 29.731 30.300 -0.051 0.000 0.883 4 R HN 0.212 8.482 8.270 0.000 0.000 0.457 5 L N 3.102 124.290 121.223 -0.057 0.000 2.295 5 L HA 0.491 4.830 4.340 -0.001 0.000 0.285 5 L C -2.022 174.896 176.870 0.080 0.000 1.035 5 L CA -2.576 52.252 54.840 -0.019 0.000 0.806 5 L CB 1.385 43.346 42.059 -0.163 0.000 1.214 5 L HN 0.058 8.288 8.230 0.000 0.000 0.426 6 P HA 0.188 4.608 4.420 0.000 0.000 0.275 6 P C -0.450 177.075 177.300 0.376 0.000 1.227 6 P CA -0.393 62.842 63.100 0.224 0.000 0.781 6 P CB 1.305 33.105 31.700 0.166 0.000 0.906 7 A N 2.737 125.700 122.820 0.238 0.000 2.475 7 A HA 0.134 4.454 4.320 -0.001 0.000 0.239 7 A C 0.277 177.802 177.584 -0.098 0.000 1.087 7 A CA -0.099 52.007 52.037 0.115 0.000 0.779 7 A CB -0.346 18.613 19.000 -0.068 0.000 1.036 7 A HN 0.686 8.836 8.150 0.000 0.000 0.506 8 C N 0.936 119.976 119.300 -0.433 0.000 2.330 8 C HA 0.545 5.005 4.460 -0.001 0.000 0.344 8 C C 0.108 174.839 174.990 -0.431 0.000 1.273 8 C CA -0.433 58.149 59.018 -0.727 0.000 1.879 8 C CB 0.116 26.960 27.740 -1.494 0.000 2.376 8 C HN 0.547 8.777 8.230 0.000 0.000 0.534 9 V N 4.984 124.746 119.914 -0.253 0.000 2.350 9 V HA 0.418 4.537 4.120 -0.001 0.000 0.285 9 V C -0.315 175.874 176.094 0.158 0.000 1.014 9 V CA -0.284 61.924 62.300 -0.154 0.000 0.831 9 V CB 1.407 32.927 31.823 -0.505 0.000 1.000 9 V HN 0.681 8.871 8.190 0.000 0.000 0.433 10 V N 3.869 123.873 119.914 0.149 0.000 2.376 10 V HA 0.404 4.523 4.120 -0.001 0.000 0.287 10 V C -0.605 175.622 176.094 0.222 0.000 1.015 10 V CA -0.462 61.977 62.300 0.232 0.000 0.834 10 V CB 1.872 33.820 31.823 0.209 0.000 1.001 10 V HN 0.916 9.106 8.190 0.000 0.000 0.428 11 D N 4.026 124.607 120.400 0.302 0.000 2.473 11 D HA 0.261 4.901 4.640 -0.001 0.000 0.226 11 D C -0.385 176.019 176.300 0.173 0.000 1.089 11 D CA -0.176 53.962 54.000 0.230 0.000 0.883 11 D CB 0.878 41.865 40.800 0.313 0.000 1.029 11 D HN 0.476 8.846 8.370 0.000 0.000 0.517 12 C N 4.256 123.625 119.300 0.114 0.000 2.289 12 C HA 0.733 5.193 4.460 -0.001 0.000 0.340 12 C C 1.120 176.123 174.990 0.022 0.000 1.152 12 C CA -0.456 58.592 59.018 0.049 0.000 1.650 12 C CB -0.639 27.094 27.740 -0.012 0.000 2.203 12 C HN 0.663 8.893 8.230 0.000 0.000 0.511 13 G N 2.824 111.652 108.800 0.047 0.000 2.511 13 G HA2 0.404 4.363 3.960 -0.001 0.000 0.316 13 G HA3 0.404 4.363 3.960 -0.001 0.000 0.316 13 G C 0.874 175.778 174.900 0.006 0.000 1.210 13 G CA -0.115 45.013 45.100 0.047 0.000 0.969 13 G HN 0.559 8.849 8.290 0.000 0.000 0.492 14 T N 0.156 114.713 114.554 0.004 0.000 2.788 14 T HA -0.057 4.293 4.350 -0.001 0.000 0.268 14 T C 2.221 176.917 174.700 -0.006 0.000 1.044 14 T CA 1.934 64.018 62.100 -0.026 0.000 1.139 14 T CB -0.154 68.686 68.868 -0.047 0.000 0.867 14 T HN 0.601 8.841 8.240 0.000 0.000 0.454 15 G N -1.511 107.305 108.800 0.027 0.000 2.720 15 G HA2 0.299 4.259 3.960 -0.001 0.000 0.204 15 G HA3 0.299 4.259 3.960 -0.001 0.000 0.204 15 G C -0.104 174.703 174.900 -0.155 0.000 1.113 15 G CA -0.157 44.930 45.100 -0.021 0.000 0.805 15 G HN 0.402 8.692 8.290 0.000 0.000 0.536 16 Y N -0.227 120.134 120.300 0.101 0.000 2.545 16 Y HA 0.604 5.153 4.550 -0.001 0.000 0.348 16 Y C -0.420 175.522 175.900 0.071 0.000 1.002 16 Y CA -0.732 57.429 58.100 0.101 0.000 1.039 16 Y CB 2.450 40.974 38.460 0.107 0.000 1.271 16 Y HN -0.185 8.095 8.280 0.000 0.000 0.467 17 T N 2.927 117.618 114.554 0.227 0.000 2.786 17 T HA 0.425 4.775 4.350 -0.001 0.000 0.283 17 T C -0.907 173.855 174.700 0.102 0.000 0.992 17 T CA -0.933 61.267 62.100 0.166 0.000 0.954 17 T CB 0.559 69.564 68.868 0.228 0.000 0.934 17 T HN 0.220 8.460 8.240 0.000 0.000 0.440 18 K N 3.363 123.802 120.400 0.065 0.000 2.240 18 K HA 0.695 5.015 4.320 -0.001 0.000 0.271 18 K C -0.707 175.848 176.600 -0.074 0.000 1.018 18 K CA -0.593 55.603 56.287 -0.152 0.000 0.874 18 K CB 0.665 33.030 32.500 -0.226 0.000 1.098 18 K HN 0.523 8.773 8.250 0.000 0.000 0.458 19 L N -0.556 120.549 121.223 -0.196 0.000 2.409 19 L HA 1.013 5.352 4.340 -0.001 0.000 0.262 19 L C 0.081 176.928 176.870 -0.038 0.000 0.992 19 L CA -0.661 54.194 54.840 0.025 0.000 0.817 19 L CB 2.427 44.510 42.059 0.040 0.000 1.350 19 L HN 0.579 8.809 8.230 0.000 0.000 0.411 20 G N -0.000 108.905 108.800 0.175 0.000 2.348 20 G HA2 0.403 4.362 3.960 -0.001 0.000 0.296 20 G HA3 0.403 4.362 3.960 -0.001 0.000 0.296 20 G C -2.275 172.675 174.900 0.082 0.000 1.258 20 G CA -0.671 44.522 45.100 0.155 0.000 0.868 20 G HN 0.505 8.795 8.290 0.000 0.000 0.488 21 Y N 0.439 120.897 120.300 0.264 0.000 2.487 21 Y HA 0.672 5.222 4.550 -0.001 0.000 0.337 21 Y C 0.919 176.870 175.900 0.084 0.000 1.076 21 Y CA 0.026 58.186 58.100 0.100 0.000 1.115 21 Y CB 2.033 40.516 38.460 0.038 0.000 1.235 21 Y HN 0.770 9.050 8.280 0.000 0.000 0.468 22 A N 0.947 123.811 122.820 0.072 0.000 2.477 22 A HA 0.461 4.780 4.320 -0.001 0.000 0.246 22 A C 1.229 178.803 177.584 -0.016 0.000 1.078 22 A CA 0.831 52.802 52.037 -0.110 0.000 0.770 22 A CB -0.836 18.031 19.000 -0.221 0.000 1.011 22 A HN 1.445 9.595 8.150 0.000 0.000 0.494 23 G N 1.987 110.747 108.800 -0.067 0.000 2.284 23 G HA2 -0.204 3.755 3.960 -0.001 0.000 0.216 23 G HA3 -0.204 3.755 3.960 -0.001 0.000 0.216 23 G C 0.245 175.189 174.900 0.073 0.000 1.009 23 G CA 0.045 45.141 45.100 -0.006 0.000 0.625 23 G HN 0.782 9.072 8.290 0.000 0.000 0.501 24 N N 0.750 119.551 118.700 0.167 0.000 2.503 24 N HA 0.381 5.121 4.740 -0.001 0.000 0.267 24 N C 1.036 176.764 175.510 0.364 0.000 1.214 24 N CA 0.748 53.947 53.050 0.249 0.000 0.959 24 N CB 1.166 39.834 38.487 0.301 0.000 1.142 24 N HN 0.129 8.509 8.380 0.000 0.000 0.455 25 T N 0.350 115.107 114.554 0.338 0.000 3.043 25 T HA 0.041 4.390 4.350 -0.001 0.000 0.263 25 T C 0.265 175.266 174.700 0.501 0.000 1.094 25 T CA 0.924 63.312 62.100 0.480 0.000 1.127 25 T CB 0.239 69.288 68.868 0.302 0.000 0.905 25 T HN 0.410 8.650 8.240 0.000 0.000 0.490 26 E N 0.597 120.961 120.200 0.274 0.000 2.392 26 E HA 0.408 4.758 4.350 -0.001 0.000 0.269 26 E C -2.902 173.418 176.600 -0.467 0.000 0.924 26 E CA -2.521 53.888 56.400 0.016 0.000 0.784 26 E CB 1.630 31.300 29.700 -0.050 0.000 1.292 26 E HN -0.034 8.326 8.360 0.000 0.000 0.447 27 P HA 0.175 4.595 4.420 0.000 0.000 0.274 27 P C 0.200 177.075 177.300 -0.708 0.000 1.231 27 P CA -0.108 62.115 63.100 -1.462 0.000 0.790 27 P CB 0.741 31.529 31.700 -1.520 0.000 0.951 28 Q N 0.208 119.696 119.800 -0.519 0.000 2.331 28 Q HA 0.208 4.547 4.340 -0.001 0.000 0.203 28 Q C -0.388 175.064 176.000 -0.913 0.000 0.944 28 Q CA 1.238 56.708 55.803 -0.555 0.000 0.892 28 Q CB -0.144 28.383 28.738 -0.352 0.000 0.983 28 Q HN 0.447 8.717 8.270 0.000 0.000 0.482 29 F N -0.841 118.935 119.950 -0.290 0.000 2.596 29 F HA 0.481 5.007 4.527 -0.001 0.000 0.311 29 F C -0.782 174.822 175.800 -0.327 0.000 1.116 29 F CA -0.974 56.877 58.000 -0.248 0.000 0.957 29 F CB 1.611 40.486 39.000 -0.208 0.000 1.250 29 F HN -0.306 7.994 8.300 0.000 0.000 0.444 30 I N 5.410 125.922 120.570 -0.097 0.000 2.466 30 I HA 0.514 4.683 4.170 -0.001 0.000 0.279 30 I C -0.811 175.354 176.117 0.080 0.000 1.033 30 I CA -0.483 60.739 61.300 -0.131 0.000 1.123 30 I CB 1.180 38.992 38.000 -0.313 0.000 1.237 30 I HN 0.511 8.721 8.210 0.000 0.000 0.460 31 I N 3.394 124.053 120.570 0.148 0.000 2.934 31 I HA 0.716 4.885 4.170 -0.001 0.000 0.306 31 I C -2.839 173.392 176.117 0.191 0.000 1.110 31 I CA -2.887 58.520 61.300 0.179 0.000 1.019 31 I CB 2.363 40.333 38.000 -0.049 0.000 1.227 31 I HN 0.114 8.324 8.210 0.000 0.000 0.434 32 P HA 0.039 4.459 4.420 0.000 0.000 0.262 32 P C -0.345 176.898 177.300 -0.094 0.000 1.182 32 P CA 0.215 63.159 63.100 -0.261 0.000 0.761 32 P CB 0.512 32.128 31.700 -0.141 0.000 0.795 33 S N 2.059 117.697 115.700 -0.104 0.000 3.870 33 S HA 0.145 4.614 4.470 -0.001 0.000 0.198 33 S C 0.541 174.889 174.600 -0.419 0.000 1.336 33 S CA -0.309 57.754 58.200 -0.230 0.000 1.049 33 S CB -1.327 61.768 63.200 -0.175 0.000 1.412 33 S HN 0.571 8.881 8.310 0.000 0.000 0.448 34 C N 0.114 119.141 119.300 -0.455 0.000 2.802 34 C HA 0.864 5.323 4.460 -0.001 0.000 0.307 34 C C -0.479 174.365 174.990 -0.244 0.000 1.222 34 C CA -1.385 57.159 59.018 -0.790 0.000 1.580 34 C CB 0.513 27.172 27.740 -1.803 0.000 2.119 34 C HN 0.566 8.796 8.230 0.000 0.000 0.479 35 I N 1.995 122.416 120.570 -0.249 0.000 2.582 35 I HA 0.713 4.882 4.170 -0.001 0.000 0.292 35 I C -0.228 175.861 176.117 -0.046 0.000 1.066 35 I CA -0.510 60.778 61.300 -0.019 0.000 1.053 35 I CB 1.905 39.908 38.000 0.005 0.000 1.241 35 I HN 1.151 9.361 8.210 0.000 0.000 0.421 36 A N 7.731 130.607 122.820 0.092 0.000 2.304 36 A HA 0.781 5.101 4.320 -0.001 0.000 0.323 36 A C -0.774 176.998 177.584 0.312 0.000 1.195 36 A CA -0.446 51.680 52.037 0.148 0.000 0.826 36 A CB 0.809 19.885 19.000 0.126 0.000 1.184 36 A HN 0.705 8.855 8.150 0.000 0.000 0.496 37 I N -1.112 119.642 120.570 0.308 0.000 3.239 37 I HA 0.663 4.833 4.170 -0.001 0.000 0.314 37 I C -0.576 175.714 176.117 0.289 0.000 1.126 37 I CA -1.062 60.451 61.300 0.355 0.000 0.973 37 I CB 1.705 39.806 38.000 0.167 0.000 1.252 37 I HN 0.412 8.622 8.210 0.000 0.000 0.463 38 K N 1.600 122.100 120.400 0.166 0.000 2.213 38 K HA 0.623 4.943 4.320 -0.001 0.000 0.270 38 K C -0.956 175.648 176.600 0.007 0.000 1.002 38 K CA -0.454 55.822 56.287 -0.020 0.000 0.868 38 K CB 1.248 33.673 32.500 -0.124 0.000 1.093 38 K HN 0.855 9.105 8.250 0.000 0.000 0.454 52 M N 5.182 124.788 119.600 0.010 0.000 2.105 52 M HA 0.477 4.956 4.480 -0.001 0.000 0.350 52 M C -0.239 176.068 176.300 0.012 0.000 1.308 52 M CA -0.100 55.209 55.300 0.014 0.000 1.108 52 M CB 0.916 33.528 32.600 0.019 0.000 1.622 52 M HN 0.740 9.030 8.290 0.000 0.000 0.468 53 K N 1.909 122.316 120.400 0.012 0.000 2.427 53 K HA 0.862 5.182 4.320 -0.001 0.000 0.252 53 K C 0.223 176.830 176.600 0.010 0.000 0.931 53 K CA -0.567 55.725 56.287 0.009 0.000 0.793 53 K CB 2.160 34.664 32.500 0.006 0.000 1.211 53 K HN 0.730 8.980 8.250 0.000 0.000 0.426 54 G N 0.991 109.796 108.800 0.008 0.000 2.972 54 G HA2 -0.278 3.681 3.960 -0.001 0.000 0.265 54 G HA3 -0.278 3.681 3.960 -0.001 0.000 0.265 54 G C -0.131 174.775 174.900 0.009 0.000 1.506 54 G CA -0.054 45.050 45.100 0.007 0.000 1.016 54 G HN 0.731 9.021 8.290 0.000 0.000 0.563 55 V N 2.071 121.992 119.914 0.013 0.000 2.967 55 V HA 0.273 4.393 4.120 -0.001 0.000 0.364 55 V C 0.754 176.867 176.094 0.033 0.000 1.373 55 V CA 0.590 62.900 62.300 0.016 0.000 1.193 55 V CB 0.925 32.747 31.823 -0.001 0.000 1.236 55 V HN 0.599 8.789 8.190 0.000 0.000 0.582 56 D N 1.478 121.902 120.400 0.041 0.000 2.269 56 D HA -0.151 4.489 4.640 -0.001 0.000 0.208 56 D C 1.779 178.140 176.300 0.102 0.000 0.963 56 D CA 1.481 55.518 54.000 0.062 0.000 0.864 56 D CB 0.106 40.935 40.800 0.047 0.000 0.936 56 D HN 0.675 9.045 8.370 0.000 0.000 0.505 57 D N 1.084 121.542 120.400 0.096 0.000 2.218 57 D HA -0.156 4.483 4.640 -0.001 0.000 0.204 57 D C 2.027 178.492 176.300 0.275 0.000 0.976 57 D CA 0.485 54.567 54.000 0.136 0.000 0.853 57 D CB -0.396 40.456 40.800 0.087 0.000 0.939 57 D HN 0.287 8.657 8.370 0.000 0.000 0.481 58 L N 0.239 121.576 121.223 0.189 0.000 2.509 58 L HA 0.035 4.375 4.340 -0.001 0.000 0.222 58 L C 0.934 177.762 176.870 -0.070 0.000 1.123 58 L CA 0.052 54.963 54.840 0.119 0.000 0.856 58 L CB -0.226 41.814 42.059 -0.031 0.000 0.985 58 L HN -0.146 8.084 8.230 0.000 0.000 0.456 59 D N 1.442 121.892 120.400 0.083 0.000 2.545 59 D HA 0.138 4.777 4.640 -0.001 0.000 0.227 59 D C -0.436 176.003 176.300 0.232 0.000 1.150 59 D CA 0.065 54.113 54.000 0.081 0.000 1.046 59 D CB -0.388 40.526 40.800 0.190 0.000 1.098 59 D HN 0.117 8.487 8.370 0.000 0.000 0.502 60 F N 0.015 119.865 119.950 -0.168 0.000 2.745 60 F HA 0.708 5.235 4.527 -0.001 0.000 0.316 60 F C -1.713 173.744 175.800 -0.573 0.000 1.155 60 F CA -1.478 56.435 58.000 -0.145 0.000 0.937 60 F CB 0.924 39.910 39.000 -0.025 0.000 1.361 60 F HN -0.155 8.145 8.300 0.000 0.000 0.472 61 F N 1.429 121.437 119.950 0.097 0.000 2.613 61 F HA 0.789 5.315 4.527 -0.001 0.000 0.314 61 F C -0.299 175.567 175.800 0.109 0.000 1.075 61 F CA -1.068 56.910 58.000 -0.036 0.000 0.945 61 F CB 2.372 41.245 39.000 -0.211 0.000 1.310 61 F HN 0.733 9.033 8.300 0.000 0.000 0.467 62 I N -0.943 119.754 120.570 0.212 0.000 3.174 62 I HA 0.992 5.162 4.170 -0.001 0.000 0.313 62 I C 0.246 176.374 176.117 0.018 0.000 1.155 62 I CA -0.754 60.597 61.300 0.086 0.000 0.977 62 I CB 1.744 39.646 38.000 -0.163 0.000 1.248 62 I HN 0.870 9.080 8.210 0.000 0.000 0.453 63 G N 2.548 111.344 108.800 -0.006 0.000 2.575 63 G HA2 -0.260 3.699 3.960 -0.001 0.000 0.267 63 G HA3 -0.260 3.699 3.960 -0.001 0.000 0.267 63 G C 0.305 175.200 174.900 -0.010 0.000 1.264 63 G CA 0.602 45.680 45.100 -0.036 0.000 0.935 63 G HN 0.876 9.166 8.290 0.000 0.000 0.568 64 D N 0.712 121.128 120.400 0.027 0.000 2.149 64 D HA -0.109 4.531 4.640 -0.001 0.000 0.194 64 D C 2.081 178.398 176.300 0.028 0.000 1.001 64 D CA 1.782 55.813 54.000 0.051 0.000 0.849 64 D CB -0.176 40.671 40.800 0.078 0.000 0.939 64 D HN 0.722 9.092 8.370 0.000 0.000 0.449 65 E N -0.001 120.224 120.200 0.042 0.000 2.510 65 E HA -0.009 4.341 4.350 -0.001 0.000 0.202 65 E C 1.229 177.792 176.600 -0.060 0.000 1.072 65 E CA 0.267 56.666 56.400 -0.001 0.000 0.883 65 E CB 0.132 29.897 29.700 0.108 0.000 0.818 65 E HN 0.209 8.569 8.360 0.000 0.000 0.548 66 A N -0.178 122.632 122.820 -0.016 0.000 2.469 66 A HA 0.224 4.544 4.320 -0.001 0.000 0.245 66 A C 1.599 179.155 177.584 -0.046 0.000 1.221 66 A CA -0.355 51.664 52.037 -0.030 0.000 0.946 66 A CB 0.234 19.239 19.000 0.008 0.000 1.049 66 A HN 0.085 8.235 8.150 0.000 0.000 0.529 67 I N -0.229 120.329 120.570 -0.019 0.000 2.133 67 I HA -0.084 4.086 4.170 -0.001 0.000 0.238 67 I C 0.906 177.053 176.117 0.050 0.000 1.074 67 I CA 1.051 62.373 61.300 0.037 0.000 1.342 67 I CB 0.145 38.192 38.000 0.079 0.000 1.053 67 I HN 0.164 8.374 8.210 0.000 0.000 0.404 68 E N 1.472 121.686 120.200 0.024 0.000 3.105 68 E HA 0.147 4.496 4.350 -0.001 0.000 0.219 68 E C -0.508 176.093 176.600 0.002 0.000 1.064 68 E CA -0.145 56.272 56.400 0.029 0.000 1.342 68 E CB 0.325 30.045 29.700 0.032 0.000 1.295 68 E HN 0.118 8.478 8.360 0.000 0.000 0.438 69 K N 1.654 122.046 120.400 -0.013 0.000 2.363 69 K HA 0.110 4.430 4.320 -0.001 0.000 0.289 69 K C -1.773 174.891 176.600 0.106 0.000 1.063 69 K CA -1.692 54.578 56.287 -0.028 0.000 0.967 69 K CB 0.941 33.361 32.500 -0.134 0.000 0.987 69 K HN -0.059 8.191 8.250 0.000 0.000 0.473 70 P HA -0.231 4.189 4.420 0.000 0.000 0.205 70 P C 1.138 178.496 177.300 0.096 0.000 1.046 70 P CA 1.760 64.908 63.100 0.079 0.000 0.968 70 P CB 0.060 31.793 31.700 0.054 0.000 0.753 71 T N -2.418 112.194 114.554 0.096 0.000 3.284 71 T HA -0.001 4.348 4.350 -0.001 0.000 0.252 71 T C -0.228 174.361 174.700 -0.186 0.000 1.144 71 T CA 0.174 62.236 62.100 -0.062 0.000 1.021 71 T CB -0.951 67.818 68.868 -0.164 0.000 0.984 71 T HN -0.067 8.173 8.240 0.000 0.000 0.545 72 Y N 0.382 120.698 120.300 0.027 0.000 2.468 72 Y HA 0.673 5.222 4.550 -0.001 0.000 0.342 72 Y C 0.221 176.147 175.900 0.044 0.000 1.021 72 Y CA -1.696 56.437 58.100 0.053 0.000 1.079 72 Y CB 1.572 40.083 38.460 0.085 0.000 1.226 72 Y HN 0.051 8.331 8.280 0.000 0.000 0.460 73 A N 1.548 124.488 122.820 0.200 0.000 2.274 73 A HA 0.594 4.914 4.320 -0.001 0.000 0.309 73 A C -0.317 177.331 177.584 0.108 0.000 1.226 73 A CA -0.595 51.518 52.037 0.126 0.000 0.853 73 A CB 0.012 19.063 19.000 0.086 0.000 1.146 73 A HN 0.712 8.862 8.150 0.000 0.000 0.518 74 T N 3.903 118.505 114.554 0.079 0.000 2.869 74 T HA 0.403 4.752 4.350 -0.001 0.000 0.295 74 T C -0.034 174.641 174.700 -0.041 0.000 0.987 74 T CA -0.185 61.910 62.100 -0.008 0.000 1.109 74 T CB 0.437 69.324 68.868 0.031 0.000 0.932 74 T HN 0.559 8.799 8.240 0.000 0.000 0.518 75 K N 1.872 122.128 120.400 -0.240 0.000 2.385 75 K HA 0.400 4.719 4.320 -0.001 0.000 0.248 75 K C -1.464 174.827 176.600 -0.514 0.000 0.955 75 K CA -0.692 55.484 56.287 -0.185 0.000 0.816 75 K CB 2.268 34.708 32.500 -0.099 0.000 1.250 75 K HN 0.644 8.894 8.250 0.000 0.000 0.434 76 W N 2.283 123.532 121.300 -0.085 0.000 2.485 76 W HA 0.328 4.988 4.660 -0.001 0.000 0.297 76 W C -1.815 174.600 176.519 -0.174 0.000 0.999 76 W CA -1.693 55.569 57.345 -0.139 0.000 1.512 76 W CB 1.130 30.511 29.460 -0.132 0.000 1.322 76 W HN 0.481 8.661 8.180 0.000 0.000 0.419 77 P HA -0.106 4.314 4.420 0.000 0.000 0.223 77 P C 0.016 177.194 177.300 -0.204 0.000 1.144 77 P CA 1.433 64.418 63.100 -0.191 0.000 0.783 77 P CB 0.434 31.958 31.700 -0.293 0.000 0.771 78 I N 0.038 120.522 120.570 -0.143 0.000 2.410 78 I HA 0.304 4.474 4.170 -0.001 0.000 0.286 78 I C 0.026 176.084 176.117 -0.099 0.000 1.009 78 I CA -0.914 60.301 61.300 -0.142 0.000 1.111 78 I CB 1.573 39.478 38.000 -0.158 0.000 1.262 78 I HN -0.342 7.868 8.210 0.000 0.000 0.443 79 R N 5.144 125.579 120.500 -0.109 0.000 2.534 79 R HA 0.430 4.769 4.340 -0.001 0.000 0.301 79 R C -0.227 175.996 176.300 -0.128 0.000 0.961 79 R CA -1.065 54.912 56.100 -0.206 0.000 0.871 79 R CB 0.765 30.946 30.300 -0.199 0.000 1.170 79 R HN 0.584 8.854 8.270 0.000 0.000 0.446 80 H N 1.117 120.187 119.070 0.000 0.000 2.756 80 H HA -0.200 4.355 4.556 -0.001 0.000 0.315 80 H C 1.087 176.427 175.328 0.020 0.000 1.210 80 H CA 1.117 57.184 56.048 0.032 0.000 1.150 80 H CB -1.331 28.467 29.762 0.060 0.000 1.463 80 H HN 1.080 9.360 8.280 0.000 0.000 0.427 81 G N -1.062 107.765 108.800 0.045 0.000 2.238 81 G HA2 -0.356 3.604 3.960 -0.001 0.000 0.270 81 G HA3 -0.356 3.604 3.960 -0.001 0.000 0.270 81 G C 0.279 175.181 174.900 0.004 0.000 0.977 81 G CA 0.722 45.828 45.100 0.010 0.000 0.639 81 G HN 0.442 8.732 8.290 0.000 0.000 0.544 82 I N 0.536 121.119 120.570 0.022 0.000 2.460 82 I HA 0.460 4.630 4.170 -0.001 0.000 0.298 82 I C 0.716 176.780 176.117 -0.089 0.000 0.989 82 I CA -1.051 60.255 61.300 0.010 0.000 1.173 82 I CB 2.010 40.057 38.000 0.079 0.000 1.338 82 I HN -0.077 8.133 8.210 0.000 0.000 0.456 83 V N 7.503 127.295 119.914 -0.202 0.000 2.421 83 V HA 0.062 4.182 4.120 -0.001 0.000 0.271 83 V C 1.165 176.995 176.094 -0.440 0.000 1.031 83 V CA 0.091 62.089 62.300 -0.503 0.000 1.032 83 V CB -0.036 31.088 31.823 -1.165 0.000 1.009 83 V HN 0.725 8.915 8.190 0.000 0.000 0.477 84 E N 2.489 122.506 120.200 -0.305 0.000 2.057 84 E HA 0.003 4.352 4.350 -0.001 0.000 0.190 84 E C 0.649 177.126 176.600 -0.205 0.000 0.969 84 E CA 0.442 56.748 56.400 -0.158 0.000 0.812 84 E CB 0.127 29.784 29.700 -0.072 0.000 0.777 84 E HN 0.674 9.034 8.360 0.000 0.000 0.455 85 D N -0.476 119.774 120.400 -0.250 0.000 2.428 85 D HA 0.047 4.687 4.640 -0.001 0.000 0.221 85 D C 0.151 176.297 176.300 -0.256 0.000 1.123 85 D CA -0.425 53.471 54.000 -0.173 0.000 0.869 85 D CB 0.106 40.841 40.800 -0.109 0.000 1.032 85 D HN -0.023 8.347 8.370 0.000 0.000 0.506 86 W N 2.152 123.418 121.300 -0.058 0.000 2.388 86 W HA -0.076 4.583 4.660 -0.001 0.000 0.294 86 W C 1.798 178.279 176.519 -0.064 0.000 1.212 86 W CA 0.130 57.436 57.345 -0.065 0.000 1.271 86 W CB 0.158 29.544 29.460 -0.124 0.000 1.126 86 W HN 0.370 8.550 8.180 0.000 0.000 0.535 87 D N 0.004 120.469 120.400 0.109 0.000 2.104 87 D HA -0.161 4.478 4.640 -0.001 0.000 0.194 87 D C 2.076 178.358 176.300 -0.030 0.000 0.994 87 D CA 1.343 55.363 54.000 0.033 0.000 0.830 87 D CB -0.623 40.179 40.800 0.004 0.000 0.959 87 D HN 0.039 8.409 8.370 0.000 0.000 0.452 88 L N -0.069 121.111 121.223 -0.071 0.000 2.156 88 L HA -0.029 4.311 4.340 -0.001 0.000 0.208 88 L C 2.178 178.987 176.870 -0.101 0.000 1.095 88 L CA 0.906 55.669 54.840 -0.128 0.000 0.770 88 L CB -0.552 41.427 42.059 -0.135 0.000 0.914 88 L HN 0.028 8.258 8.230 0.000 0.000 0.439 89 M N -0.562 118.975 119.600 -0.104 0.000 2.175 89 M HA -0.167 4.312 4.480 -0.001 0.000 0.264 89 M C 2.181 178.540 176.300 0.098 0.000 1.063 89 M CA 1.525 56.775 55.300 -0.084 0.000 1.119 89 M CB -0.315 32.136 32.600 -0.248 0.000 1.377 89 M HN 0.312 8.602 8.290 0.000 0.000 0.415 90 E N -0.461 119.812 120.200 0.121 0.000 2.072 90 E HA -0.202 4.148 4.350 -0.001 0.000 0.191 90 E C 2.086 178.801 176.600 0.192 0.000 0.985 90 E CA 1.150 57.664 56.400 0.190 0.000 0.801 90 E CB 0.020 29.798 29.700 0.131 0.000 0.750 90 E HN 0.525 8.885 8.360 0.000 0.000 0.452 91 R N -0.519 119.993 120.500 0.020 0.000 2.090 91 R HA -0.093 4.246 4.340 -0.001 0.000 0.228 91 R C 2.288 178.565 176.300 -0.038 0.000 1.110 91 R CA 1.130 57.152 56.100 -0.129 0.000 0.973 91 R CB -0.408 29.469 30.300 -0.705 0.000 0.869 91 R HN 0.225 8.495 8.270 0.000 0.000 0.440 92 F N 1.359 121.211 119.950 -0.163 0.000 2.091 92 F HA -0.274 4.252 4.527 -0.001 0.000 0.299 92 F C 2.207 178.044 175.800 0.062 0.000 1.103 92 F CA 1.545 59.517 58.000 -0.046 0.000 1.228 92 F CB -0.013 38.932 39.000 -0.091 0.000 0.984 92 F HN -0.077 8.223 8.300 0.000 0.000 0.477 93 M N 0.184 119.938 119.600 0.257 0.000 2.213 93 M HA -0.185 4.294 4.480 -0.001 0.000 0.263 93 M C 2.015 178.287 176.300 -0.046 0.000 1.062 93 M CA 1.464 56.833 55.300 0.114 0.000 1.105 93 M CB -1.160 31.561 32.600 0.201 0.000 1.385 93 M HN 0.298 8.588 8.290 0.000 0.000 0.417 94 E N -0.250 120.057 120.200 0.180 0.000 2.085 94 E HA -0.232 4.118 4.350 -0.001 0.000 0.194 94 E C 2.022 178.724 176.600 0.171 0.000 0.994 94 E CA 1.199 57.748 56.400 0.248 0.000 0.801 94 E CB -0.090 29.869 29.700 0.432 0.000 0.743 94 E HN 0.609 8.969 8.360 0.000 0.000 0.453 95 Q N -0.009 119.864 119.800 0.122 0.000 2.245 95 Q HA -0.052 4.288 4.340 -0.001 0.000 0.201 95 Q C 2.286 178.299 176.000 0.021 0.000 0.955 95 Q CA 0.498 56.318 55.803 0.027 0.000 0.870 95 Q CB 0.350 29.100 28.738 0.021 0.000 0.945 95 Q HN 0.144 8.414 8.270 0.000 0.000 0.461 96 V N 0.996 120.850 119.914 -0.101 0.000 2.343 96 V HA -0.268 3.851 4.120 -0.001 0.000 0.247 96 V C 2.042 178.065 176.094 -0.118 0.000 1.051 96 V CA 1.616 63.836 62.300 -0.134 0.000 1.036 96 V CB -0.316 31.413 31.823 -0.157 0.000 0.654 96 V HN 0.325 8.515 8.190 0.000 0.000 0.451 97 I N -1.354 119.101 120.570 -0.191 0.000 2.188 97 I HA -0.135 4.035 4.170 -0.001 0.000 0.237 97 I C 2.124 178.031 176.117 -0.350 0.000 1.073 97 I CA 1.717 62.819 61.300 -0.329 0.000 1.359 97 I CB -0.326 37.293 38.000 -0.634 0.000 1.083 97 I HN 0.201 8.411 8.210 0.000 0.000 0.412 98 F N 0.631 120.497 119.950 -0.139 0.000 2.615 98 F HA -0.010 4.516 4.527 -0.001 0.000 0.297 98 F C 2.376 178.072 175.800 -0.174 0.000 1.124 98 F CA 0.845 58.776 58.000 -0.115 0.000 1.451 98 F CB -0.127 38.818 39.000 -0.091 0.000 1.103 98 F HN -0.046 8.254 8.300 0.000 0.000 0.569 99 K N -1.558 118.774 120.400 -0.113 0.000 2.329 99 K HA 0.031 4.351 4.320 -0.001 0.000 0.198 99 K C 1.307 177.536 176.600 -0.619 0.000 1.085 99 K CA 0.606 56.664 56.287 -0.382 0.000 0.961 99 K CB 0.068 32.232 32.500 -0.560 0.000 0.971 99 K HN 0.105 8.355 8.250 0.000 0.000 0.502 100 Y N 0.471 120.574 120.300 -0.329 0.000 2.284 100 Y HA 0.143 4.693 4.550 -0.001 0.000 0.293 100 Y C 1.859 177.562 175.900 -0.328 0.000 1.140 100 Y CA 0.445 58.182 58.100 -0.604 0.000 1.153 100 Y CB -0.032 37.819 38.460 -1.016 0.000 1.114 100 Y HN -0.149 8.131 8.280 0.000 0.000 0.521 101 L N -0.218 120.963 121.223 -0.070 0.000 2.217 101 L HA -0.079 4.260 4.340 -0.001 0.000 0.211 101 L C 0.419 177.346 176.870 0.094 0.000 1.107 101 L CA 0.804 55.667 54.840 0.040 0.000 0.783 101 L CB -0.397 41.550 42.059 -0.186 0.000 0.919 101 L HN 0.217 8.447 8.230 0.000 0.000 0.442 102 R N -0.419 120.070 120.500 -0.018 0.000 3.333 102 R HA -0.157 4.182 4.340 -0.001 0.000 0.256 102 R C -0.132 176.178 176.300 0.017 0.000 1.010 102 R CA 0.308 56.410 56.100 0.003 0.000 0.680 102 R CB -2.003 28.326 30.300 0.048 0.000 1.102 102 R HN 0.358 8.628 8.270 0.000 0.000 0.440 103 A N 1.152 123.917 122.820 -0.091 0.000 2.317 103 A HA 0.431 4.751 4.320 -0.001 0.000 0.327 103 A C 0.033 177.560 177.584 -0.095 0.000 1.178 103 A CA -0.639 51.352 52.037 -0.076 0.000 0.817 103 A CB 1.298 20.100 19.000 -0.331 0.000 1.189 103 A HN 0.246 8.396 8.150 0.000 0.000 0.489 104 E N 4.208 124.490 120.200 0.137 0.000 2.029 104 E HA 0.187 4.537 4.350 -0.001 0.000 0.276 104 E C -1.563 175.163 176.600 0.210 0.000 1.163 104 E CA -2.080 54.397 56.400 0.127 0.000 0.909 104 E CB 0.590 30.401 29.700 0.184 0.000 1.046 104 E HN 0.357 8.717 8.360 0.000 0.000 0.406 105 P HA -0.230 4.190 4.420 0.000 0.000 0.218 105 P C 0.256 177.724 177.300 0.280 0.000 1.146 105 P CA 1.361 64.581 63.100 0.201 0.000 0.820 105 P CB 0.337 32.024 31.700 -0.022 0.000 0.778 106 E N -0.617 119.715 120.200 0.220 0.000 2.478 106 E HA -0.096 4.253 4.350 -0.001 0.000 0.198 106 E C 0.647 177.358 176.600 0.185 0.000 1.046 106 E CA 0.541 57.055 56.400 0.190 0.000 0.870 106 E CB -0.206 29.592 29.700 0.163 0.000 0.818 106 E HN 0.348 8.708 8.360 0.000 0.000 0.527 107 D N -0.821 119.698 120.400 0.198 0.000 2.433 107 D HA 0.073 4.713 4.640 -0.001 0.000 0.211 107 D C -0.032 176.233 176.300 -0.058 0.000 1.114 107 D CA 0.252 54.288 54.000 0.060 0.000 0.837 107 D CB 0.434 41.202 40.800 -0.053 0.000 0.984 107 D HN 0.157 8.527 8.370 0.000 0.000 0.505 108 H N -0.070 119.161 119.070 0.269 0.000 2.589 108 H HA 0.186 4.741 4.556 -0.001 0.000 0.351 108 H C -0.528 175.016 175.328 0.360 0.000 1.074 108 H CA -0.586 55.609 56.048 0.245 0.000 1.203 108 H CB 1.269 31.015 29.762 -0.027 0.000 1.558 108 H HN -0.110 8.170 8.280 0.000 0.000 0.522 109 Y N 1.308 121.774 120.300 0.278 0.000 2.379 109 Y HA 0.091 4.640 4.550 -0.001 0.000 0.337 109 Y C 0.044 176.076 175.900 0.220 0.000 1.238 109 Y CA 0.459 58.730 58.100 0.286 0.000 1.405 109 Y CB 0.394 38.979 38.460 0.209 0.000 1.310 109 Y HN 0.407 8.687 8.280 0.000 0.000 0.569 110 F N 2.688 122.760 119.950 0.202 0.000 2.532 110 F HA 0.506 5.032 4.527 -0.001 0.000 0.321 110 F C -0.712 175.232 175.800 0.239 0.000 1.089 110 F CA -0.937 57.145 58.000 0.137 0.000 0.926 110 F CB 1.566 40.568 39.000 0.003 0.000 1.168 110 F HN 0.186 8.486 8.300 0.000 0.000 0.459 111 L N 5.521 126.926 121.223 0.303 0.000 2.343 111 L HA 0.627 4.966 4.340 -0.001 0.000 0.278 111 L C -1.571 175.419 176.870 0.199 0.000 0.996 111 L CA -0.273 54.745 54.840 0.296 0.000 0.831 111 L CB 0.720 42.817 42.059 0.063 0.000 1.232 111 L HN 0.578 8.808 8.230 0.000 0.000 0.413 112 L N 3.193 124.544 121.223 0.213 0.000 2.313 112 L HA 0.711 5.050 4.340 -0.001 0.000 0.268 112 L C 0.226 177.166 176.870 0.116 0.000 1.010 112 L CA -0.708 54.227 54.840 0.157 0.000 0.814 112 L CB 2.245 44.395 42.059 0.152 0.000 1.304 112 L HN 0.597 8.827 8.230 0.000 0.000 0.441 113 T N -1.955 112.656 114.554 0.094 0.000 2.942 113 T HA 0.691 5.040 4.350 -0.001 0.000 0.289 113 T C -0.835 173.898 174.700 0.055 0.000 1.044 113 T CA -0.765 61.373 62.100 0.064 0.000 1.023 113 T CB 2.211 71.113 68.868 0.058 0.000 1.123 113 T HN 0.760 9.000 8.240 0.000 0.000 0.512 114 E N 0.338 120.558 120.200 0.035 0.000 2.356 114 E HA 0.620 4.969 4.350 -0.001 0.000 0.275 114 E C -3.124 173.483 176.600 0.012 0.000 0.904 114 E CA -2.445 53.976 56.400 0.035 0.000 0.757 114 E CB 2.241 31.970 29.700 0.047 0.000 1.232 114 E HN 0.426 8.786 8.360 0.000 0.000 0.442 115 P HA 0.298 4.718 4.420 0.000 0.000 0.277 115 P C -2.535 174.757 177.300 -0.013 0.000 1.271 115 P CA -1.661 61.418 63.100 -0.036 0.000 0.795 115 P CB -0.104 31.565 31.700 -0.051 0.000 1.101 116 P HA 0.154 4.574 4.420 0.000 0.000 0.272 116 P C -0.292 177.035 177.300 0.045 0.000 1.223 116 P CA 0.045 63.156 63.100 0.018 0.000 0.784 116 P CB 0.033 31.745 31.700 0.020 0.000 0.923 117 L N -0.937 120.324 121.223 0.063 0.000 3.548 117 L HA -0.219 4.120 4.340 -0.001 0.000 0.443 117 L C -0.086 176.825 176.870 0.068 0.000 1.286 117 L CA 0.670 55.551 54.840 0.068 0.000 0.863 117 L CB -2.779 39.326 42.059 0.078 0.000 1.734 117 L HN 0.515 8.745 8.230 0.000 0.000 0.873 118 N N -0.144 118.596 118.700 0.067 0.000 2.419 118 N HA 0.554 5.293 4.740 -0.001 0.000 0.277 118 N C 0.383 175.935 175.510 0.071 0.000 1.006 118 N CA 0.272 53.369 53.050 0.079 0.000 0.923 118 N CB 1.163 39.698 38.487 0.079 0.000 1.140 118 N HN 0.306 8.686 8.380 0.000 0.000 0.488 119 T N 1.560 116.158 114.554 0.073 0.000 2.856 119 T HA 0.213 4.562 4.350 -0.001 0.000 0.306 119 T C -1.695 173.011 174.700 0.010 0.000 1.062 119 T CA -0.978 61.146 62.100 0.040 0.000 1.083 119 T CB 0.908 69.796 68.868 0.034 0.000 0.984 119 T HN 0.360 8.600 8.240 0.000 0.000 0.542 120 P HA -0.001 4.419 4.420 0.000 0.000 0.218 120 P C 1.292 178.514 177.300 -0.130 0.000 1.149 120 P CA 0.792 63.866 63.100 -0.044 0.000 0.817 120 P CB 0.073 31.750 31.700 -0.038 0.000 0.785 121 E N -0.483 119.600 120.200 -0.196 0.000 2.051 121 E HA -0.174 4.175 4.350 -0.001 0.000 0.192 121 E C 1.753 177.936 176.600 -0.696 0.000 0.991 121 E CA 1.310 57.440 56.400 -0.450 0.000 0.799 121 E CB -1.068 28.388 29.700 -0.406 0.000 0.748 121 E HN 0.369 8.729 8.360 0.000 0.000 0.449 122 N N 0.145 118.662 118.700 -0.305 0.000 2.205 122 N HA -0.153 4.587 4.740 -0.001 0.000 0.186 122 N C 1.723 177.231 175.510 -0.004 0.000 1.015 122 N CA 0.712 53.745 53.050 -0.028 0.000 0.862 122 N CB -0.045 38.633 38.487 0.318 0.000 0.986 122 N HN 0.074 8.454 8.380 0.000 0.000 0.429 123 R N 1.108 121.592 120.500 -0.027 0.000 2.092 123 R HA -0.072 4.267 4.340 -0.001 0.000 0.231 123 R C 1.693 177.988 176.300 -0.009 0.000 1.119 123 R CA 0.989 57.106 56.100 0.029 0.000 0.970 123 R CB -0.118 30.197 30.300 0.026 0.000 0.864 123 R HN 0.425 8.695 8.270 0.000 0.000 0.440 124 E N -0.172 119.948 120.200 -0.135 0.000 2.152 124 E HA -0.161 4.189 4.350 -0.001 0.000 0.192 124 E C 1.651 178.223 176.600 -0.047 0.000 0.983 124 E CA 0.940 57.288 56.400 -0.086 0.000 0.818 124 E CB -0.041 29.553 29.700 -0.176 0.000 0.758 124 E HN 0.529 8.889 8.360 0.000 0.000 0.467 125 Y N 0.771 120.909 120.300 -0.270 0.000 2.200 125 Y HA -0.169 4.380 4.550 -0.001 0.000 0.290 125 Y C 2.748 178.440 175.900 -0.347 0.000 1.137 125 Y CA 0.711 58.461 58.100 -0.584 0.000 1.163 125 Y CB -0.003 37.553 38.460 -1.508 0.000 0.988 125 Y HN 0.021 8.301 8.280 0.000 0.000 0.518 126 T N -0.015 114.578 114.554 0.065 0.000 2.737 126 T HA -0.191 4.158 4.350 -0.001 0.000 0.265 126 T C 2.116 176.893 174.700 0.127 0.000 1.038 126 T CA 1.204 63.455 62.100 0.252 0.000 1.144 126 T CB -0.453 68.587 68.868 0.287 0.000 0.866 126 T HN 0.447 8.687 8.240 0.000 0.000 0.434 127 A N 1.215 124.108 122.820 0.121 0.000 1.930 127 A HA -0.105 4.214 4.320 -0.001 0.000 0.217 127 A C 2.179 179.823 177.584 0.101 0.000 1.175 127 A CA 1.787 53.913 52.037 0.148 0.000 0.627 127 A CB -0.555 18.642 19.000 0.329 0.000 0.815 127 A HN 0.620 8.770 8.150 0.000 0.000 0.443 128 E N -0.104 120.181 120.200 0.141 0.000 2.110 128 E HA -0.172 4.177 4.350 -0.001 0.000 0.193 128 E C 1.826 178.425 176.600 -0.001 0.000 0.988 128 E CA 1.235 57.714 56.400 0.132 0.000 0.804 128 E CB -0.195 29.580 29.700 0.123 0.000 0.745 128 E HN 0.692 9.052 8.360 0.000 0.000 0.458 129 I N 0.462 121.024 120.570 -0.013 0.000 2.133 129 I HA -0.270 3.899 4.170 -0.001 0.000 0.238 129 I C 2.493 178.511 176.117 -0.165 0.000 1.074 129 I CA 0.759 62.011 61.300 -0.080 0.000 1.342 129 I CB -0.243 37.800 38.000 0.072 0.000 1.053 129 I HN 0.216 8.426 8.210 0.000 0.000 0.404 130 M N -0.165 119.366 119.600 -0.114 0.000 2.117 130 M HA -0.166 4.313 4.480 -0.001 0.000 0.262 130 M C 2.299 178.376 176.300 -0.372 0.000 1.065 130 M CA 1.993 57.155 55.300 -0.230 0.000 1.114 130 M CB -1.230 31.107 32.600 -0.439 0.000 1.361 130 M HN 0.137 8.427 8.290 0.000 0.000 0.408 131 F N 0.609 120.374 119.950 -0.308 0.000 2.262 131 F HA -0.005 4.521 4.527 -0.001 0.000 0.292 131 F C 2.393 178.027 175.800 -0.277 0.000 1.081 131 F CA 0.888 58.640 58.000 -0.413 0.000 1.355 131 F CB -0.389 38.002 39.000 -1.015 0.000 1.069 131 F HN 0.241 8.541 8.300 0.000 0.000 0.506 132 E N -1.062 119.102 120.200 -0.060 0.000 2.340 132 E HA 0.010 4.359 4.350 -0.001 0.000 0.194 132 E C 1.914 178.446 176.600 -0.114 0.000 0.996 132 E CA 0.722 57.107 56.400 -0.025 0.000 0.869 132 E CB 0.062 29.786 29.700 0.039 0.000 0.835 132 E HN 0.233 8.593 8.360 0.000 0.000 0.493 133 S N 0.300 115.834 115.700 -0.277 0.000 2.444 133 S HA 0.065 4.534 4.470 -0.001 0.000 0.223 133 S C 1.194 175.531 174.600 -0.439 0.000 1.054 133 S CA 0.318 58.222 58.200 -0.493 0.000 0.947 133 S CB 0.047 62.683 63.200 -0.940 0.000 0.850 133 S HN 0.130 8.440 8.310 0.000 0.000 0.527 134 F N 2.161 122.100 119.950 -0.017 0.000 2.727 134 F HA 0.367 4.894 4.527 -0.001 0.000 0.302 134 F C 0.405 176.195 175.800 -0.017 0.000 1.097 134 F CA -0.651 57.347 58.000 -0.004 0.000 1.330 134 F CB -0.849 38.087 39.000 -0.107 0.000 1.084 134 F HN 0.023 8.323 8.300 0.000 0.000 0.578 135 N N 0.063 118.817 118.700 0.089 0.000 2.710 135 N HA -0.178 4.561 4.740 -0.001 0.000 0.249 135 N C -0.085 175.482 175.510 0.094 0.000 1.059 135 N CA 0.894 54.005 53.050 0.102 0.000 0.720 135 N CB -2.177 36.385 38.487 0.124 0.000 0.983 135 N HN 0.303 8.683 8.380 0.000 0.000 0.544 136 V N -1.925 117.971 119.914 -0.030 0.000 2.872 136 V HA 0.188 4.308 4.120 -0.001 0.000 0.307 136 V C -0.359 175.743 176.094 0.013 0.000 1.072 136 V CA -0.732 61.536 62.300 -0.053 0.000 1.148 136 V CB 0.891 32.535 31.823 -0.299 0.000 0.954 136 V HN 0.006 8.196 8.190 0.000 0.000 0.490 137 P HA 0.177 4.597 4.420 0.000 0.000 0.220 137 P C 0.629 177.742 177.300 -0.312 0.000 1.152 137 P CA 1.535 64.617 63.100 -0.029 0.000 0.812 137 P CB 0.272 32.019 31.700 0.078 0.000 0.792 138 G N -0.267 108.117 108.800 -0.693 0.000 2.746 138 G HA2 0.532 4.491 3.960 -0.001 0.000 0.297 138 G HA3 0.532 4.491 3.960 -0.001 0.000 0.297 138 G C -2.390 172.319 174.900 -0.317 0.000 1.426 138 G CA -0.302 44.348 45.100 -0.749 0.000 0.989 138 G HN 0.198 8.488 8.290 0.000 0.000 0.520 139 L N 1.113 122.315 121.223 -0.034 0.000 2.388 139 L HA 0.937 5.276 4.340 -0.001 0.000 0.264 139 L C -1.858 175.119 176.870 0.179 0.000 0.998 139 L CA -1.184 53.678 54.840 0.037 0.000 0.817 139 L CB 2.227 44.181 42.059 -0.176 0.000 1.338 139 L HN 0.632 8.862 8.230 0.000 0.000 0.414 140 Y N 4.254 124.606 120.300 0.088 0.000 2.470 140 Y HA 0.703 5.253 4.550 -0.001 0.000 0.341 140 Y C -1.415 174.577 175.900 0.153 0.000 1.021 140 Y CA -0.871 57.270 58.100 0.068 0.000 1.025 140 Y CB 1.686 40.184 38.460 0.063 0.000 1.266 140 Y HN 0.538 8.818 8.280 0.000 0.000 0.448 141 I N 5.903 126.261 120.570 -0.353 0.000 2.382 141 I HA 0.645 4.815 4.170 -0.001 0.000 0.285 141 I C -0.462 175.437 176.117 -0.362 0.000 1.007 141 I CA -0.779 60.415 61.300 -0.177 0.000 1.142 141 I CB 1.367 39.329 38.000 -0.064 0.000 1.289 141 I HN 0.752 8.962 8.210 0.000 0.000 0.453 142 A N 5.879 128.655 122.820 -0.073 0.000 2.312 142 A HA 0.608 4.928 4.320 -0.001 0.000 0.326 142 A C -0.467 177.114 177.584 -0.005 0.000 1.172 142 A CA -0.563 51.482 52.037 0.014 0.000 0.821 142 A CB 1.630 20.773 19.000 0.238 0.000 1.166 142 A HN 0.538 8.688 8.150 0.000 0.000 0.493 143 V N 3.750 123.649 119.914 -0.025 0.000 2.488 143 V HA 0.071 4.190 4.120 -0.001 0.000 0.277 143 V C 1.189 177.265 176.094 -0.030 0.000 1.046 143 V CA 0.252 62.540 62.300 -0.021 0.000 0.986 143 V CB 0.379 32.191 31.823 -0.019 0.000 0.989 143 V HN 1.077 9.267 8.190 0.000 0.000 0.475 144 Q N 5.026 124.814 119.800 -0.021 0.000 2.082 144 Q HA -0.259 4.080 4.340 -0.001 0.000 0.211 144 Q C 2.274 178.251 176.000 -0.038 0.000 1.002 144 Q CA 2.658 58.447 55.803 -0.022 0.000 0.868 144 Q CB -0.441 28.286 28.738 -0.018 0.000 0.931 144 Q HN 1.039 9.309 8.270 0.000 0.000 0.414 145 A N 0.331 123.127 122.820 -0.039 0.000 1.884 145 A HA -0.251 4.069 4.320 -0.001 0.000 0.219 145 A C 2.382 179.931 177.584 -0.058 0.000 1.197 145 A CA 2.141 54.157 52.037 -0.035 0.000 0.637 145 A CB -1.170 17.818 19.000 -0.020 0.000 0.827 145 A HN 0.259 8.409 8.150 0.000 0.000 0.450 146 V N 0.105 119.972 119.914 -0.079 0.000 2.332 146 V HA -0.292 3.828 4.120 -0.001 0.000 0.248 146 V C 2.563 178.540 176.094 -0.195 0.000 1.055 146 V CA 2.056 64.279 62.300 -0.129 0.000 1.038 146 V CB -0.887 30.845 31.823 -0.151 0.000 0.651 146 V HN 0.567 8.757 8.190 0.000 0.000 0.450 147 L N 0.093 121.214 121.223 -0.170 0.000 2.046 147 L HA -0.148 4.191 4.340 -0.001 0.000 0.208 147 L C 2.787 179.543 176.870 -0.190 0.000 1.077 147 L CA 1.498 56.208 54.840 -0.216 0.000 0.747 147 L CB -0.883 41.088 42.059 -0.148 0.000 0.896 147 L HN 0.364 8.594 8.230 0.000 0.000 0.432 148 A N 0.250 123.012 122.820 -0.096 0.000 1.908 148 A HA -0.201 4.118 4.320 -0.001 0.000 0.218 148 A C 2.295 179.822 177.584 -0.095 0.000 1.181 148 A CA 1.512 53.529 52.037 -0.035 0.000 0.627 148 A CB -0.731 18.270 19.000 0.003 0.000 0.818 148 A HN 0.337 8.487 8.150 0.000 0.000 0.445 149 L N -0.895 120.243 121.223 -0.142 0.000 1.989 149 L HA -0.270 4.069 4.340 -0.001 0.000 0.211 149 L C 3.183 179.778 176.870 -0.459 0.000 1.071 149 L CA 1.373 56.113 54.840 -0.167 0.000 0.749 149 L CB -0.658 41.342 42.059 -0.099 0.000 0.890 149 L HN 0.478 8.708 8.230 0.000 0.000 0.431 150 A N -0.102 122.263 122.820 -0.758 0.000 1.892 150 A HA -0.290 4.029 4.320 -0.001 0.000 0.218 150 A C 2.488 179.475 177.584 -0.994 0.000 1.188 150 A CA 2.092 53.194 52.037 -1.557 0.000 0.631 150 A CB -0.907 17.357 19.000 -1.226 0.000 0.822 150 A HN 0.488 8.638 8.150 0.000 0.000 0.447 151 A N 0.236 122.799 122.820 -0.427 0.000 1.986 151 A HA -0.162 4.158 4.320 -0.001 0.000 0.220 151 A C 2.425 179.839 177.584 -0.283 0.000 1.171 151 A CA 2.515 54.531 52.037 -0.035 0.000 0.640 151 A CB -1.026 18.114 19.000 0.234 0.000 0.811 151 A HN 1.207 9.357 8.150 0.000 0.000 0.451 152 S N -2.026 113.397 115.700 -0.461 0.000 2.515 152 S HA -0.110 4.359 4.470 -0.001 0.000 0.231 152 S C 1.287 175.831 174.600 -0.094 0.000 0.987 152 S CA 0.591 58.446 58.200 -0.576 0.000 0.936 152 S CB -0.623 62.446 63.200 -0.219 0.000 0.766 152 S HN 0.653 8.963 8.310 0.000 0.000 0.528 153 W N 2.196 123.416 121.300 -0.133 0.000 2.721 153 W HA 0.200 4.859 4.660 -0.001 0.000 0.245 153 W C 2.270 178.770 176.519 -0.033 0.000 1.276 153 W CA 0.113 57.422 57.345 -0.061 0.000 1.342 153 W CB -1.715 27.723 29.460 -0.036 0.000 1.135 153 W HN 0.361 8.541 8.180 0.000 0.000 0.654 154 T N -0.891 113.755 114.554 0.153 0.000 3.067 154 T HA -0.019 4.331 4.350 -0.001 0.000 0.261 154 T C 1.301 176.046 174.700 0.075 0.000 1.110 154 T CA 0.625 62.803 62.100 0.131 0.000 1.113 154 T CB 0.001 68.939 68.868 0.116 0.000 0.917 154 T HN -0.039 8.201 8.240 0.000 0.000 0.499 158 V N -2.626 117.308 119.914 0.034 0.000 2.686 158 V HA 0.925 5.044 4.120 -0.001 0.000 0.306 158 V C 0.245 176.341 176.094 0.004 0.000 1.065 158 V CA -0.028 62.286 62.300 0.024 0.000 0.894 158 V CB 1.596 33.446 31.823 0.045 0.000 1.004 158 V HN 0.138 8.328 8.190 0.000 0.000 0.424 159 G N 2.488 111.277 108.800 -0.019 0.000 3.079 159 G HA2 0.311 4.270 3.960 -0.001 0.000 0.233 159 G HA3 0.311 4.270 3.960 -0.001 0.000 0.233 159 G C 0.110 174.963 174.900 -0.079 0.000 1.062 159 G CA 0.292 45.371 45.100 -0.036 0.000 0.809 159 G HN 0.793 9.083 8.290 0.000 0.000 0.535 160 E N 1.408 121.553 120.200 -0.092 0.000 2.141 160 E HA 0.413 4.762 4.350 -0.001 0.000 0.259 160 E C 0.151 176.615 176.600 -0.227 0.000 0.883 160 E CA -0.695 55.623 56.400 -0.136 0.000 0.744 160 E CB 0.282 29.934 29.700 -0.081 0.000 1.150 160 E HN 0.107 8.467 8.360 0.000 0.000 0.420 161 R N 2.430 122.672 120.500 -0.430 0.000 2.537 161 R HA 0.355 4.694 4.340 -0.001 0.000 0.280 161 R C -0.160 175.846 176.300 -0.490 0.000 1.058 161 R CA 0.258 55.838 56.100 -0.868 0.000 1.057 161 R CB 0.934 30.361 30.300 -1.454 0.000 0.973 161 R HN 0.470 8.740 8.270 0.000 0.000 0.438 162 T N 2.131 116.561 114.554 -0.206 0.000 2.932 162 T HA 0.281 4.630 4.350 -0.001 0.000 0.318 162 T C -0.241 174.651 174.700 0.320 0.000 1.265 162 T CA -0.718 61.418 62.100 0.059 0.000 1.036 162 T CB 0.992 69.889 68.868 0.048 0.000 1.209 162 T HN 0.481 8.721 8.240 0.000 0.000 0.484 163 L N 3.214 124.579 121.223 0.237 0.000 2.928 163 L HA 0.324 4.664 4.340 -0.001 0.000 0.246 163 L C 0.156 177.094 176.870 0.114 0.000 1.239 163 L CA -0.097 54.864 54.840 0.201 0.000 1.035 163 L CB 0.494 42.639 42.059 0.144 0.000 1.360 163 L HN 0.616 8.846 8.230 0.000 0.000 0.529 164 T N 0.306 114.929 114.554 0.114 0.000 2.791 164 T HA 0.726 5.076 4.350 -0.001 0.000 0.288 164 T C 0.198 174.945 174.700 0.079 0.000 0.999 164 T CA -0.501 61.649 62.100 0.084 0.000 0.952 164 T CB 1.896 70.809 68.868 0.075 0.000 0.938 164 T HN 0.407 8.647 8.240 0.000 0.000 0.444 165 G N 1.540 110.377 108.800 0.062 0.000 2.356 165 G HA2 0.493 4.452 3.960 -0.001 0.000 0.294 165 G HA3 0.493 4.452 3.960 -0.001 0.000 0.294 165 G C -1.297 173.624 174.900 0.035 0.000 1.423 165 G CA -0.732 44.400 45.100 0.054 0.000 0.806 165 G HN 0.492 8.782 8.290 0.000 0.000 0.527 166 T N 0.610 115.181 114.554 0.028 0.000 2.758 166 T HA 0.555 4.904 4.350 -0.001 0.000 0.285 166 T C -0.182 174.540 174.700 0.038 0.000 0.981 166 T CA -0.275 61.836 62.100 0.019 0.000 0.965 166 T CB 1.450 70.312 68.868 -0.010 0.000 0.927 166 T HN 0.504 8.744 8.240 0.000 0.000 0.448 167 V N 5.396 125.333 119.914 0.038 0.000 2.394 167 V HA 0.443 4.562 4.120 -0.001 0.000 0.282 167 V C 0.037 176.161 176.094 0.049 0.000 1.031 167 V CA -0.758 61.567 62.300 0.042 0.000 0.881 167 V CB 1.304 33.144 31.823 0.028 0.000 0.982 167 V HN 0.809 8.999 8.190 0.000 0.000 0.451 168 I N 3.999 124.598 120.570 0.049 0.000 2.347 168 I HA 0.313 4.482 4.170 -0.001 0.000 0.283 168 I C -0.491 175.635 176.117 0.016 0.000 1.058 168 I CA -0.185 61.144 61.300 0.048 0.000 1.202 168 I CB 1.091 39.132 38.000 0.068 0.000 1.386 168 I HN 0.577 8.787 8.210 0.000 0.000 0.475 169 D N 4.379 124.801 120.400 0.037 0.000 2.329 169 D HA 0.233 4.873 4.640 -0.001 0.000 0.232 169 D C -0.478 175.843 176.300 0.036 0.000 1.088 169 D CA 0.034 54.045 54.000 0.018 0.000 0.835 169 D CB 1.253 42.065 40.800 0.021 0.000 1.078 169 D HN 0.293 8.663 8.370 0.000 0.000 0.495 170 S N 2.861 118.553 115.700 -0.013 0.000 2.594 170 S HA 0.626 5.096 4.470 -0.001 0.000 0.322 170 S C 0.609 175.214 174.600 0.008 0.000 1.085 170 S CA -0.471 57.745 58.200 0.027 0.000 1.116 170 S CB 0.618 63.845 63.200 0.046 0.000 0.979 170 S HN 0.558 8.868 8.310 0.000 0.000 0.465 171 G N 2.611 111.430 108.800 0.031 0.000 3.287 171 G HA2 0.181 4.140 3.960 -0.001 0.000 0.172 171 G HA3 0.181 4.140 3.960 -0.001 0.000 0.172 171 G C 0.096 175.005 174.900 0.015 0.000 1.922 171 G CA 0.311 45.426 45.100 0.025 0.000 0.952 171 G HN 0.656 8.946 8.290 0.000 0.000 0.520 172 D N -2.706 117.701 120.400 0.012 0.000 2.516 172 D HA 0.221 4.860 4.640 -0.001 0.000 0.241 172 D C 1.748 178.011 176.300 -0.062 0.000 1.246 172 D CA 0.783 54.773 54.000 -0.017 0.000 0.808 172 D CB 0.444 41.258 40.800 0.023 0.000 1.147 172 D HN 0.361 8.731 8.370 0.000 0.000 0.527 173 G N -0.300 108.473 108.800 -0.045 0.000 2.742 173 G HA2 0.381 4.340 3.960 -0.001 0.000 0.204 173 G HA3 0.381 4.340 3.960 -0.001 0.000 0.204 173 G C 0.223 175.086 174.900 -0.062 0.000 1.126 173 G CA 0.253 45.317 45.100 -0.060 0.000 0.829 173 G HN 0.131 8.421 8.290 0.000 0.000 0.574 174 V N -0.440 119.448 119.914 -0.044 0.000 3.216 174 V HA 0.523 4.642 4.120 -0.001 0.000 0.302 174 V C -0.947 175.089 176.094 -0.096 0.000 1.286 174 V CA -0.764 61.467 62.300 -0.115 0.000 1.048 174 V CB 2.022 33.741 31.823 -0.173 0.000 1.081 174 V HN 0.105 8.295 8.190 0.000 0.000 0.442 175 T N 1.083 115.538 114.554 -0.165 0.000 2.824 175 T HA 0.663 5.012 4.350 -0.001 0.000 0.280 175 T C -1.079 173.465 174.700 -0.259 0.000 0.995 175 T CA -0.305 61.756 62.100 -0.065 0.000 1.009 175 T CB 0.824 69.746 68.868 0.089 0.000 0.955 175 T HN 0.685 8.925 8.240 0.000 0.000 0.452 176 H N 0.201 119.215 119.070 -0.094 0.000 2.495 176 H HA 0.581 5.137 4.556 -0.001 0.000 0.348 176 H C -0.706 174.616 175.328 -0.011 0.000 1.113 176 H CA -0.557 55.431 56.048 -0.101 0.000 1.195 176 H CB 1.341 31.015 29.762 -0.148 0.000 1.521 176 H HN 0.288 8.568 8.280 0.000 0.000 0.509 177 V N 5.380 125.368 119.914 0.123 0.000 2.293 177 V HA 0.275 4.394 4.120 -0.001 0.000 0.275 177 V C -0.198 175.961 176.094 0.107 0.000 1.021 177 V CA -0.376 61.982 62.300 0.096 0.000 0.815 177 V CB 0.108 31.977 31.823 0.077 0.000 1.025 177 V HN 0.603 8.793 8.190 0.000 0.000 0.448 178 I N 7.959 128.583 120.570 0.089 0.000 2.355 178 I HA 0.408 4.577 4.170 -0.001 0.000 0.288 178 I C -2.351 173.795 176.117 0.049 0.000 0.999 178 I CA -1.993 59.353 61.300 0.077 0.000 1.163 178 I CB 2.591 40.630 38.000 0.066 0.000 1.316 178 I HN 0.378 8.588 8.210 0.000 0.000 0.454 179 P HA 0.257 4.677 4.420 0.000 0.000 0.286 179 P C -0.860 176.467 177.300 0.044 0.000 1.269 179 P CA -0.281 62.836 63.100 0.029 0.000 0.787 179 P CB 1.886 33.596 31.700 0.017 0.000 0.920 180 V N 2.903 122.842 119.914 0.042 0.000 2.540 180 V HA 0.712 4.831 4.120 -0.001 0.000 0.302 180 V C 0.084 176.218 176.094 0.067 0.000 1.035 180 V CA -0.841 61.492 62.300 0.054 0.000 0.873 180 V CB 1.771 33.615 31.823 0.034 0.000 0.992 180 V HN 0.721 8.911 8.190 0.000 0.000 0.428 181 A N 2.880 125.757 122.820 0.095 0.000 2.340 181 A HA 0.748 5.067 4.320 -0.001 0.000 0.297 181 A C 0.217 177.887 177.584 0.145 0.000 1.195 181 A CA -0.433 51.667 52.037 0.104 0.000 0.769 181 A CB 0.362 19.420 19.000 0.096 0.000 1.163 181 A HN 1.056 9.206 8.150 0.000 0.000 0.472 182 E N 1.450 121.724 120.200 0.123 0.000 2.637 182 E HA -0.249 4.100 4.350 -0.001 0.000 0.265 182 E C 0.954 177.631 176.600 0.129 0.000 1.073 182 E CA 1.327 57.814 56.400 0.144 0.000 0.778 182 E CB -1.651 28.158 29.700 0.181 0.000 1.362 182 E HN 2.335 10.695 8.360 0.000 0.000 0.413 183 G N -1.228 107.591 108.800 0.031 0.000 2.157 183 G HA2 -0.337 3.622 3.960 -0.001 0.000 0.248 183 G HA3 -0.337 3.622 3.960 -0.001 0.000 0.248 183 G C -0.391 174.260 174.900 -0.415 0.000 0.979 183 G CA 0.388 45.388 45.100 -0.167 0.000 0.650 183 G HN 0.290 8.580 8.290 0.000 0.000 0.529 184 Y N -0.695 119.642 120.300 0.063 0.000 2.373 184 Y HA 0.543 5.093 4.550 -0.001 0.000 0.336 184 Y C 0.596 176.525 175.900 0.048 0.000 0.979 184 Y CA -1.016 57.120 58.100 0.060 0.000 1.080 184 Y CB 2.152 40.653 38.460 0.069 0.000 1.190 184 Y HN 0.094 8.374 8.280 0.000 0.000 0.446 185 V N 5.179 125.196 119.914 0.171 0.000 2.585 185 V HA -0.017 4.102 4.120 -0.001 0.000 0.296 185 V C 0.565 176.735 176.094 0.126 0.000 1.035 185 V CA 0.198 62.568 62.300 0.117 0.000 1.084 185 V CB 0.316 32.193 31.823 0.090 0.000 0.953 185 V HN 0.609 8.799 8.190 0.000 0.000 0.483 186 I N 5.316 125.943 120.570 0.095 0.000 2.204 186 I HA 0.121 4.290 4.170 -0.001 0.000 0.291 186 I C 1.862 178.021 176.117 0.069 0.000 1.153 186 I CA 0.184 61.530 61.300 0.077 0.000 1.546 186 I CB -0.073 37.962 38.000 0.059 0.000 1.490 186 I HN 0.857 9.067 8.210 0.000 0.000 0.697 187 G N 3.096 111.942 108.800 0.076 0.000 2.545 187 G HA2 -0.353 3.607 3.960 -0.001 0.000 0.222 187 G HA3 -0.353 3.607 3.960 -0.001 0.000 0.222 187 G C 1.637 176.572 174.900 0.059 0.000 1.126 187 G CA 1.314 46.457 45.100 0.071 0.000 0.754 187 G HN 0.628 8.918 8.290 0.000 0.000 0.583 188 S N -1.403 114.324 115.700 0.045 0.000 2.603 188 S HA 0.012 4.482 4.470 -0.001 0.000 0.229 188 S C 1.556 176.176 174.600 0.033 0.000 0.972 188 S CA 0.918 59.138 58.200 0.033 0.000 0.935 188 S CB -0.341 62.874 63.200 0.025 0.000 0.769 188 S HN 0.335 8.645 8.310 0.000 0.000 0.536 189 C N 0.915 120.240 119.300 0.043 0.000 3.336 189 C HA 0.510 4.970 4.460 -0.001 0.000 0.291 189 C C 0.826 175.850 174.990 0.056 0.000 1.363 189 C CA -1.087 57.955 59.018 0.040 0.000 1.737 189 C CB -1.148 26.611 27.740 0.032 0.000 2.274 189 C HN 0.569 8.799 8.230 0.000 0.000 0.663 190 I N 1.813 122.430 120.570 0.078 0.000 2.836 190 I HA 0.127 4.296 4.170 -0.001 0.000 0.285 190 I C 0.154 176.347 176.117 0.127 0.000 1.174 190 I CA 0.971 62.348 61.300 0.127 0.000 1.405 190 I CB 0.401 38.511 38.000 0.184 0.000 1.385 190 I HN 0.049 8.259 8.210 0.000 0.000 0.594 191 K N 3.247 123.757 120.400 0.182 0.000 2.508 191 K HA 0.508 4.827 4.320 -0.001 0.000 0.260 191 K C -1.255 175.500 176.600 0.258 0.000 0.949 191 K CA -0.681 55.697 56.287 0.152 0.000 0.834 191 K CB 1.632 34.195 32.500 0.106 0.000 1.365 191 K HN 0.498 8.748 8.250 0.000 0.000 0.437 192 H N 1.765 120.771 119.070 -0.107 0.000 2.621 192 H HA 0.572 5.128 4.556 -0.001 0.000 0.360 192 H C -0.470 174.682 175.328 -0.293 0.000 1.163 192 H CA -1.112 54.767 56.048 -0.282 0.000 1.194 192 H CB 1.921 31.483 29.762 -0.333 0.000 1.649 192 H HN 0.228 8.508 8.280 0.000 0.000 0.532 193 I N 2.778 123.184 120.570 -0.273 0.000 2.418 193 I HA 0.170 4.340 4.170 -0.001 0.000 0.287 193 I C -2.178 173.620 176.117 -0.532 0.000 1.008 193 I CA -2.189 58.809 61.300 -0.503 0.000 1.104 193 I CB 2.468 40.336 38.000 -0.220 0.000 1.264 193 I HN 0.360 8.570 8.210 0.000 0.000 0.438 194 P HA 0.141 4.561 4.420 0.000 0.000 0.286 194 P C -0.705 176.393 177.300 -0.337 0.000 1.577 194 P CA 0.573 63.399 63.100 -0.458 0.000 0.805 194 P CB -0.337 31.099 31.700 -0.440 0.000 1.706 195 I N -0.004 120.369 120.570 -0.328 0.000 2.478 195 I HA 0.604 4.773 4.170 -0.001 0.000 0.287 195 I C 0.001 175.911 176.117 -0.344 0.000 1.042 195 I CA -0.666 60.422 61.300 -0.353 0.000 1.067 195 I CB 1.861 39.599 38.000 -0.437 0.000 1.233 195 I HN -0.103 8.107 8.210 0.000 0.000 0.431 196 A N 3.713 126.334 122.820 -0.333 0.000 2.533 196 A HA 0.733 5.052 4.320 -0.001 0.000 0.293 196 A C 1.005 178.465 177.584 -0.206 0.000 1.228 196 A CA -0.062 51.851 52.037 -0.206 0.000 0.689 196 A CB 0.271 19.197 19.000 -0.124 0.000 1.303 196 A HN 0.735 8.885 8.150 0.000 0.000 0.444 197 G N -0.490 108.264 108.800 -0.076 0.000 2.462 197 G HA2 -0.209 3.751 3.960 -0.001 0.000 0.220 197 G HA3 -0.209 3.751 3.960 -0.001 0.000 0.220 197 G C 1.376 176.197 174.900 -0.132 0.000 1.121 197 G CA 1.413 46.495 45.100 -0.030 0.000 0.758 197 G HN 0.786 9.076 8.290 0.000 0.000 0.559 198 R N 0.355 120.715 120.500 -0.234 0.000 2.081 198 R HA -0.071 4.268 4.340 -0.001 0.000 0.235 198 R C 1.980 177.801 176.300 -0.798 0.000 1.131 198 R CA 1.764 57.590 56.100 -0.457 0.000 0.960 198 R CB -0.155 29.895 30.300 -0.418 0.000 0.856 198 R HN 0.285 8.556 8.270 0.000 0.000 0.436 199 D N 0.135 120.216 120.400 -0.532 0.000 2.149 199 D HA -0.116 4.524 4.640 -0.001 0.000 0.201 199 D C 1.959 178.157 176.300 -0.170 0.000 0.972 199 D CA 1.079 54.846 54.000 -0.388 0.000 0.835 199 D CB -0.012 40.632 40.800 -0.261 0.000 0.966 199 D HN 0.347 8.717 8.370 0.000 0.000 0.476 200 I N 1.223 121.695 120.570 -0.164 0.000 2.286 200 I HA -0.214 3.955 4.170 -0.001 0.000 0.248 200 I C 2.330 178.474 176.117 0.045 0.000 1.115 200 I CA 1.011 62.288 61.300 -0.039 0.000 1.392 200 I CB -0.349 37.621 38.000 -0.050 0.000 1.065 200 I HN -0.053 8.157 8.210 0.000 0.000 0.418 201 T N -0.024 114.527 114.554 -0.005 0.000 2.821 201 T HA -0.158 4.191 4.350 -0.001 0.000 0.267 201 T C 1.757 176.586 174.700 0.215 0.000 1.046 201 T CA 1.339 63.486 62.100 0.078 0.000 1.139 201 T CB -0.329 68.576 68.868 0.061 0.000 0.871 201 T HN 0.358 8.598 8.240 0.000 0.000 0.454 202 Y N -0.241 120.096 120.300 0.061 0.000 2.133 202 Y HA -0.101 4.448 4.550 -0.001 0.000 0.287 202 Y C 2.350 178.320 175.900 0.117 0.000 1.134 202 Y CA 0.455 58.596 58.100 0.068 0.000 1.133 202 Y CB -0.372 38.125 38.460 0.062 0.000 0.987 202 Y HN 0.104 8.384 8.280 0.000 0.000 0.502 203 F N 1.156 121.195 119.950 0.148 0.000 2.154 203 F HA -0.266 4.260 4.527 -0.001 0.000 0.301 203 F C 1.970 177.800 175.800 0.051 0.000 1.087 203 F CA 1.180 59.227 58.000 0.078 0.000 1.274 203 F CB -0.700 38.327 39.000 0.045 0.000 1.009 203 F HN -0.040 8.260 8.300 0.000 0.000 0.485 204 I N -0.347 120.221 120.570 -0.003 0.000 2.493 204 I HA -0.270 3.900 4.170 -0.001 0.000 0.254 204 I C 2.458 178.531 176.117 -0.072 0.000 1.160 204 I CA 1.192 62.423 61.300 -0.115 0.000 1.445 204 I CB -0.529 37.456 38.000 -0.025 0.000 1.086 204 I HN 0.289 8.499 8.210 0.000 0.000 0.433 205 Q N 0.942 120.753 119.800 0.018 0.000 2.016 205 Q HA -0.253 4.086 4.340 -0.001 0.000 0.200 205 Q C 2.250 178.234 176.000 -0.026 0.000 0.978 205 Q CA 1.599 57.412 55.803 0.016 0.000 0.833 205 Q CB -0.021 28.753 28.738 0.060 0.000 0.895 205 Q HN 0.484 8.754 8.270 0.000 0.000 0.427 206 Q N 0.114 119.904 119.800 -0.017 0.000 2.030 206 Q HA -0.187 4.153 4.340 -0.001 0.000 0.204 206 Q C 2.294 178.243 176.000 -0.086 0.000 0.986 206 Q CA 1.729 57.514 55.803 -0.030 0.000 0.843 206 Q CB -0.170 28.587 28.738 0.031 0.000 0.904 206 Q HN 0.440 8.710 8.270 0.000 0.000 0.420 207 L N 0.324 121.432 121.223 -0.191 0.000 2.129 207 L HA -0.256 4.083 4.340 -0.001 0.000 0.212 207 L C 2.282 179.088 176.870 -0.106 0.000 1.087 207 L CA 0.975 55.694 54.840 -0.201 0.000 0.757 207 L CB -0.418 41.429 42.059 -0.353 0.000 0.896 207 L HN 0.289 8.519 8.230 0.000 0.000 0.434 208 L N -1.052 120.118 121.223 -0.088 0.000 2.068 208 L HA -0.131 4.208 4.340 -0.001 0.000 0.204 208 L C 2.796 179.645 176.870 -0.034 0.000 1.076 208 L CA 1.008 55.819 54.840 -0.049 0.000 0.753 208 L CB -0.453 41.586 42.059 -0.033 0.000 0.910 208 L HN 0.146 8.376 8.230 0.000 0.000 0.439 209 R N 0.235 120.713 120.500 -0.037 0.000 2.117 209 R HA -0.171 4.168 4.340 -0.001 0.000 0.243 209 R C 1.240 177.524 176.300 -0.026 0.000 1.143 209 R CA 1.469 57.550 56.100 -0.031 0.000 0.968 209 R CB -0.333 29.948 30.300 -0.032 0.000 0.863 209 R HN 0.398 8.668 8.270 0.000 0.000 0.444 210 D N -0.762 119.622 120.400 -0.027 0.000 2.352 210 D HA -0.045 4.594 4.640 -0.001 0.000 0.232 210 D C 1.315 177.609 176.300 -0.010 0.000 1.055 210 D CA 0.565 54.554 54.000 -0.018 0.000 0.891 210 D CB 0.369 41.158 40.800 -0.019 0.000 0.897 210 D HN 0.265 8.635 8.370 0.000 0.000 0.529 211 R N -0.238 120.255 120.500 -0.012 0.000 2.880 211 R HA -0.001 4.338 4.340 -0.001 0.000 0.156 211 R C -0.507 175.790 176.300 -0.004 0.000 0.884 211 R CA -0.118 55.979 56.100 -0.005 0.000 1.623 211 R CB 0.784 31.081 30.300 -0.005 0.000 1.687 211 R HN -0.131 8.139 8.270 0.000 0.000 0.538 212 E N 2.269 122.466 120.200 -0.005 0.000 2.266 212 E HA 0.254 4.604 4.350 -0.001 0.000 0.277 212 E C -0.253 176.347 176.600 -0.000 0.000 1.018 212 E CA -0.341 56.063 56.400 0.008 0.000 0.840 212 E CB 2.029 31.744 29.700 0.025 0.000 1.082 212 E HN 0.196 8.556 8.360 0.000 0.000 0.395 213 V N -1.821 118.096 119.914 0.007 0.000 2.994 213 V HA 0.835 4.954 4.120 -0.001 0.000 0.318 213 V C 1.043 177.129 176.094 -0.015 0.000 1.085 213 V CA -0.300 61.995 62.300 -0.008 0.000 0.998 213 V CB 1.271 33.093 31.823 -0.001 0.000 1.063 213 V HN 0.794 8.984 8.190 0.000 0.000 0.447 214 G N 1.305 110.077 108.800 -0.046 0.000 2.155 214 G HA2 -0.221 3.738 3.960 -0.001 0.000 0.257 214 G HA3 -0.221 3.738 3.960 -0.001 0.000 0.257 214 G C -0.073 174.679 174.900 -0.246 0.000 0.983 214 G CA 0.405 45.456 45.100 -0.081 0.000 0.676 214 G HN 0.876 9.166 8.290 0.000 0.000 0.528 215 I N 1.753 122.166 120.570 -0.261 0.000 2.322 215 I HA 0.210 4.379 4.170 -0.001 0.000 0.292 215 I C -1.795 174.094 176.117 -0.382 0.000 1.060 215 I CA -2.054 58.964 61.300 -0.470 0.000 1.309 215 I CB 1.072 38.939 38.000 -0.222 0.000 1.415 215 I HN -0.147 8.063 8.210 0.000 0.000 0.492 216 P HA -0.013 4.407 4.420 0.000 0.000 0.256 216 P C -1.966 175.248 177.300 -0.144 0.000 1.173 216 P CA -0.617 62.334 63.100 -0.248 0.000 0.768 216 P CB 0.116 31.687 31.700 -0.214 0.000 0.758 217 P HA -0.238 4.182 4.420 0.000 0.000 0.217 217 P C 1.133 178.409 177.300 -0.039 0.000 1.158 217 P CA 1.553 64.616 63.100 -0.061 0.000 0.887 217 P CB -0.039 31.632 31.700 -0.048 0.000 0.792 218 E N -0.851 119.334 120.200 -0.025 0.000 2.478 218 E HA -0.111 4.239 4.350 -0.001 0.000 0.198 218 E C 1.142 177.751 176.600 0.016 0.000 1.046 218 E CA 0.844 57.243 56.400 -0.001 0.000 0.870 218 E CB -0.262 29.444 29.700 0.010 0.000 0.818 218 E HN 0.540 8.900 8.360 0.000 0.000 0.527 219 Q N -0.395 119.407 119.800 0.003 0.000 2.175 219 Q HA 0.167 4.507 4.340 -0.001 0.000 0.225 219 Q C 1.490 177.509 176.000 0.033 0.000 0.837 219 Q CA -0.152 55.677 55.803 0.043 0.000 1.032 219 Q CB 0.790 29.568 28.738 0.067 0.000 1.137 219 Q HN -0.019 8.251 8.270 0.000 0.000 0.483 220 S N 1.096 116.798 115.700 0.003 0.000 2.335 220 S HA -0.139 4.331 4.470 -0.001 0.000 0.216 220 S C 1.726 176.345 174.600 0.032 0.000 1.032 220 S CA 1.024 59.223 58.200 -0.001 0.000 1.000 220 S CB -0.010 63.177 63.200 -0.023 0.000 0.928 220 S HN 0.464 8.774 8.310 0.000 0.000 0.434 221 L N 2.265 123.513 121.223 0.042 0.000 2.042 221 L HA -0.094 4.246 4.340 -0.001 0.000 0.210 221 L C 2.442 179.364 176.870 0.085 0.000 1.076 221 L CA 2.670 57.556 54.840 0.077 0.000 0.749 221 L CB -0.953 41.160 42.059 0.091 0.000 0.893 221 L HN 0.605 8.835 8.230 0.000 0.000 0.432 222 E N -1.213 119.042 120.200 0.091 0.000 2.033 222 E HA -0.283 4.066 4.350 -0.001 0.000 0.199 222 E C 1.885 178.544 176.600 0.098 0.000 1.011 222 E CA 2.340 58.806 56.400 0.110 0.000 0.815 222 E CB -0.396 29.389 29.700 0.141 0.000 0.755 222 E HN 0.530 8.890 8.360 0.000 0.000 0.451 223 T N 0.799 115.427 114.554 0.124 0.000 2.699 223 T HA -0.198 4.151 4.350 -0.001 0.000 0.268 223 T C 1.867 176.516 174.700 -0.084 0.000 1.036 223 T CA 1.635 63.773 62.100 0.063 0.000 1.147 223 T CB -0.435 68.551 68.868 0.197 0.000 0.862 223 T HN 0.435 8.675 8.240 0.000 0.000 0.446 224 A N 1.508 124.326 122.820 -0.003 0.000 1.873 224 A HA -0.071 4.249 4.320 -0.001 0.000 0.215 224 A C 2.230 179.825 177.584 0.019 0.000 1.186 224 A CA 1.861 53.900 52.037 0.003 0.000 0.616 224 A CB -0.559 18.468 19.000 0.045 0.000 0.823 224 A HN 0.482 8.632 8.150 0.000 0.000 0.442 225 K N -0.276 120.152 120.400 0.047 0.000 2.147 225 K HA -0.094 4.226 4.320 -0.001 0.000 0.205 225 K C 1.998 178.619 176.600 0.036 0.000 1.049 225 K CA 1.236 57.559 56.287 0.060 0.000 0.936 225 K CB -0.278 32.268 32.500 0.077 0.000 0.722 225 K HN 0.378 8.628 8.250 0.000 0.000 0.446 226 A N 0.382 123.197 122.820 -0.008 0.000 1.968 226 A HA -0.032 4.287 4.320 -0.001 0.000 0.217 226 A C 2.124 179.666 177.584 -0.071 0.000 1.169 226 A CA 1.055 53.068 52.037 -0.041 0.000 0.638 226 A CB -0.244 18.716 19.000 -0.066 0.000 0.812 226 A HN 0.156 8.306 8.150 0.000 0.000 0.446 227 V N 0.405 120.260 119.914 -0.098 0.000 2.379 227 V HA -0.230 3.890 4.120 -0.001 0.000 0.245 227 V C 2.505 178.692 176.094 0.155 0.000 1.044 227 V CA 2.233 64.562 62.300 0.049 0.000 1.036 227 V CB -0.609 31.208 31.823 -0.010 0.000 0.664 227 V HN 0.696 8.886 8.190 0.000 0.000 0.453 228 K N 0.382 120.852 120.400 0.117 0.000 2.026 228 K HA -0.230 4.089 4.320 -0.001 0.000 0.208 228 K C 2.041 178.781 176.600 0.234 0.000 1.048 228 K CA 2.000 58.403 56.287 0.194 0.000 0.929 228 K CB -0.141 32.471 32.500 0.187 0.000 0.713 228 K HN 0.546 8.796 8.250 0.000 0.000 0.439 229 E N -0.438 119.834 120.200 0.121 0.000 2.274 229 E HA -0.123 4.226 4.350 -0.001 0.000 0.194 229 E C 2.025 178.620 176.600 -0.009 0.000 0.996 229 E CA 0.755 57.186 56.400 0.051 0.000 0.840 229 E CB 0.225 29.928 29.700 0.005 0.000 0.772 229 E HN 0.241 8.601 8.360 0.000 0.000 0.491 230 R N -1.189 119.272 120.500 -0.067 0.000 2.195 230 R HA 0.078 4.418 4.340 -0.001 0.000 0.197 230 R C 0.849 176.881 176.300 -0.447 0.000 0.990 230 R CA 0.625 56.532 56.100 -0.322 0.000 1.048 230 R CB 0.413 30.391 30.300 -0.537 0.000 0.997 230 R HN 0.132 8.402 8.270 0.000 0.000 0.502 231 Y N -0.999 119.402 120.300 0.168 0.000 2.432 231 Y HA 0.389 4.938 4.550 -0.001 0.000 0.252 231 Y C 0.355 176.478 175.900 0.370 0.000 1.097 231 Y CA -0.483 57.758 58.100 0.234 0.000 1.250 231 Y CB 0.736 39.315 38.460 0.200 0.000 1.245 231 Y HN -0.203 8.077 8.280 0.000 0.000 0.522 232 S N 1.403 117.380 115.700 0.462 0.000 2.576 232 S HA 0.381 4.850 4.470 -0.001 0.000 0.276 232 S C -0.808 174.162 174.600 0.618 0.000 1.339 232 S CA -0.241 58.222 58.200 0.437 0.000 1.039 232 S CB 0.217 63.578 63.200 0.268 0.000 0.902 232 S HN 0.369 8.679 8.310 0.000 0.000 0.516 233 Y N -1.486 119.003 120.300 0.314 0.000 2.725 233 Y HA 0.725 5.274 4.550 -0.001 0.000 0.333 233 Y C -1.441 174.618 175.900 0.264 0.000 1.242 233 Y CA -1.490 56.819 58.100 0.348 0.000 1.059 233 Y CB 0.363 39.020 38.460 0.328 0.000 1.306 233 Y HN 0.258 8.538 8.280 0.000 0.000 0.454 234 V N 2.494 122.616 119.914 0.347 0.000 2.398 234 V HA 0.489 4.608 4.120 -0.001 0.000 0.286 234 V C 0.246 176.435 176.094 0.158 0.000 1.026 234 V CA -0.678 61.733 62.300 0.185 0.000 0.868 234 V CB 0.798 32.788 31.823 0.278 0.000 0.982 234 V HN 1.128 9.318 8.190 0.000 0.000 0.443 235 C N 4.848 124.133 119.300 -0.025 0.000 2.358 235 C HA 0.669 5.129 4.460 -0.001 0.000 0.354 235 C C -1.120 173.799 174.990 -0.118 0.000 1.183 235 C CA -1.514 57.480 59.018 -0.040 0.000 2.150 235 C CB 1.611 29.188 27.740 -0.271 0.000 2.361 235 C HN 0.699 8.929 8.230 0.000 0.000 0.535 236 P HA 0.137 4.557 4.420 0.000 0.000 0.221 236 P C -0.479 176.734 177.300 -0.146 0.000 1.155 236 P CA 1.422 64.444 63.100 -0.130 0.000 0.812 236 P CB 0.090 31.743 31.700 -0.078 0.000 0.801 237 D N -2.173 118.134 120.400 -0.156 0.000 2.891 237 D HA 0.166 4.806 4.640 -0.001 0.000 0.224 237 D C 0.723 176.915 176.300 -0.180 0.000 1.321 237 D CA -0.420 53.501 54.000 -0.130 0.000 0.929 237 D CB 0.743 41.486 40.800 -0.096 0.000 1.551 237 D HN -0.285 8.085 8.370 0.000 0.000 0.574 238 L N 2.728 123.892 121.223 -0.099 0.000 1.971 238 L HA -0.194 4.145 4.340 -0.001 0.000 0.215 238 L C 2.462 179.337 176.870 0.008 0.000 1.072 238 L CA 1.977 56.783 54.840 -0.057 0.000 0.758 238 L CB -0.604 41.551 42.059 0.160 0.000 0.889 238 L HN 0.607 8.837 8.230 0.000 0.000 0.433 239 V N -2.479 117.478 119.914 0.072 0.000 2.255 239 V HA -0.310 3.809 4.120 -0.001 0.000 0.247 239 V C 2.328 178.429 176.094 0.011 0.000 1.051 239 V CA 1.909 64.265 62.300 0.093 0.000 1.018 239 V CB -1.023 30.817 31.823 0.028 0.000 0.641 239 V HN 0.408 8.598 8.190 0.000 0.000 0.445 240 K N 0.043 120.403 120.400 -0.067 0.000 2.113 240 K HA -0.254 4.065 4.320 -0.001 0.000 0.208 240 K C 2.247 178.724 176.600 -0.204 0.000 1.047 240 K CA 2.108 58.334 56.287 -0.103 0.000 0.928 240 K CB -0.233 32.206 32.500 -0.102 0.000 0.716 240 K HN 0.582 8.832 8.250 0.000 0.000 0.446 241 E N 0.371 120.339 120.200 -0.387 0.000 2.028 241 E HA -0.116 4.233 4.350 -0.001 0.000 0.191 241 E C 1.625 177.881 176.600 -0.573 0.000 0.988 241 E CA 1.155 57.115 56.400 -0.734 0.000 0.799 241 E CB -0.157 28.674 29.700 -1.448 0.000 0.755 241 E HN 0.141 8.501 8.360 0.000 0.000 0.447 242 F N 1.172 120.899 119.950 -0.371 0.000 2.154 242 F HA -0.198 4.328 4.527 -0.001 0.000 0.301 242 F C 2.225 178.033 175.800 0.014 0.000 1.087 242 F CA 1.684 59.629 58.000 -0.092 0.000 1.274 242 F CB -0.709 38.210 39.000 -0.135 0.000 1.009 242 F HN 0.199 8.499 8.300 0.000 0.000 0.485 243 N N 0.252 119.034 118.700 0.136 0.000 2.043 243 N HA -0.230 4.509 4.740 -0.001 0.000 0.193 243 N C 1.882 177.448 175.510 0.092 0.000 1.037 243 N CA 1.401 54.509 53.050 0.096 0.000 0.851 243 N CB -0.023 38.483 38.487 0.031 0.000 1.027 243 N HN 0.239 8.619 8.380 0.000 0.000 0.422 244 K N -0.036 120.356 120.400 -0.013 0.000 2.001 244 K HA -0.222 4.097 4.320 -0.001 0.000 0.214 244 K C 2.056 178.711 176.600 0.093 0.000 1.050 244 K CA 1.903 58.147 56.287 -0.072 0.000 0.934 244 K CB -0.569 31.624 32.500 -0.513 0.000 0.718 244 K HN 0.378 8.628 8.250 0.000 0.000 0.443 245 Y N 1.427 121.672 120.300 -0.091 0.000 2.193 245 Y HA -0.267 4.283 4.550 -0.001 0.000 0.285 245 Y C 2.191 178.229 175.900 0.229 0.000 1.166 245 Y CA 0.813 59.017 58.100 0.174 0.000 1.181 245 Y CB -0.076 38.597 38.460 0.356 0.000 0.976 245 Y HN 0.174 8.454 8.280 0.000 0.000 0.520 246 D N -1.039 119.603 120.400 0.404 0.000 2.123 246 D HA -0.106 4.533 4.640 -0.001 0.000 0.200 246 D C 2.059 178.476 176.300 0.196 0.000 0.976 246 D CA 1.532 55.709 54.000 0.295 0.000 0.831 246 D CB -0.422 40.537 40.800 0.264 0.000 0.974 246 D HN 0.211 8.581 8.370 0.000 0.000 0.469 247 T N 0.146 114.804 114.554 0.173 0.000 2.571 247 T HA -0.134 4.215 4.350 -0.001 0.000 0.255 247 T C 0.925 175.711 174.700 0.144 0.000 1.100 247 T CA 1.154 63.335 62.100 0.135 0.000 1.199 247 T CB -0.311 68.627 68.868 0.117 0.000 0.870 247 T HN -0.016 8.224 8.240 0.000 0.000 0.399 248 D N 0.883 121.394 120.400 0.185 0.000 3.072 248 D HA 0.255 4.894 4.640 -0.001 0.000 0.250 248 D C 1.555 177.997 176.300 0.236 0.000 1.304 248 D CA -0.205 53.912 54.000 0.195 0.000 0.861 248 D CB -0.558 40.377 40.800 0.226 0.000 1.062 248 D HN 0.363 8.733 8.370 0.000 0.000 0.481 249 G N -0.193 108.717 108.800 0.183 0.000 2.532 249 G HA2 -0.313 3.646 3.960 -0.001 0.000 0.222 249 G HA3 -0.313 3.646 3.960 -0.001 0.000 0.222 249 G C 1.502 176.439 174.900 0.062 0.000 1.102 249 G CA 0.947 46.132 45.100 0.141 0.000 0.742 249 G HN 0.426 8.716 8.290 0.000 0.000 0.577 250 S N -0.123 115.603 115.700 0.044 0.000 2.423 250 S HA -0.015 4.455 4.470 -0.001 0.000 0.231 250 S C 2.015 176.569 174.600 -0.076 0.000 1.014 250 S CA 1.287 59.480 58.200 -0.012 0.000 0.965 250 S CB -0.157 63.040 63.200 -0.006 0.000 0.785 250 S HN 0.495 8.805 8.310 0.000 0.000 0.495 251 K N -1.315 119.020 120.400 -0.108 0.000 2.372 251 K HA 0.148 4.467 4.320 -0.001 0.000 0.200 251 K C 0.279 176.467 176.600 -0.687 0.000 1.022 251 K CA -0.075 56.008 56.287 -0.339 0.000 1.125 251 K CB 0.276 32.565 32.500 -0.352 0.000 0.855 251 K HN 0.475 8.725 8.250 0.000 0.000 0.524 252 W N 0.099 121.235 121.300 -0.273 0.000 3.336 252 W HA 0.255 4.915 4.660 -0.000 0.000 0.221 252 W C 0.225 176.432 176.519 -0.521 0.000 1.086 252 W CA -0.544 56.483 57.345 -0.530 0.000 1.457 252 W CB 0.619 29.422 29.460 -1.095 0.000 0.756 252 W HN -0.200 7.980 8.180 0.000 0.000 0.783 253 I N 2.753 123.223 120.570 -0.166 0.000 2.638 253 I HA 0.139 4.308 4.170 -0.001 0.000 0.286 253 I C 0.436 176.485 176.117 -0.113 0.000 1.088 253 I CA -0.036 61.201 61.300 -0.104 0.000 1.397 253 I CB 0.148 38.112 38.000 -0.060 0.000 1.414 253 I HN -0.170 8.040 8.210 0.000 0.000 0.566 254 K N 4.612 124.922 120.400 -0.150 0.000 2.349 254 K HA 0.559 4.879 4.320 -0.001 0.000 0.243 254 K C -0.560 175.929 176.600 -0.186 0.000 1.058 254 K CA -0.861 55.293 56.287 -0.222 0.000 0.871 254 K CB 1.444 33.635 32.500 -0.515 0.000 1.337 254 K HN 0.374 8.624 8.250 0.000 0.000 0.469 255 Q N 0.530 120.246 119.800 -0.141 0.000 2.387 255 Q HA 0.441 4.780 4.340 -0.001 0.000 0.273 255 Q C -1.281 174.751 176.000 0.053 0.000 1.089 255 Q CA -0.877 54.902 55.803 -0.039 0.000 0.824 255 Q CB 2.155 30.881 28.738 -0.019 0.000 1.367 255 Q HN 0.623 8.893 8.270 0.000 0.000 0.443 256 Y N 0.251 120.536 120.300 -0.026 0.000 2.330 256 Y HA 0.374 4.923 4.550 -0.001 0.000 0.324 256 Y C -1.334 174.559 175.900 -0.013 0.000 1.093 256 Y CA -0.517 57.607 58.100 0.041 0.000 1.103 256 Y CB 1.646 40.168 38.460 0.102 0.000 1.183 256 Y HN 0.634 8.914 8.280 0.000 0.000 0.433 257 T N 2.609 116.708 114.554 -0.760 0.000 2.772 257 T HA 0.808 5.158 4.350 -0.001 0.000 0.288 257 T C 0.211 174.223 174.700 -1.146 0.000 0.994 257 T CA -0.292 61.346 62.100 -0.769 0.000 0.951 257 T CB 1.178 69.796 68.868 -0.416 0.000 0.933 257 T HN 0.960 9.200 8.240 0.000 0.000 0.447 258 G N 2.027 109.942 108.800 -1.475 0.000 2.521 258 G HA2 0.655 4.614 3.960 -0.001 0.000 0.323 258 G HA3 0.655 4.614 3.960 -0.001 0.000 0.323 258 G C -1.023 173.225 174.900 -1.087 0.000 1.211 258 G CA -1.023 43.361 45.100 -1.194 0.000 0.979 258 G HN 0.696 8.986 8.290 0.000 0.000 0.490 259 I N 1.167 121.489 120.570 -0.412 0.000 2.355 259 I HA 0.195 4.364 4.170 -0.001 0.000 0.288 259 I C 0.221 176.430 176.117 0.154 0.000 0.999 259 I CA -1.068 60.145 61.300 -0.144 0.000 1.163 259 I CB 1.394 39.350 38.000 -0.073 0.000 1.316 259 I HN 0.325 8.535 8.210 0.000 0.000 0.454 260 N N 4.887 123.761 118.700 0.291 0.000 2.365 260 N HA -0.008 4.732 4.740 -0.001 0.000 0.265 260 N C 0.593 176.202 175.510 0.165 0.000 1.288 260 N CA 0.250 53.493 53.050 0.323 0.000 0.869 260 N CB 1.030 39.671 38.487 0.257 0.000 1.071 260 N HN 0.745 9.125 8.380 0.000 0.000 0.480 261 A N 4.512 127.419 122.820 0.145 0.000 2.346 261 A HA 0.171 4.490 4.320 -0.001 0.000 0.242 261 A C 1.320 178.943 177.584 0.065 0.000 1.323 261 A CA 0.046 52.139 52.037 0.093 0.000 0.940 261 A CB -0.197 18.856 19.000 0.089 0.000 0.943 261 A HN 0.808 8.958 8.150 0.000 0.000 0.501 262 I N -2.217 118.392 120.570 0.064 0.000 3.481 262 I HA -0.028 4.141 4.170 -0.001 0.000 0.267 262 I C 2.114 178.256 176.117 0.042 0.000 1.044 262 I CA 0.851 62.178 61.300 0.044 0.000 1.902 262 I CB 0.032 38.052 38.000 0.033 0.000 1.680 262 I HN 0.276 8.486 8.210 0.000 0.000 0.426 263 S N 1.003 116.731 115.700 0.047 0.000 2.607 263 S HA 0.015 4.484 4.470 -0.001 0.000 0.224 263 S C 0.791 175.420 174.600 0.049 0.000 0.969 263 S CA 0.107 58.332 58.200 0.042 0.000 0.927 263 S CB -0.512 62.714 63.200 0.043 0.000 0.772 263 S HN 0.331 8.641 8.310 0.000 0.000 0.533 264 K N 0.437 120.872 120.400 0.059 0.000 3.010 264 K HA -0.163 4.156 4.320 -0.001 0.000 0.255 264 K C -0.347 176.281 176.600 0.046 0.000 0.929 264 K CA 0.749 57.068 56.287 0.054 0.000 0.687 264 K CB -0.880 31.641 32.500 0.034 0.000 1.304 264 K HN 0.381 8.631 8.250 0.000 0.000 0.479 265 K N 1.261 121.703 120.400 0.069 0.000 2.095 265 K HA 0.165 4.485 4.320 -0.001 0.000 0.252 265 K C 0.021 176.656 176.600 0.058 0.000 0.977 265 K CA -0.466 55.855 56.287 0.056 0.000 0.900 265 K CB 1.251 33.791 32.500 0.067 0.000 1.060 265 K HN 0.212 8.462 8.250 0.000 0.000 0.449 266 E N 2.890 123.090 120.200 0.001 0.000 1.996 266 E HA 0.101 4.450 4.350 -0.001 0.000 0.280 266 E C -0.972 175.602 176.600 -0.044 0.000 1.092 266 E CA -0.454 55.891 56.400 -0.091 0.000 0.862 266 E CB -0.052 29.581 29.700 -0.111 0.000 1.066 266 E HN 0.303 8.663 8.360 0.000 0.000 0.396 267 F N 2.728 122.658 119.950 -0.034 0.000 2.408 267 F HA 0.551 5.077 4.527 -0.001 0.000 0.344 267 F C -0.363 175.413 175.800 -0.040 0.000 1.112 267 F CA -0.986 57.002 58.000 -0.020 0.000 1.096 267 F CB 1.133 40.137 39.000 0.007 0.000 1.129 267 F HN 0.179 8.479 8.300 0.000 0.000 0.486 268 S N 5.352 121.134 115.700 0.136 0.000 2.600 268 S HA 0.929 5.398 4.470 -0.001 0.000 0.300 268 S C -0.707 174.000 174.600 0.179 0.000 1.087 268 S CA -0.716 57.518 58.200 0.057 0.000 0.965 268 S CB 1.993 65.179 63.200 -0.024 0.000 1.089 268 S HN 1.163 9.473 8.310 0.000 0.000 0.496 269 I N -1.879 118.792 120.570 0.168 0.000 2.918 269 I HA 0.585 4.755 4.170 -0.001 0.000 0.301 269 I C -1.859 174.316 176.117 0.096 0.000 1.312 269 I CA -1.015 60.378 61.300 0.156 0.000 1.007 269 I CB 2.064 40.200 38.000 0.226 0.000 1.281 269 I HN 0.398 8.608 8.210 0.000 0.000 0.440 270 D N 3.212 123.637 120.400 0.042 0.000 2.283 270 D HA 0.517 5.156 4.640 -0.001 0.000 0.248 270 D C -0.537 175.744 176.300 -0.030 0.000 1.072 270 D CA -0.184 53.811 54.000 -0.009 0.000 0.929 270 D CB 2.713 43.498 40.800 -0.026 0.000 1.182 270 D HN 0.317 8.687 8.370 0.000 0.000 0.433 271 V N 1.117 120.979 119.914 -0.087 0.000 2.407 271 V HA 0.666 4.786 4.120 -0.001 0.000 0.291 271 V C 0.757 176.824 176.094 -0.045 0.000 1.018 271 V CA -0.358 61.880 62.300 -0.104 0.000 0.842 271 V CB 1.386 33.057 31.823 -0.254 0.000 0.996 271 V HN 0.724 8.914 8.190 0.000 0.000 0.426 272 G N 1.759 110.545 108.800 -0.024 0.000 3.340 272 G HA2 0.313 4.273 3.960 -0.001 0.000 0.176 272 G HA3 0.313 4.273 3.960 -0.001 0.000 0.176 272 G C 0.550 175.453 174.900 0.005 0.000 1.103 272 G CA -0.154 45.000 45.100 0.090 0.000 0.779 272 G HN 0.534 8.824 8.290 0.000 0.000 0.673 273 Y N 1.638 121.828 120.300 -0.184 0.000 2.331 273 Y HA -0.397 4.153 4.550 -0.000 0.000 0.254 273 Y C 3.075 178.340 175.900 -1.059 0.000 1.346 273 Y CA 1.950 59.512 58.100 -0.897 0.000 1.037 273 Y CB -0.249 37.957 38.460 -0.424 0.000 0.840 273 Y HN 0.537 8.817 8.280 0.000 0.000 0.528 274 E N 1.531 121.513 120.200 -0.364 0.000 2.273 274 E HA -0.244 4.105 4.350 -0.001 0.000 0.198 274 E C 1.726 178.168 176.600 -0.263 0.000 1.002 274 E CA 1.515 57.719 56.400 -0.326 0.000 0.828 274 E CB -0.604 28.974 29.700 -0.204 0.000 0.747 274 E HN 0.596 8.956 8.360 0.000 0.000 0.491 275 R N 0.074 120.467 120.500 -0.177 0.000 2.091 275 R HA -0.134 4.206 4.340 -0.001 0.000 0.238 275 R C 2.455 178.644 176.300 -0.184 0.000 1.136 275 R CA 2.281 58.414 56.100 0.055 0.000 0.959 275 R CB -0.478 30.101 30.300 0.465 0.000 0.856 275 R HN 0.462 8.732 8.270 0.000 0.000 0.437 276 F N -2.211 117.506 119.950 -0.389 0.000 2.559 276 F HA 0.238 4.764 4.527 -0.001 0.000 0.286 276 F C 1.757 177.401 175.800 -0.261 0.000 1.108 276 F CA -0.155 57.502 58.000 -0.571 0.000 1.436 276 F CB -0.574 37.978 39.000 -0.746 0.000 1.130 276 F HN -0.201 8.098 8.300 0.000 0.000 0.584 277 L N 1.318 122.252 121.223 -0.481 0.000 2.191 277 L HA -0.029 4.311 4.340 -0.001 0.000 0.212 277 L C 2.672 179.657 176.870 0.191 0.000 1.103 277 L CA 1.189 56.010 54.840 -0.032 0.000 0.769 277 L CB -1.061 40.912 42.059 -0.143 0.000 0.908 277 L HN 0.478 8.708 8.230 0.000 0.000 0.438 278 G N 0.970 109.766 108.800 -0.007 0.000 2.604 278 G HA2 -0.228 3.731 3.960 -0.001 0.000 0.216 278 G HA3 -0.228 3.731 3.960 -0.001 0.000 0.216 278 G C -0.836 174.044 174.900 -0.033 0.000 1.265 278 G CA 0.726 45.847 45.100 0.035 0.000 0.804 278 G HN 0.288 8.578 8.290 0.000 0.000 0.579 279 P HA -0.004 4.416 4.420 0.000 0.000 0.222 279 P C 1.376 178.793 177.300 0.195 0.000 1.147 279 P CA 1.293 64.302 63.100 -0.152 0.000 0.790 279 P CB 0.103 31.605 31.700 -0.329 0.000 0.780 280 E N 0.841 121.153 120.200 0.187 0.000 2.160 280 E HA -0.187 4.162 4.350 -0.001 0.000 0.195 280 E C 1.637 178.308 176.600 0.119 0.000 0.991 280 E CA 0.860 57.422 56.400 0.268 0.000 0.810 280 E CB -1.244 28.611 29.700 0.259 0.000 0.742 280 E HN 0.346 8.706 8.360 0.000 0.000 0.466 281 I N -2.091 118.479 120.570 0.000 0.000 3.241 281 I HA -0.082 4.087 4.170 -0.001 0.000 0.280 281 I C 1.198 177.196 176.117 -0.198 0.000 1.320 281 I CA 0.588 61.786 61.300 -0.170 0.000 1.413 281 I CB -0.300 37.542 38.000 -0.264 0.000 1.060 281 I HN -0.080 8.130 8.210 0.000 0.000 0.500 282 F N 0.996 120.809 119.950 -0.227 0.000 2.335 282 F HA 0.122 4.648 4.527 -0.002 0.000 0.296 282 F C 1.645 177.033 175.800 -0.687 0.000 1.091 282 F CA 1.433 59.169 58.000 -0.441 0.000 1.399 282 F CB -0.214 38.441 39.000 -0.574 0.000 1.067 282 F HN 0.036 8.336 8.300 0.000 0.000 0.520 283 F N -2.402 117.533 119.950 -0.024 0.000 2.656 283 F HA 0.126 4.652 4.527 -0.002 0.000 0.291 283 F C 0.454 175.881 175.800 -0.622 0.000 1.122 283 F CA 0.414 58.232 58.000 -0.302 0.000 1.427 283 F CB -0.335 38.454 39.000 -0.352 0.000 1.125 283 F HN -0.153 8.147 8.300 0.000 0.000 0.583 284 H N -0.745 118.207 119.070 -0.197 0.000 2.380 284 H HA 0.236 4.791 4.556 -0.002 0.000 0.231 284 H C -2.054 173.067 175.328 -0.345 0.000 1.415 284 H CA -1.635 54.154 56.048 -0.432 0.000 1.433 284 H CB 0.561 29.641 29.762 -1.137 0.000 1.544 284 H HN -0.141 8.139 8.280 0.000 0.000 0.503 285 P HA -0.267 4.153 4.420 0.000 0.000 0.216 285 P C 1.504 178.825 177.300 0.035 0.000 1.153 285 P CA 1.478 64.579 63.100 0.001 0.000 0.858 285 P CB 0.309 32.117 31.700 0.179 0.000 0.789 286 E N -1.344 118.901 120.200 0.075 0.000 2.333 286 E HA -0.219 4.130 4.350 -0.001 0.000 0.200 286 E C 1.308 178.021 176.600 0.188 0.000 1.010 286 E CA 0.874 57.345 56.400 0.118 0.000 0.841 286 E CB -1.080 28.696 29.700 0.127 0.000 0.757 286 E HN 0.138 8.498 8.360 0.000 0.000 0.508 287 F N 1.246 121.129 119.950 -0.112 0.000 2.269 287 F HA 0.032 4.558 4.527 -0.002 0.000 0.301 287 F C 2.076 177.631 175.800 -0.408 0.000 1.082 287 F CA 0.926 58.782 58.000 -0.240 0.000 1.360 287 F CB -0.032 38.769 39.000 -0.332 0.000 1.041 287 F HN 0.231 8.531 8.300 0.000 0.000 0.512 288 A N -1.552 121.166 122.820 -0.169 0.000 2.701 288 A HA 0.212 4.532 4.320 -0.001 0.000 0.241 288 A C 0.211 177.767 177.584 -0.047 0.000 1.231 288 A CA -0.274 51.647 52.037 -0.194 0.000 1.003 288 A CB -0.238 18.532 19.000 -0.384 0.000 1.281 288 A HN 0.247 8.397 8.150 0.000 0.000 0.600 289 N N 0.407 119.104 118.700 -0.005 0.000 2.519 289 N HA 0.372 5.111 4.740 -0.001 0.000 0.286 289 N C -2.576 172.972 175.510 0.062 0.000 1.079 289 N CA -1.583 51.490 53.050 0.038 0.000 0.878 289 N CB 2.036 40.556 38.487 0.056 0.000 1.375 289 N HN -0.194 8.186 8.380 0.000 0.000 0.514 290 P HA 0.002 4.422 4.420 0.000 0.000 0.219 290 P C -0.298 177.034 177.300 0.054 0.000 1.150 290 P CA 1.091 64.218 63.100 0.045 0.000 0.814 290 P CB 0.289 32.010 31.700 0.034 0.000 0.787 291 D N -2.534 117.913 120.400 0.078 0.000 2.340 291 D HA 0.079 4.719 4.640 -0.001 0.000 0.220 291 D C -0.153 176.250 176.300 0.171 0.000 1.039 291 D CA 0.453 54.511 54.000 0.096 0.000 0.866 291 D CB -0.167 40.685 40.800 0.087 0.000 0.913 291 D HN 0.141 8.511 8.370 0.000 0.000 0.523 292 F N 0.394 120.336 119.950 -0.013 0.000 2.585 292 F HA 0.301 4.829 4.527 0.001 0.000 0.319 292 F C 0.545 176.335 175.800 -0.017 0.000 1.165 292 F CA -0.586 57.403 58.000 -0.018 0.000 0.949 292 F CB 1.830 40.812 39.000 -0.030 0.000 1.218 292 F HN -0.157 8.143 8.300 0.000 0.000 0.453 293 T N -0.033 114.285 114.554 -0.394 0.000 2.958 293 T HA 0.130 4.480 4.350 -0.001 0.000 0.256 293 T C 0.544 175.056 174.700 -0.312 0.000 0.983 293 T CA -0.116 61.850 62.100 -0.222 0.000 0.924 293 T CB -0.142 68.649 68.868 -0.128 0.000 1.136 293 T HN 0.547 8.787 8.240 0.000 0.000 0.506 294 Q N 3.246 122.650 119.800 -0.660 0.000 2.244 294 Q HA 0.202 4.541 4.340 -0.001 0.000 0.278 294 Q C -2.569 173.316 176.000 -0.191 0.000 1.093 294 Q CA -1.732 53.793 55.803 -0.463 0.000 0.916 294 Q CB 0.370 28.737 28.738 -0.618 0.000 1.159 294 Q HN 0.189 8.459 8.270 0.000 0.000 0.384 295 P HA -0.060 4.360 4.420 0.000 0.000 0.268 295 P C 0.415 177.720 177.300 0.009 0.000 1.205 295 P CA 0.146 63.210 63.100 -0.061 0.000 0.771 295 P CB 0.572 32.218 31.700 -0.090 0.000 0.858 296 I N 2.416 122.981 120.570 -0.009 0.000 2.315 296 I HA -0.327 3.842 4.170 -0.001 0.000 0.251 296 I C 1.732 177.861 176.117 0.019 0.000 1.125 296 I CA 2.136 63.444 61.300 0.014 0.000 1.392 296 I CB -0.065 37.882 38.000 -0.089 0.000 1.065 296 I HN 0.361 8.571 8.210 0.000 0.000 0.424 297 S N -0.196 115.519 115.700 0.025 0.000 2.382 297 S HA -0.213 4.256 4.470 -0.001 0.000 0.228 297 S C 1.789 176.421 174.600 0.053 0.000 1.027 297 S CA 1.273 59.504 58.200 0.053 0.000 0.991 297 S CB -0.518 62.725 63.200 0.072 0.000 0.823 297 S HN 0.590 8.900 8.310 0.000 0.000 0.469 298 E N 0.807 121.029 120.200 0.037 0.000 2.107 298 E HA -0.030 4.319 4.350 -0.001 0.000 0.191 298 E C 2.110 178.738 176.600 0.047 0.000 0.982 298 E CA 1.030 57.450 56.400 0.033 0.000 0.809 298 E CB -0.265 29.436 29.700 0.001 0.000 0.756 298 E HN 0.387 8.747 8.360 0.000 0.000 0.459 299 V N 0.918 120.870 119.914 0.063 0.000 2.392 299 V HA -0.239 3.881 4.120 -0.001 0.000 0.249 299 V C 2.302 178.436 176.094 0.067 0.000 1.059 299 V CA 1.281 63.635 62.300 0.090 0.000 1.051 299 V CB -0.396 31.517 31.823 0.150 0.000 0.658 299 V HN 0.134 8.324 8.190 0.000 0.000 0.455 300 V N 0.529 120.478 119.914 0.058 0.000 2.307 300 V HA -0.271 3.848 4.120 -0.001 0.000 0.245 300 V C 2.367 178.470 176.094 0.015 0.000 1.045 300 V CA 2.374 64.695 62.300 0.036 0.000 1.024 300 V CB -0.696 31.153 31.823 0.044 0.000 0.651 300 V HN 0.645 8.835 8.190 0.000 0.000 0.449 301 D N 0.039 120.477 120.400 0.064 0.000 2.123 301 D HA -0.249 4.390 4.640 -0.001 0.000 0.196 301 D C 2.202 178.539 176.300 0.062 0.000 0.992 301 D CA 1.802 55.868 54.000 0.110 0.000 0.833 301 D CB -0.119 40.768 40.800 0.144 0.000 0.954 301 D HN 0.564 8.934 8.370 0.000 0.000 0.455 302 E N -0.520 119.709 120.200 0.048 0.000 2.077 302 E HA -0.150 4.199 4.350 -0.001 0.000 0.193 302 E C 2.153 178.765 176.600 0.021 0.000 0.989 302 E CA 1.004 57.426 56.400 0.038 0.000 0.800 302 E CB 0.053 29.776 29.700 0.038 0.000 0.746 302 E HN 0.171 8.531 8.360 0.000 0.000 0.452 303 V N 1.459 121.380 119.914 0.012 0.000 2.255 303 V HA -0.289 3.830 4.120 -0.001 0.000 0.247 303 V C 2.426 178.497 176.094 -0.038 0.000 1.051 303 V CA 1.875 64.175 62.300 0.001 0.000 1.018 303 V CB -0.409 31.420 31.823 0.010 0.000 0.641 303 V HN 0.360 8.550 8.190 0.000 0.000 0.445 304 I N -0.472 120.033 120.570 -0.110 0.000 2.286 304 I HA -0.253 3.916 4.170 -0.001 0.000 0.248 304 I C 2.660 178.717 176.117 -0.100 0.000 1.115 304 I CA 1.210 62.387 61.300 -0.205 0.000 1.392 304 I CB -0.455 37.191 38.000 -0.590 0.000 1.065 304 I HN 0.344 8.554 8.210 0.000 0.000 0.418 305 Q N 0.617 120.402 119.800 -0.026 0.000 2.167 305 Q HA -0.116 4.223 4.340 -0.001 0.000 0.202 305 Q C 1.701 177.717 176.000 0.025 0.000 0.970 305 Q CA 1.087 56.912 55.803 0.037 0.000 0.855 305 Q CB -0.429 28.349 28.738 0.067 0.000 0.911 305 Q HN 0.596 8.866 8.270 0.000 0.000 0.438 306 N N -0.462 118.246 118.700 0.014 0.000 2.515 306 N HA -0.037 4.703 4.740 -0.001 0.000 0.185 306 N C 0.392 175.910 175.510 0.014 0.000 1.109 306 N CA 0.135 53.194 53.050 0.016 0.000 0.903 306 N CB 0.099 38.597 38.487 0.017 0.000 0.969 306 N HN 0.127 8.507 8.380 0.000 0.000 0.450 307 C N 1.533 120.836 119.300 0.005 0.000 2.443 307 C HA 0.296 4.755 4.460 -0.001 0.000 0.369 307 C C -1.938 173.062 174.990 0.017 0.000 1.241 307 C CA -1.196 57.827 59.018 0.008 0.000 2.413 307 C CB 0.885 28.620 27.740 -0.009 0.000 2.451 307 C HN 0.166 8.396 8.230 0.000 0.000 0.595 308 P HA -0.020 4.400 4.420 0.000 0.000 0.260 308 P C 0.843 178.163 177.300 0.033 0.000 1.185 308 P CA 0.379 63.495 63.100 0.027 0.000 0.763 308 P CB 0.155 31.872 31.700 0.027 0.000 0.776 309 I N 5.035 125.627 120.570 0.037 0.000 2.143 309 I HA -0.311 3.858 4.170 -0.001 0.000 0.245 309 I C 1.351 177.498 176.117 0.050 0.000 1.068 309 I CA 1.927 63.255 61.300 0.047 0.000 1.326 309 I CB -0.621 37.403 38.000 0.041 0.000 1.028 309 I HN 0.404 8.614 8.210 0.000 0.000 0.412 310 D N -0.432 119.992 120.400 0.041 0.000 2.400 310 D HA -0.105 4.534 4.640 -0.001 0.000 0.242 310 D C 1.546 177.872 176.300 0.044 0.000 1.077 310 D CA 0.789 54.813 54.000 0.040 0.000 0.943 310 D CB -0.227 40.593 40.800 0.033 0.000 0.882 310 D HN 0.408 8.778 8.370 0.000 0.000 0.529 311 V N -0.577 119.365 119.914 0.047 0.000 3.432 311 V HA 0.073 4.192 4.120 -0.001 0.000 0.290 311 V C 1.822 177.943 176.094 0.046 0.000 1.591 311 V CA -0.188 62.140 62.300 0.046 0.000 1.069 311 V CB 0.152 31.999 31.823 0.040 0.000 0.892 311 V HN -0.058 8.132 8.190 0.000 0.000 0.436 312 R N 0.136 120.670 120.500 0.057 0.000 2.096 312 R HA -0.069 4.271 4.340 -0.001 0.000 0.235 312 R C 2.239 178.646 176.300 0.177 0.000 1.127 312 R CA 1.761 57.895 56.100 0.058 0.000 0.968 312 R CB -0.230 30.140 30.300 0.118 0.000 0.861 312 R HN 0.410 8.680 8.270 0.000 0.000 0.440 313 R N 0.127 120.748 120.500 0.203 0.000 2.081 313 R HA -0.081 4.258 4.340 -0.001 0.000 0.235 313 R C -0.694 175.711 176.300 0.175 0.000 1.131 313 R CA 1.386 57.624 56.100 0.229 0.000 0.960 313 R CB -1.027 29.349 30.300 0.126 0.000 0.856 313 R HN 0.190 8.460 8.270 0.000 0.000 0.436 314 P HA -0.146 4.274 4.420 0.000 0.000 0.216 314 P C 1.067 178.413 177.300 0.076 0.000 1.153 314 P CA 1.187 64.336 63.100 0.083 0.000 0.848 314 P CB 0.019 31.756 31.700 0.062 0.000 0.787 315 L N -2.623 118.624 121.223 0.039 0.000 2.046 315 L HA -0.220 4.119 4.340 -0.001 0.000 0.208 315 L C 2.459 179.320 176.870 -0.016 0.000 1.077 315 L CA 1.657 56.482 54.840 -0.024 0.000 0.747 315 L CB -1.004 40.983 42.059 -0.120 0.000 0.896 315 L HN -0.008 8.222 8.230 0.000 0.000 0.432 316 Y N 0.048 120.371 120.300 0.039 0.000 2.224 316 Y HA -0.252 4.297 4.550 -0.001 0.000 0.289 316 Y C 2.635 178.556 175.900 0.035 0.000 1.146 316 Y CA 1.401 59.521 58.100 0.034 0.000 1.182 316 Y CB -0.268 38.208 38.460 0.027 0.000 0.983 316 Y HN 0.062 8.342 8.280 0.000 0.000 0.524 317 K N 0.166 120.683 120.400 0.195 0.000 2.288 317 K HA -0.079 4.241 4.320 -0.001 0.000 0.201 317 K C 0.308 176.967 176.600 0.098 0.000 1.048 317 K CA 0.685 57.046 56.287 0.124 0.000 0.956 317 K CB -0.047 32.511 32.500 0.097 0.000 0.746 317 K HN 0.202 8.452 8.250 0.000 0.000 0.461 318 N N 0.730 119.486 118.700 0.093 0.000 2.765 318 N HA 0.178 4.918 4.740 -0.001 0.000 0.277 318 N C -1.391 174.166 175.510 0.078 0.000 1.750 318 N CA -0.223 52.878 53.050 0.085 0.000 0.827 318 N CB 0.513 39.050 38.487 0.084 0.000 1.200 318 N HN -0.025 8.355 8.380 0.000 0.000 0.494 319 I N 2.105 122.725 120.570 0.083 0.000 2.301 319 I HA 0.224 4.394 4.170 -0.001 0.000 0.292 319 I C 0.012 176.183 176.117 0.091 0.000 1.046 319 I CA -0.605 60.742 61.300 0.078 0.000 1.282 319 I CB 1.379 39.428 38.000 0.082 0.000 1.409 319 I HN -0.064 8.146 8.210 0.000 0.000 0.484 320 V N 7.603 127.569 119.914 0.086 0.000 2.472 320 V HA 0.411 4.531 4.120 -0.001 0.000 0.290 320 V C 0.263 176.410 176.094 0.088 0.000 1.037 320 V CA -0.601 61.761 62.300 0.104 0.000 0.908 320 V CB 1.828 33.708 31.823 0.096 0.000 0.985 320 V HN 0.482 8.672 8.190 0.000 0.000 0.454 321 L N 3.482 124.755 121.223 0.084 0.000 2.343 321 L HA 0.745 5.085 4.340 -0.001 0.000 0.275 321 L C 0.103 176.949 176.870 -0.039 0.000 1.056 321 L CA -0.066 54.775 54.840 0.001 0.000 0.804 321 L CB 1.767 43.797 42.059 -0.047 0.000 1.203 321 L HN 0.690 8.920 8.230 0.000 0.000 0.440 322 S N 0.960 116.608 115.700 -0.086 0.000 2.566 322 S HA 0.806 5.275 4.470 -0.001 0.000 0.273 322 S C -0.645 173.879 174.600 -0.126 0.000 1.157 322 S CA 0.196 58.345 58.200 -0.084 0.000 0.938 322 S CB 1.574 64.767 63.200 -0.011 0.000 1.087 322 S HN 1.191 9.501 8.310 0.000 0.000 0.474 323 G N 2.165 110.866 108.800 -0.165 0.000 2.539 323 G HA2 0.254 4.213 3.960 -0.001 0.000 0.686 323 G HA3 0.254 4.213 3.960 -0.001 0.000 0.686 323 G C 0.643 175.376 174.900 -0.278 0.000 1.258 323 G CA -0.050 44.943 45.100 -0.179 0.000 0.846 323 G HN 1.497 9.787 8.290 0.000 0.000 0.647 324 G N -0.421 108.209 108.800 -0.283 0.000 2.443 324 G HA2 0.107 4.066 3.960 -0.001 0.000 0.219 324 G HA3 0.107 4.066 3.960 -0.001 0.000 0.219 324 G C 1.778 176.448 174.900 -0.383 0.000 1.131 324 G CA 1.838 46.729 45.100 -0.348 0.000 0.775 324 G HN 1.402 9.692 8.290 0.000 0.000 0.547 325 S N 0.176 115.728 115.700 -0.248 0.000 2.660 325 S HA 0.024 4.493 4.470 -0.001 0.000 0.223 325 S C 1.943 176.348 174.600 -0.325 0.000 0.963 325 S CA 1.166 59.292 58.200 -0.123 0.000 0.932 325 S CB -0.059 63.246 63.200 0.175 0.000 0.775 325 S HN 0.657 8.967 8.310 0.000 0.000 0.531 326 T N -2.195 112.010 114.554 -0.582 0.000 3.084 326 T HA 0.301 4.650 4.350 -0.001 0.000 0.270 326 T C 1.187 175.533 174.700 -0.590 0.000 1.008 326 T CA -0.293 61.238 62.100 -0.949 0.000 0.900 326 T CB -0.046 68.376 68.868 -0.743 0.000 1.084 326 T HN 0.096 8.336 8.240 0.000 0.000 0.538 327 M N 0.847 120.111 119.600 -0.559 0.000 2.558 327 M HA 0.372 4.852 4.480 -0.001 0.000 0.255 327 M C -0.300 175.816 176.300 -0.306 0.000 1.113 327 M CA -0.456 54.587 55.300 -0.429 0.000 1.097 327 M CB -1.142 31.179 32.600 -0.465 0.000 1.426 327 M HN 0.244 8.534 8.290 0.000 0.000 0.488 328 F N 1.556 121.518 119.950 0.021 0.000 2.572 328 F HA 0.087 4.613 4.527 -0.001 0.000 0.370 328 F C 1.394 177.318 175.800 0.207 0.000 1.103 328 F CA -0.153 57.945 58.000 0.163 0.000 1.286 328 F CB -0.108 39.052 39.000 0.266 0.000 1.105 328 F HN 0.027 8.327 8.300 0.000 0.000 0.583 329 R N 3.398 124.130 120.500 0.385 0.000 2.502 329 R HA -0.079 4.261 4.340 -0.001 0.000 0.292 329 R C -0.090 176.408 176.300 0.330 0.000 0.998 329 R CA 0.588 56.862 56.100 0.291 0.000 1.056 329 R CB -0.106 30.347 30.300 0.255 0.000 0.939 329 R HN 0.826 9.096 8.270 0.000 0.000 0.411 330 D N 2.853 123.398 120.400 0.241 0.000 3.070 330 D HA -0.265 4.374 4.640 -0.001 0.000 0.210 330 D C 0.512 176.937 176.300 0.207 0.000 1.103 330 D CA 1.228 55.343 54.000 0.192 0.000 0.980 330 D CB -1.411 39.490 40.800 0.168 0.000 1.100 330 D HN 0.592 8.962 8.370 0.000 0.000 0.423 331 F N 1.301 121.348 119.950 0.163 0.000 2.095 331 F HA -0.090 4.437 4.527 -0.000 0.000 0.298 331 F C 2.341 178.220 175.800 0.131 0.000 1.104 331 F CA 2.697 60.811 58.000 0.189 0.000 1.232 331 F CB -0.354 38.735 39.000 0.149 0.000 0.987 331 F HN 0.062 8.362 8.300 0.000 0.000 0.475 332 G N -0.634 108.321 108.800 0.258 0.000 2.408 332 G HA2 -0.246 3.714 3.960 -0.001 0.000 0.217 332 G HA3 -0.246 3.714 3.960 -0.001 0.000 0.217 332 G C 1.808 176.722 174.900 0.023 0.000 1.150 332 G CA 1.168 46.347 45.100 0.131 0.000 0.776 332 G HN 0.553 8.843 8.290 0.000 0.000 0.542 333 R N 0.670 121.185 120.500 0.024 0.000 2.070 333 R HA -0.006 4.333 4.340 -0.001 0.000 0.233 333 R C 2.427 178.678 176.300 -0.082 0.000 1.137 333 R CA 2.085 58.178 56.100 -0.012 0.000 0.945 333 R CB -1.001 29.303 30.300 0.007 0.000 0.845 333 R HN 0.424 8.694 8.270 0.000 0.000 0.430 334 R N 0.527 120.934 120.500 -0.155 0.000 2.081 334 R HA 0.082 4.422 4.340 -0.001 0.000 0.235 334 R C 2.284 178.398 176.300 -0.310 0.000 1.131 334 R CA 1.713 57.608 56.100 -0.341 0.000 0.960 334 R CB -0.761 29.167 30.300 -0.621 0.000 0.856 334 R HN 0.508 8.778 8.270 0.000 0.000 0.436 335 L N 0.292 121.396 121.223 -0.199 0.000 2.017 335 L HA -0.218 4.122 4.340 -0.001 0.000 0.208 335 L C 2.480 179.329 176.870 -0.034 0.000 1.073 335 L CA 2.106 56.907 54.840 -0.065 0.000 0.745 335 L CB -0.470 41.500 42.059 -0.147 0.000 0.894 335 L HN 0.488 8.718 8.230 0.000 0.000 0.432 336 Q N -0.248 119.534 119.800 -0.030 0.000 2.124 336 Q HA -0.281 4.059 4.340 -0.001 0.000 0.202 336 Q C 2.329 178.316 176.000 -0.022 0.000 0.977 336 Q CA 1.597 57.398 55.803 -0.002 0.000 0.850 336 Q CB -0.033 28.710 28.738 0.008 0.000 0.901 336 Q HN 0.415 8.685 8.270 0.000 0.000 0.429 337 R N 0.090 120.556 120.500 -0.056 0.000 2.070 337 R HA -0.158 4.181 4.340 -0.001 0.000 0.232 337 R C 1.610 177.873 176.300 -0.061 0.000 1.138 337 R CA 2.016 58.077 56.100 -0.064 0.000 0.936 337 R CB -0.190 30.053 30.300 -0.094 0.000 0.839 337 R HN 0.275 8.545 8.270 0.000 0.000 0.429 338 D N 0.558 120.907 120.400 -0.086 0.000 2.172 338 D HA -0.202 4.438 4.640 -0.001 0.000 0.196 338 D C 1.701 177.993 176.300 -0.012 0.000 0.999 338 D CA 1.007 54.973 54.000 -0.058 0.000 0.856 338 D CB -0.131 40.637 40.800 -0.053 0.000 0.934 338 D HN 0.144 8.514 8.370 0.000 0.000 0.453 339 L N 0.699 121.927 121.223 0.008 0.000 2.072 339 L HA -0.038 4.302 4.340 -0.001 0.000 0.205 339 L C 1.873 178.751 176.870 0.012 0.000 1.079 339 L CA 1.656 56.521 54.840 0.041 0.000 0.752 339 L CB -0.306 41.805 42.059 0.086 0.000 0.906 339 L HN -0.160 8.070 8.230 0.000 0.000 0.436 340 K N -0.576 119.818 120.400 -0.010 0.000 2.074 340 K HA -0.215 4.105 4.320 -0.001 0.000 0.209 340 K C 2.217 178.792 176.600 -0.042 0.000 1.048 340 K CA 1.633 57.897 56.287 -0.038 0.000 0.926 340 K CB -0.057 32.422 32.500 -0.034 0.000 0.713 340 K HN 0.362 8.612 8.250 0.000 0.000 0.444 341 R N -0.204 120.277 120.500 -0.031 0.000 2.082 341 R HA -0.086 4.253 4.340 -0.001 0.000 0.228 341 R C 2.368 178.653 176.300 -0.024 0.000 1.140 341 R CA 2.037 58.120 56.100 -0.029 0.000 0.920 341 R CB -0.836 29.448 30.300 -0.026 0.000 0.828 341 R HN 0.123 8.393 8.270 0.000 0.000 0.430 342 T N 0.648 115.195 114.554 -0.012 0.000 2.795 342 T HA -0.182 4.167 4.350 -0.001 0.000 0.266 342 T C 1.747 176.441 174.700 -0.009 0.000 1.056 342 T CA 1.458 63.558 62.100 -0.001 0.000 1.141 342 T CB -0.251 68.629 68.868 0.020 0.000 0.840 342 T HN 0.053 8.293 8.240 0.000 0.000 0.493 343 V N 0.676 120.569 119.914 -0.035 0.000 2.500 343 V HA -0.053 4.067 4.120 -0.001 0.000 0.243 343 V C 2.053 178.095 176.094 -0.086 0.000 1.039 343 V CA 1.446 63.694 62.300 -0.087 0.000 1.053 343 V CB -0.074 31.625 31.823 -0.207 0.000 0.695 343 V HN 0.355 8.545 8.190 0.000 0.000 0.463 344 D N 0.650 121.008 120.400 -0.071 0.000 2.103 344 D HA -0.077 4.563 4.640 -0.001 0.000 0.199 344 D C 2.207 178.484 176.300 -0.038 0.000 0.978 344 D CA 1.544 55.509 54.000 -0.057 0.000 0.829 344 D CB -0.347 40.424 40.800 -0.048 0.000 0.981 344 D HN 0.458 8.828 8.370 0.000 0.000 0.464 345 A N 1.357 124.160 122.820 -0.030 0.000 1.958 345 A HA -0.275 4.044 4.320 -0.001 0.000 0.221 345 A C 2.174 179.748 177.584 -0.017 0.000 1.178 345 A CA 2.039 54.064 52.037 -0.020 0.000 0.642 345 A CB -0.608 18.383 19.000 -0.014 0.000 0.816 345 A HN 0.183 8.333 8.150 0.000 0.000 0.453 346 R N -0.930 119.559 120.500 -0.019 0.000 2.061 346 R HA -0.061 4.279 4.340 -0.001 0.000 0.230 346 R C 1.757 178.048 176.300 -0.016 0.000 1.140 346 R CA 1.566 57.658 56.100 -0.013 0.000 0.940 346 R CB -0.444 29.851 30.300 -0.008 0.000 0.839 346 R HN 0.355 8.625 8.270 0.000 0.000 0.429 347 L N 1.756 122.962 121.223 -0.028 0.000 2.353 347 L HA -0.104 4.236 4.340 -0.001 0.000 0.220 347 L C 2.358 179.217 176.870 -0.020 0.000 1.133 347 L CA 1.575 56.399 54.840 -0.026 0.000 0.798 347 L CB -0.543 41.492 42.059 -0.040 0.000 0.922 347 L HN 0.246 8.476 8.230 0.000 0.000 0.445 348 K N -0.255 120.133 120.400 -0.019 0.000 2.001 348 K HA -0.169 4.151 4.320 -0.001 0.000 0.208 348 K C 1.983 178.577 176.600 -0.011 0.000 1.048 348 K CA 1.247 57.525 56.287 -0.015 0.000 0.932 348 K CB -0.126 32.365 32.500 -0.015 0.000 0.715 348 K HN 0.108 8.358 8.250 0.000 0.000 0.437 349 L N 1.465 122.683 121.223 -0.009 0.000 2.261 349 L HA -0.157 4.182 4.340 -0.001 0.000 0.216 349 L C 2.222 179.090 176.870 -0.004 0.000 1.114 349 L CA 1.312 56.149 54.840 -0.006 0.000 0.777 349 L CB -0.531 41.526 42.059 -0.004 0.000 0.910 349 L HN 0.139 8.369 8.230 0.000 0.000 0.440 350 S N -1.104 114.593 115.700 -0.006 0.000 2.368 350 S HA -0.189 4.280 4.470 -0.001 0.000 0.224 350 S C 1.922 176.520 174.600 -0.004 0.000 1.029 350 S CA 1.167 59.365 58.200 -0.004 0.000 0.988 350 S CB -0.150 63.047 63.200 -0.005 0.000 0.838 350 S HN 0.546 8.856 8.310 0.000 0.000 0.462 351 E N 1.372 121.568 120.200 -0.006 0.000 2.028 351 E HA -0.198 4.151 4.350 -0.001 0.000 0.191 351 E C 1.863 178.460 176.600 -0.004 0.000 0.988 351 E CA 1.132 57.529 56.400 -0.006 0.000 0.799 351 E CB -0.147 29.549 29.700 -0.007 0.000 0.755 351 E HN 0.554 8.914 8.360 0.000 0.000 0.447 352 E N 0.262 120.459 120.200 -0.005 0.000 2.097 352 E HA -0.174 4.175 4.350 -0.001 0.000 0.196 352 E C 1.899 178.498 176.600 -0.003 0.000 1.000 352 E CA 0.599 56.996 56.400 -0.004 0.000 0.804 352 E CB -0.026 29.671 29.700 -0.004 0.000 0.740 352 E HN 0.262 8.622 8.360 0.000 0.000 0.454 353 L N 0.714 121.935 121.223 -0.002 0.000 2.650 353 L HA 0.092 4.432 4.340 -0.001 0.000 0.235 353 L C 0.193 177.062 176.870 -0.001 0.000 1.149 353 L CA 0.792 55.631 54.840 -0.001 0.000 0.887 353 L CB -0.510 41.549 42.059 -0.000 0.000 1.021 353 L HN -0.052 8.178 8.230 0.000 0.000 0.441 360 P HA 0.399 4.819 4.420 0.000 0.000 0.271 360 P C 0.370 177.661 177.300 -0.014 0.000 1.233 360 P CA -0.086 63.008 63.100 -0.009 0.000 0.764 360 P CB 1.139 32.832 31.700 -0.010 0.000 0.825 361 K N 4.276 124.670 120.400 -0.011 0.000 2.586 361 K HA 0.064 4.383 4.320 -0.001 0.000 0.280 361 K C -2.216 174.369 176.600 -0.025 0.000 0.972 361 K CA -0.740 55.540 56.287 -0.013 0.000 1.040 361 K CB -1.760 30.736 32.500 -0.007 0.000 0.870 361 K HN 0.443 8.693 8.250 0.000 0.000 0.497 362 P HA 0.048 4.468 4.420 0.000 0.000 0.265 362 P C -0.006 177.260 177.300 -0.058 0.000 1.193 362 P CA -0.388 62.685 63.100 -0.044 0.000 0.765 362 P CB 0.289 31.968 31.700 -0.034 0.000 0.823 363 I N -0.113 120.396 120.570 -0.101 0.000 2.325 363 I HA 0.378 4.547 4.170 -0.001 0.000 0.291 363 I C -0.151 175.886 176.117 -0.134 0.000 1.019 363 I CA -0.600 60.611 61.300 -0.149 0.000 1.302 363 I CB 0.641 38.453 38.000 -0.314 0.000 1.401 363 I HN 0.166 8.376 8.210 0.000 0.000 0.485 364 D N 6.234 126.594 120.400 -0.067 0.000 2.336 364 D HA 0.315 4.954 4.640 -0.001 0.000 0.249 364 D C -0.681 175.623 176.300 0.008 0.000 1.213 364 D CA -0.030 53.956 54.000 -0.022 0.000 0.870 364 D CB 0.984 41.792 40.800 0.012 0.000 1.076 364 D HN 0.402 8.772 8.370 0.000 0.000 0.483 365 V N 5.034 124.948 119.914 -0.000 0.000 2.347 365 V HA 0.332 4.451 4.120 -0.001 0.000 0.280 365 V C -0.043 176.092 176.094 0.068 0.000 1.021 365 V CA -0.617 61.723 62.300 0.066 0.000 0.847 365 V CB 1.299 33.144 31.823 0.037 0.000 0.990 365 V HN 0.519 8.709 8.190 0.000 0.000 0.444 366 Q N 4.206 124.063 119.800 0.094 0.000 2.304 366 Q HA 0.629 4.968 4.340 -0.001 0.000 0.270 366 Q C -1.937 174.113 176.000 0.082 0.000 1.035 366 Q CA -0.494 55.353 55.803 0.073 0.000 0.781 366 Q CB 2.385 31.161 28.738 0.063 0.000 1.261 366 Q HN 0.527 8.797 8.270 0.000 0.000 0.444 367 V N 5.624 125.582 119.914 0.073 0.000 2.350 367 V HA 0.349 4.468 4.120 -0.001 0.000 0.276 367 V C -0.055 176.090 176.094 0.084 0.000 1.028 367 V CA -0.698 61.652 62.300 0.083 0.000 0.860 367 V CB 1.194 33.065 31.823 0.080 0.000 0.990 367 V HN 0.742 8.932 8.190 0.000 0.000 0.453 368 I N 5.016 125.645 120.570 0.098 0.000 2.428 368 I HA 0.415 4.584 4.170 -0.001 0.000 0.289 368 I C 0.594 176.787 176.117 0.127 0.000 1.019 368 I CA 0.220 61.584 61.300 0.108 0.000 1.351 368 I CB 1.399 39.473 38.000 0.122 0.000 1.412 368 I HN 0.744 8.954 8.210 0.000 0.000 0.513 369 T N 3.940 118.555 114.554 0.101 0.000 2.886 369 T HA 0.690 5.039 4.350 -0.001 0.000 0.292 369 T C -0.586 174.136 174.700 0.036 0.000 1.012 369 T CA -0.704 61.419 62.100 0.038 0.000 0.982 369 T CB 2.109 70.976 68.868 -0.001 0.000 1.018 369 T HN 0.756 8.996 8.240 0.000 0.000 0.451 370 H N 0.949 119.947 119.070 -0.120 0.000 2.977 370 H HA 0.445 5.000 4.556 -0.001 0.000 0.350 370 H C -0.017 175.180 175.328 -0.219 0.000 1.238 370 H CA -0.776 55.156 56.048 -0.194 0.000 1.124 370 H CB 0.616 30.318 29.762 -0.100 0.000 1.866 370 H HN 0.606 8.886 8.280 0.000 0.000 0.550 371 H N 0.585 119.644 119.070 -0.018 0.000 2.457 371 H HA 0.009 4.565 4.556 -0.001 0.000 0.294 371 H C 1.253 176.463 175.328 -0.197 0.000 1.064 371 H CA 1.163 57.141 56.048 -0.117 0.000 1.330 371 H CB 0.365 30.080 29.762 -0.079 0.000 1.395 371 H HN 0.359 8.639 8.280 0.000 0.000 0.541 372 M N 0.870 120.442 119.600 -0.047 0.000 2.568 372 M HA 0.037 4.516 4.480 -0.001 0.000 0.226 372 M C 1.611 177.800 176.300 -0.185 0.000 1.148 372 M CA 0.209 55.412 55.300 -0.161 0.000 1.007 372 M CB -0.374 31.962 32.600 -0.440 0.000 1.651 372 M HN 0.248 8.538 8.290 0.000 0.000 0.488 373 Q N 0.470 119.990 119.800 -0.468 0.000 2.096 373 Q HA -0.199 4.141 4.340 -0.001 0.000 0.204 373 Q C 2.120 177.930 176.000 -0.316 0.000 0.982 373 Q CA 1.555 57.096 55.803 -0.438 0.000 0.850 373 Q CB -0.279 28.148 28.738 -0.518 0.000 0.901 373 Q HN 0.504 8.774 8.270 0.000 0.000 0.422 374 R N 0.166 120.419 120.500 -0.411 0.000 2.113 374 R HA -0.188 4.152 4.340 -0.001 0.000 0.244 374 R C 0.211 176.075 176.300 -0.726 0.000 1.142 374 R CA 1.595 57.295 56.100 -0.665 0.000 0.953 374 R CB 0.039 29.783 30.300 -0.928 0.000 0.860 374 R HN 0.308 8.578 8.270 0.000 0.000 0.438 375 Y N -1.343 118.950 120.300 -0.012 0.000 2.516 375 Y HA 0.409 4.959 4.550 -0.001 0.000 0.341 375 Y C 0.869 176.880 175.900 0.186 0.000 0.912 375 Y CA -0.303 57.850 58.100 0.087 0.000 1.167 375 Y CB 0.860 39.385 38.460 0.108 0.000 1.195 375 Y HN 0.105 8.385 8.280 0.000 0.000 0.610 376 A N -0.098 122.838 122.820 0.193 0.000 1.917 376 A HA -0.162 4.158 4.320 -0.001 0.000 0.219 376 A C 2.107 179.846 177.584 0.258 0.000 1.182 376 A CA 2.311 54.501 52.037 0.254 0.000 0.633 376 A CB -0.718 18.388 19.000 0.176 0.000 0.819 376 A HN 0.413 8.563 8.150 0.000 0.000 0.448 377 V N -2.314 117.717 119.914 0.194 0.000 2.261 377 V HA -0.274 3.845 4.120 -0.001 0.000 0.246 377 V C 2.193 178.368 176.094 0.136 0.000 1.047 377 V CA 2.021 64.397 62.300 0.127 0.000 1.015 377 V CB -0.963 30.928 31.823 0.112 0.000 0.642 377 V HN 0.865 9.055 8.190 0.000 0.000 0.446 378 W N -0.106 121.259 121.300 0.108 0.000 2.363 378 W HA -0.227 4.433 4.660 -0.001 0.000 0.296 378 W C 2.285 178.839 176.519 0.057 0.000 1.212 378 W CA 1.623 59.006 57.345 0.064 0.000 1.260 378 W CB -0.339 29.156 29.460 0.059 0.000 1.131 378 W HN 0.313 8.493 8.180 0.000 0.000 0.530 379 F N 0.914 121.021 119.950 0.263 0.000 2.134 379 F HA -0.015 4.511 4.527 -0.001 0.000 0.299 379 F C 2.246 177.960 175.800 -0.143 0.000 1.097 379 F CA 2.405 60.481 58.000 0.127 0.000 1.264 379 F CB -0.969 38.156 39.000 0.207 0.000 1.001 379 F HN -0.120 8.180 8.300 0.000 0.000 0.479 380 G N -0.426 108.231 108.800 -0.238 0.000 2.418 380 G HA2 -0.180 3.780 3.960 -0.001 0.000 0.217 380 G HA3 -0.180 3.780 3.960 -0.001 0.000 0.217 380 G C 1.936 176.527 174.900 -0.514 0.000 1.158 380 G CA 0.642 45.484 45.100 -0.429 0.000 0.771 380 G HN 0.613 8.903 8.290 0.000 0.000 0.545 381 G N 0.335 108.845 108.800 -0.483 0.000 2.418 381 G HA2 -0.187 3.772 3.960 -0.001 0.000 0.217 381 G HA3 -0.187 3.772 3.960 -0.001 0.000 0.217 381 G C 2.086 176.553 174.900 -0.721 0.000 1.158 381 G CA 1.576 46.354 45.100 -0.537 0.000 0.771 381 G HN 0.499 8.789 8.290 0.000 0.000 0.545 382 S N -0.339 114.772 115.700 -0.981 0.000 2.356 382 S HA -0.102 4.367 4.470 -0.001 0.000 0.223 382 S C 2.511 176.747 174.600 -0.606 0.000 1.032 382 S CA 1.505 59.154 58.200 -0.919 0.000 1.005 382 S CB -0.242 62.301 63.200 -1.095 0.000 0.867 382 S HN 0.157 8.467 8.310 0.000 0.000 0.449 383 M N 1.080 120.281 119.600 -0.666 0.000 2.086 383 M HA 0.037 4.517 4.480 -0.001 0.000 0.261 383 M C 2.179 178.284 176.300 -0.326 0.000 1.067 383 M CA 1.317 56.319 55.300 -0.496 0.000 1.116 383 M CB -1.589 30.632 32.600 -0.633 0.000 1.348 383 M HN 0.358 8.648 8.290 0.000 0.000 0.407 384 L N -0.544 120.464 121.223 -0.358 0.000 2.093 384 L HA -0.105 4.235 4.340 -0.001 0.000 0.208 384 L C 2.312 179.091 176.870 -0.152 0.000 1.085 384 L CA 0.913 55.648 54.840 -0.176 0.000 0.755 384 L CB -0.779 41.115 42.059 -0.275 0.000 0.904 384 L HN 0.238 8.468 8.230 0.000 0.000 0.435 385 A N -1.049 121.462 122.820 -0.515 0.000 2.235 385 A HA -0.017 4.302 4.320 -0.001 0.000 0.208 385 A C 2.025 179.346 177.584 -0.439 0.000 1.172 385 A CA 0.872 52.309 52.037 -1.000 0.000 0.786 385 A CB -0.264 17.944 19.000 -1.321 0.000 0.804 385 A HN 0.368 8.518 8.150 0.000 0.000 0.479 386 S N -0.188 115.391 115.700 -0.201 0.000 2.556 386 S HA 0.070 4.540 4.470 -0.001 0.000 0.216 386 S C 0.911 175.539 174.600 0.047 0.000 0.970 386 S CA 0.399 58.571 58.200 -0.048 0.000 0.912 386 S CB -0.131 63.025 63.200 -0.074 0.000 0.790 386 S HN 0.763 9.073 8.310 0.000 0.000 0.504 387 T N -0.183 114.424 114.554 0.088 0.000 2.934 387 T HA 0.422 4.772 4.350 -0.001 0.000 0.283 387 T C -2.463 172.355 174.700 0.196 0.000 1.005 387 T CA -1.914 60.263 62.100 0.128 0.000 1.041 387 T CB 1.407 70.372 68.868 0.162 0.000 1.042 387 T HN -0.227 8.013 8.240 0.000 0.000 0.505 388 P HA 0.052 4.472 4.420 0.000 0.000 0.221 388 P C 1.348 178.694 177.300 0.077 0.000 1.150 388 P CA 0.527 63.690 63.100 0.106 0.000 0.800 388 P CB 0.145 31.852 31.700 0.012 0.000 0.787 389 E N -1.448 118.754 120.200 0.004 0.000 2.204 389 E HA -0.196 4.154 4.350 -0.001 0.000 0.195 389 E C 1.608 177.904 176.600 -0.505 0.000 0.990 389 E CA 0.557 56.856 56.400 -0.168 0.000 0.821 389 E CB -0.411 29.245 29.700 -0.074 0.000 0.750 389 E HN 0.152 8.512 8.360 0.000 0.000 0.477 390 F N 0.234 119.835 119.950 -0.581 0.000 2.134 390 F HA -0.244 4.282 4.527 -0.001 0.000 0.299 390 F C 1.500 176.903 175.800 -0.662 0.000 1.097 390 F CA 1.487 58.974 58.000 -0.855 0.000 1.264 390 F CB -0.432 38.240 39.000 -0.548 0.000 1.001 390 F HN 0.051 8.351 8.300 0.000 0.000 0.479 391 Y N 0.419 120.482 120.300 -0.395 0.000 2.421 391 Y HA -0.158 4.391 4.550 -0.001 0.000 0.292 391 Y C 2.516 178.225 175.900 -0.317 0.000 1.136 391 Y CA 1.442 59.293 58.100 -0.414 0.000 1.255 391 Y CB -0.820 37.437 38.460 -0.338 0.000 0.991 391 Y HN 0.212 8.492 8.280 0.000 0.000 0.552 392 Q N -0.437 119.240 119.800 -0.205 0.000 2.049 392 Q HA -0.104 4.235 4.340 -0.001 0.000 0.198 392 Q C 2.175 178.040 176.000 -0.224 0.000 0.971 392 Q CA 1.888 57.594 55.803 -0.161 0.000 0.833 392 Q CB -0.161 28.492 28.738 -0.141 0.000 0.896 392 Q HN 0.485 8.755 8.270 0.000 0.000 0.434 393 V N -2.388 117.276 119.914 -0.417 0.000 3.573 393 V HA 0.066 4.185 4.120 -0.001 0.000 0.270 393 V C 0.909 176.773 176.094 -0.383 0.000 1.221 393 V CA -0.307 61.775 62.300 -0.363 0.000 1.163 393 V CB -0.896 30.678 31.823 -0.416 0.000 0.847 393 V HN 0.190 8.380 8.190 0.000 0.000 0.468 394 C N 1.224 120.246 119.300 -0.463 0.000 2.595 394 C HA 0.416 4.875 4.460 -0.001 0.000 0.384 394 C C 0.615 175.473 174.990 -0.220 0.000 1.289 394 C CA -0.164 58.632 59.018 -0.369 0.000 2.372 394 C CB -0.378 27.174 27.740 -0.314 0.000 2.593 394 C HN 0.658 8.888 8.230 0.000 0.000 0.639 395 H N 0.341 119.472 119.070 0.102 0.000 2.552 395 H HA 0.369 4.924 4.556 -0.001 0.000 0.311 395 H C 0.656 176.074 175.328 0.150 0.000 1.071 395 H CA -0.191 55.930 56.048 0.121 0.000 1.307 395 H CB 0.813 30.670 29.762 0.158 0.000 1.416 395 H HN 0.742 9.022 8.280 0.000 0.000 0.464 396 T N -0.453 114.211 114.554 0.183 0.000 2.816 396 T HA 0.072 4.421 4.350 -0.001 0.000 0.282 396 T C 1.448 176.162 174.700 0.024 0.000 0.993 396 T CA -0.933 61.239 62.100 0.120 0.000 0.994 396 T CB 1.500 70.440 68.868 0.120 0.000 1.025 396 T HN 0.640 8.880 8.240 0.000 0.000 0.529 397 K N 0.454 120.900 120.400 0.076 0.000 2.057 397 K HA -0.093 4.226 4.320 -0.001 0.000 0.206 397 K C 2.355 178.914 176.600 -0.069 0.000 1.050 397 K CA 1.274 57.527 56.287 -0.058 0.000 0.935 397 K CB -0.209 32.384 32.500 0.154 0.000 0.715 397 K HN 0.704 8.954 8.250 0.000 0.000 0.439 398 K N 0.613 121.018 120.400 0.008 0.000 2.020 398 K HA -0.225 4.095 4.320 -0.001 0.000 0.212 398 K C 1.413 177.998 176.600 -0.025 0.000 1.050 398 K CA 2.240 58.531 56.287 0.007 0.000 0.929 398 K CB -0.143 32.375 32.500 0.031 0.000 0.714 398 K HN 0.209 8.459 8.250 0.000 0.000 0.443 399 D N -0.405 119.980 120.400 -0.026 0.000 2.144 399 D HA -0.198 4.441 4.640 -0.001 0.000 0.199 399 D C 1.774 178.009 176.300 -0.109 0.000 0.984 399 D CA 1.098 55.073 54.000 -0.042 0.000 0.834 399 D CB -0.353 40.451 40.800 0.007 0.000 0.955 399 D HN 0.358 8.728 8.370 0.000 0.000 0.465 400 Y N 1.908 122.001 120.300 -0.344 0.000 2.224 400 Y HA -0.174 4.375 4.550 -0.001 0.000 0.289 400 Y C 2.007 177.736 175.900 -0.285 0.000 1.146 400 Y CA 1.615 59.441 58.100 -0.457 0.000 1.182 400 Y CB 0.108 37.952 38.460 -1.026 0.000 0.983 400 Y HN -0.021 8.259 8.280 0.000 0.000 0.524 401 E N -0.387 119.739 120.200 -0.123 0.000 2.122 401 E HA -0.126 4.223 4.350 -0.001 0.000 0.190 401 E C 1.899 178.418 176.600 -0.135 0.000 0.977 401 E CA 1.196 57.528 56.400 -0.113 0.000 0.820 401 E CB -0.060 29.639 29.700 -0.002 0.000 0.770 401 E HN 0.613 8.973 8.360 0.000 0.000 0.462 402 E N 0.246 120.382 120.200 -0.105 0.000 2.230 402 E HA 0.016 4.365 4.350 -0.001 0.000 0.192 402 E C 1.781 178.317 176.600 -0.106 0.000 0.987 402 E CA 0.541 56.890 56.400 -0.085 0.000 0.841 402 E CB 0.337 30.008 29.700 -0.050 0.000 0.783 402 E HN 0.229 8.589 8.360 0.000 0.000 0.481 403 I N -0.720 119.767 120.570 -0.139 0.000 3.790 403 I HA 0.220 4.389 4.170 -0.001 0.000 0.305 403 I C 0.813 176.810 176.117 -0.200 0.000 1.253 403 I CA 0.199 61.416 61.300 -0.139 0.000 1.355 403 I CB 0.936 38.871 38.000 -0.108 0.000 1.137 403 I HN 0.065 8.275 8.210 0.000 0.000 0.435 404 G N 1.840 110.448 108.800 -0.319 0.000 2.539 404 G HA2 -0.097 3.863 3.960 -0.001 0.000 0.686 404 G HA3 -0.097 3.863 3.960 -0.001 0.000 0.686 404 G C -2.466 172.129 174.900 -0.509 0.000 1.258 404 G CA -0.493 44.348 45.100 -0.432 0.000 0.846 404 G HN -0.087 8.203 8.290 0.000 0.000 0.647 405 P HA -0.081 4.339 4.420 0.000 0.000 0.236 405 P C 1.701 178.930 177.300 -0.119 0.000 1.172 405 P CA 1.722 64.657 63.100 -0.274 0.000 0.759 405 P CB -0.042 31.593 31.700 -0.109 0.000 0.843 406 S N 0.639 116.240 115.700 -0.165 0.000 2.428 406 S HA -0.128 4.342 4.470 -0.001 0.000 0.230 406 S C 2.137 176.658 174.600 -0.132 0.000 1.014 406 S CA 0.697 58.823 58.200 -0.123 0.000 0.957 406 S CB -1.634 61.498 63.200 -0.113 0.000 0.784 406 S HN 0.304 8.614 8.310 0.000 0.000 0.499 407 I N -0.212 120.246 120.570 -0.187 0.000 2.423 407 I HA -0.113 4.056 4.170 -0.001 0.000 0.254 407 I C 1.852 177.666 176.117 -0.505 0.000 1.151 407 I CA 1.075 62.203 61.300 -0.287 0.000 1.421 407 I CB -1.264 36.541 38.000 -0.324 0.000 1.079 407 I HN 0.288 8.498 8.210 0.000 0.000 0.431 408 C N 1.080 120.186 119.300 -0.324 0.000 2.522 408 C HA 0.113 4.573 4.460 -0.001 0.000 0.271 408 C C 2.768 177.744 174.990 -0.024 0.000 1.425 408 C CA 0.109 59.021 59.018 -0.177 0.000 1.751 408 C CB -1.621 26.165 27.740 0.077 0.000 1.775 408 C HN 0.493 8.723 8.230 0.000 0.000 0.557 409 R N -0.051 120.431 120.500 -0.030 0.000 2.092 409 R HA -0.069 4.270 4.340 -0.001 0.000 0.231 409 R C 0.754 177.127 176.300 0.121 0.000 1.119 409 R CA 0.944 57.059 56.100 0.026 0.000 0.970 409 R CB -0.196 30.107 30.300 0.005 0.000 0.864 409 R HN 0.572 8.842 8.270 0.000 0.000 0.440 410 H N 0.427 119.516 119.070 0.032 0.000 2.457 410 H HA 0.328 4.883 4.556 -0.001 0.000 0.335 410 H C -1.066 174.400 175.328 0.230 0.000 1.115 410 H CA -0.857 55.259 56.048 0.113 0.000 1.219 410 H CB 0.783 30.608 29.762 0.106 0.000 1.471 410 H HN -0.075 8.205 8.280 0.000 0.000 0.491 411 N N 6.452 124.948 118.700 -0.339 0.000 2.609 411 N HA 0.177 4.916 4.740 -0.001 0.000 0.268 411 N C -2.847 172.475 175.510 -0.313 0.000 1.106 411 N CA -1.372 51.481 53.050 -0.330 0.000 0.823 411 N CB 1.947 40.136 38.487 -0.497 0.000 1.263 411 N HN 0.476 8.856 8.380 0.000 0.000 0.533 412 P HA -0.100 4.320 4.420 0.000 0.000 0.258 412 P C 0.404 177.886 177.300 0.303 0.000 1.172 412 P CA 0.189 63.329 63.100 0.066 0.000 0.762 412 P CB 0.609 32.391 31.700 0.137 0.000 0.764 413 V N 5.984 126.024 119.914 0.209 0.000 3.096 413 V HA 0.485 4.605 4.120 -0.001 0.000 0.306 413 V C -0.217 176.037 176.094 0.267 0.000 1.088 413 V CA 0.492 62.857 62.300 0.107 0.000 1.129 413 V CB -0.300 31.380 31.823 -0.238 0.000 1.014 413 V HN 0.547 8.737 8.190 0.000 0.000 0.486 414 F N 1.971 121.950 119.950 0.049 0.000 2.741 414 F HA 0.811 5.338 4.527 -0.001 0.000 0.311 414 F C 0.253 176.106 175.800 0.088 0.000 1.149 414 F CA -0.059 57.975 58.000 0.055 0.000 0.930 414 F CB 1.155 40.160 39.000 0.010 0.000 1.312 414 F HN 1.032 9.332 8.300 0.000 0.000 0.450 415 G N 0.232 109.162 108.800 0.217 0.000 2.428 415 G HA2 0.000 3.960 3.960 -0.001 0.000 0.199 415 G HA3 0.000 3.960 3.960 -0.001 0.000 0.199 415 G C -0.117 174.932 174.900 0.249 0.000 1.005 415 G CA 0.007 45.235 45.100 0.212 0.000 0.671 415 G HN 1.603 9.893 8.290 0.000 0.000 0.485 416 V N 0.000 120.019 119.914 0.176 0.000 2.409 416 V HA 0.000 4.119 4.120 -0.001 0.000 0.244 416 V CA 0.000 62.307 62.300 0.012 0.000 1.235 416 V CB 0.000 31.854 31.823 0.052 0.000 1.184 416 V HN 0.000 8.190 8.190 0.000 0.000 0.556