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 2voe_1_B DATA FIRST_RESID 1 DATA SEQUENCE MRVGIPTETK NNEFRVAITP AGVAELTRRG HEVLIQAGAG EGSAITDADF DATA SEQUENCE KAAGAQLVGT ADQVWADADL LLKVKEPIAA EYGRLRHGQI LFTFLHLAAS DATA SEQUENCE RACTDALLDS GTTSIAYETV QTADGALPLL APMSEVAGRL AAQVGAYHLM DATA SEQUENCE RTQGGRGVLM GGVPGVEPAD VVVIGAGTAG YNAARIANGM GATVTVLDIN DATA SEQUENCE IDKLRQLDAE FCGRIHTRYS SAYELEGAVK RADLVIGAVL VPGAKAPKLV DATA SEQUENCE SNSLVAHMKP GAVLVDIAID QGGCFEGSRP TTYDHPTFAV HDTLFYCVAN DATA SEQUENCE MPASVPKTST YALTNATMPY VLELADHGWR AACRSNPALA KGLSTHEGAL DATA SEQUENCE LSERVATDLG VPFTEPASVL A VARS RESID RESNAME ATOMNAME SS_SHIFT SHIFT RC_SHIFT HM_SHIFT EF_SHIFT SIGMA FORMAT %4d %4s %4s %9.3f %9.3f %9.3f %9.3f %9.3f %9.3f 1 M HA 0.000 4.480 4.480 -0.000 0.000 0.227 1 M C 0.000 176.386 176.300 0.144 0.000 1.140 1 M CA 0.000 55.400 55.300 0.166 0.000 0.988 1 M CB 0.000 32.677 32.600 0.128 0.000 1.302 2 R N 2.159 122.694 120.500 0.058 0.000 2.445 2 R HA 0.809 5.148 4.340 -0.001 0.000 0.308 2 R C -1.589 174.703 176.300 -0.014 0.000 0.961 2 R CA -0.529 55.590 56.100 0.031 0.000 0.862 2 R CB 1.928 32.242 30.300 0.023 0.000 1.144 2 R HN 0.478 8.748 8.270 -0.000 0.000 0.447 3 V N 2.800 122.694 119.914 -0.033 0.000 2.409 3 V HA 0.596 4.716 4.120 -0.001 0.000 0.291 3 V C 0.312 176.349 176.094 -0.095 0.000 1.020 3 V CA -0.766 61.492 62.300 -0.070 0.000 0.848 3 V CB 1.699 33.474 31.823 -0.081 0.000 0.990 3 V HN 0.933 9.123 8.190 -0.000 0.000 0.430 4 G N 3.855 112.577 108.800 -0.129 0.000 2.482 4 G HA2 0.795 4.755 3.960 -0.001 0.000 0.317 4 G HA3 0.795 4.755 3.960 -0.001 0.000 0.317 4 G C -1.451 173.310 174.900 -0.231 0.000 1.241 4 G CA -0.568 44.426 45.100 -0.178 0.000 0.967 4 G HN 0.521 8.811 8.290 -0.000 0.000 0.482 5 I N 2.876 123.301 120.570 -0.242 0.000 2.503 5 I HA 0.343 4.513 4.170 -0.001 0.000 0.282 5 I C -2.285 173.695 176.117 -0.229 0.000 1.059 5 I CA -1.870 59.286 61.300 -0.239 0.000 1.081 5 I CB 2.779 40.646 38.000 -0.222 0.000 1.210 5 I HN 0.248 8.458 8.210 -0.000 0.000 0.450 6 P HA 0.295 4.715 4.420 -0.000 0.000 0.282 6 P C -0.383 176.893 177.300 -0.041 0.000 1.259 6 P CA -0.411 62.600 63.100 -0.147 0.000 0.826 6 P CB 0.747 32.325 31.700 -0.203 0.000 1.064 7 T N 1.833 116.399 114.554 0.020 0.000 2.946 7 T HA 0.039 4.389 4.350 -0.001 0.000 0.311 7 T C 0.460 175.201 174.700 0.067 0.000 1.063 7 T CA 0.067 62.199 62.100 0.053 0.000 1.139 7 T CB -0.083 68.825 68.868 0.067 0.000 0.994 7 T HN 0.335 8.575 8.240 -0.000 0.000 0.547 8 E N 2.151 122.388 120.200 0.061 0.000 2.316 8 E HA 0.128 4.478 4.350 -0.001 0.000 0.275 8 E C 1.177 177.800 176.600 0.039 0.000 1.029 8 E CA -0.017 56.419 56.400 0.059 0.000 0.871 8 E CB 1.164 30.893 29.700 0.049 0.000 1.022 8 E HN 0.837 9.197 8.360 -0.000 0.000 0.418 9 T N -0.267 114.315 114.554 0.047 0.000 3.023 9 T HA 0.073 4.422 4.350 -0.001 0.000 0.249 9 T C 0.925 175.618 174.700 -0.011 0.000 1.050 9 T CA -0.178 61.937 62.100 0.024 0.000 1.088 9 T CB 0.397 69.290 68.868 0.042 0.000 0.946 9 T HN 0.147 8.387 8.240 -0.000 0.000 0.480 10 K N 3.400 123.793 120.400 -0.011 0.000 2.527 10 K HA 0.028 4.348 4.320 -0.001 0.000 0.278 10 K C 0.086 176.638 176.600 -0.079 0.000 0.981 10 K CA -0.222 56.047 56.287 -0.031 0.000 1.009 10 K CB 0.285 32.780 32.500 -0.009 0.000 0.895 10 K HN 0.463 8.713 8.250 -0.000 0.000 0.493 11 N N 3.733 122.392 118.700 -0.070 0.000 2.513 11 N HA -0.058 4.681 4.740 -0.001 0.000 0.268 11 N C -0.561 174.862 175.510 -0.145 0.000 1.180 11 N CA -0.056 52.939 53.050 -0.090 0.000 0.948 11 N CB 0.430 38.898 38.487 -0.032 0.000 1.083 11 N HN 0.608 8.988 8.380 -0.000 0.000 0.455 12 N N -1.234 117.270 118.700 -0.326 0.000 2.725 12 N HA -0.235 4.505 4.740 -0.001 0.000 0.249 12 N C -0.897 174.253 175.510 -0.600 0.000 1.103 12 N CA 1.007 53.712 53.050 -0.575 0.000 0.707 12 N CB -0.773 37.817 38.487 0.170 0.000 1.043 12 N HN 0.814 9.194 8.380 -0.000 0.000 0.553 13 E N -0.133 119.707 120.200 -0.601 0.000 2.129 13 E HA 0.415 4.764 4.350 -0.001 0.000 0.268 13 E C -0.241 176.103 176.600 -0.426 0.000 0.900 13 E CA -0.524 55.681 56.400 -0.325 0.000 0.755 13 E CB 0.207 29.847 29.700 -0.099 0.000 1.117 13 E HN 0.108 8.468 8.360 -0.000 0.000 0.410 14 F N 2.376 122.358 119.950 0.055 0.000 2.682 14 F HA 0.380 4.906 4.527 -0.001 0.000 0.308 14 F C 0.886 176.718 175.800 0.054 0.000 1.093 14 F CA -0.368 57.653 58.000 0.036 0.000 1.244 14 F CB 0.329 39.327 39.000 -0.004 0.000 1.052 14 F HN 0.172 8.472 8.300 -0.000 0.000 0.573 15 R N -0.055 120.566 120.500 0.201 0.000 2.580 15 R HA 0.613 4.953 4.340 -0.001 0.000 0.267 15 R C -0.878 175.500 176.300 0.131 0.000 1.125 15 R CA -0.614 55.583 56.100 0.163 0.000 1.188 15 R CB 1.450 31.843 30.300 0.154 0.000 1.155 15 R HN -0.063 8.207 8.270 -0.000 0.000 0.586 16 V N -0.359 119.622 119.914 0.111 0.000 2.971 16 V HA 0.461 4.581 4.120 -0.001 0.000 0.309 16 V C -0.373 175.755 176.094 0.057 0.000 1.130 16 V CA -0.369 61.989 62.300 0.096 0.000 0.964 16 V CB 2.078 33.993 31.823 0.153 0.000 1.029 16 V HN 0.880 9.070 8.190 -0.000 0.000 0.427 17 A N 5.609 128.445 122.820 0.027 0.000 2.259 17 A HA 0.545 4.864 4.320 -0.001 0.000 0.208 17 A C 0.312 177.879 177.584 -0.028 0.000 1.201 17 A CA 0.708 52.746 52.037 0.001 0.000 0.824 17 A CB -0.491 18.511 19.000 0.003 0.000 0.838 17 A HN 0.948 9.098 8.150 -0.000 0.000 0.485 18 I N -1.682 118.880 120.570 -0.013 0.000 2.984 18 I HA 0.423 4.593 4.170 -0.001 0.000 0.303 18 I C -0.402 175.753 176.117 0.064 0.000 1.381 18 I CA -0.279 61.012 61.300 -0.015 0.000 0.988 18 I CB 2.339 40.310 38.000 -0.048 0.000 1.307 18 I HN 0.134 8.344 8.210 -0.000 0.000 0.460 19 T N 1.271 115.829 114.554 0.006 0.000 2.926 19 T HA 0.583 4.932 4.350 -0.001 0.000 0.289 19 T C -2.423 172.375 174.700 0.163 0.000 1.054 19 T CA -1.793 60.297 62.100 -0.017 0.000 1.015 19 T CB 1.803 70.350 68.868 -0.535 0.000 1.167 19 T HN 0.303 8.543 8.240 -0.000 0.000 0.526 20 P HA -0.117 4.303 4.420 -0.000 0.000 0.216 20 P C 1.744 179.104 177.300 0.099 0.000 1.154 20 P CA 2.023 65.214 63.100 0.152 0.000 0.865 20 P CB -0.415 31.314 31.700 0.048 0.000 0.789 21 A N -0.202 122.658 122.820 0.067 0.000 1.903 21 A HA -0.206 4.114 4.320 -0.001 0.000 0.219 21 A C 2.535 180.145 177.584 0.044 0.000 1.191 21 A CA 2.507 54.581 52.037 0.061 0.000 0.638 21 A CB -1.940 17.107 19.000 0.078 0.000 0.823 21 A HN 0.317 8.467 8.150 -0.000 0.000 0.451 22 G N -1.094 107.723 108.800 0.029 0.000 2.403 22 G HA2 -0.019 3.940 3.960 -0.001 0.000 0.216 22 G HA3 -0.019 3.940 3.960 -0.001 0.000 0.216 22 G C 1.493 176.411 174.900 0.029 0.000 1.154 22 G CA 1.073 46.184 45.100 0.019 0.000 0.784 22 G HN 0.341 8.631 8.290 -0.000 0.000 0.538 23 V N 1.667 121.612 119.914 0.052 0.000 2.332 23 V HA -0.184 3.936 4.120 -0.001 0.000 0.248 23 V C 3.331 179.455 176.094 0.049 0.000 1.055 23 V CA 2.102 64.430 62.300 0.047 0.000 1.038 23 V CB -0.894 30.984 31.823 0.092 0.000 0.651 23 V HN 0.471 8.661 8.190 -0.000 0.000 0.450 24 A N -0.570 122.284 122.820 0.057 0.000 1.877 24 A HA -0.212 4.108 4.320 -0.001 0.000 0.216 24 A C 2.217 179.824 177.584 0.038 0.000 1.186 24 A CA 1.709 53.774 52.037 0.047 0.000 0.620 24 A CB -0.480 18.549 19.000 0.047 0.000 0.822 24 A HN 0.499 8.649 8.150 -0.000 0.000 0.443 25 E N -0.409 119.813 120.200 0.036 0.000 2.085 25 E HA -0.164 4.185 4.350 -0.001 0.000 0.194 25 E C 1.975 178.605 176.600 0.050 0.000 0.994 25 E CA 0.870 57.290 56.400 0.033 0.000 0.801 25 E CB -0.446 29.268 29.700 0.024 0.000 0.743 25 E HN 0.419 8.779 8.360 -0.000 0.000 0.453 26 L N 0.847 122.105 121.223 0.060 0.000 2.027 26 L HA -0.122 4.217 4.340 -0.001 0.000 0.206 26 L C 2.373 179.320 176.870 0.127 0.000 1.074 26 L CA 1.724 56.632 54.840 0.113 0.000 0.745 26 L CB -1.343 40.753 42.059 0.062 0.000 0.898 26 L HN 0.104 8.334 8.230 -0.000 0.000 0.433 27 T N -0.805 113.788 114.554 0.065 0.000 2.652 27 T HA -0.263 4.087 4.350 -0.001 0.000 0.267 27 T C 2.003 176.707 174.700 0.008 0.000 1.039 27 T CA 1.514 63.634 62.100 0.034 0.000 1.153 27 T CB -0.246 68.639 68.868 0.027 0.000 0.863 27 T HN 0.255 8.495 8.240 -0.000 0.000 0.428 28 R N 1.005 121.513 120.500 0.013 0.000 2.170 28 R HA -0.086 4.254 4.340 -0.001 0.000 0.242 28 R C 1.935 178.221 176.300 -0.022 0.000 1.145 28 R CA 1.257 57.356 56.100 -0.001 0.000 0.984 28 R CB -0.058 30.246 30.300 0.007 0.000 0.869 28 R HN 0.287 8.557 8.270 -0.000 0.000 0.455 29 R N -0.836 119.653 120.500 -0.018 0.000 2.334 29 R HA 0.066 4.405 4.340 -0.001 0.000 0.220 29 R C 0.678 176.820 176.300 -0.264 0.000 0.917 29 R CA 0.650 56.704 56.100 -0.077 0.000 1.073 29 R CB 0.638 30.955 30.300 0.028 0.000 1.056 29 R HN 0.511 8.781 8.270 -0.000 0.000 0.506 30 G N 1.431 110.113 108.800 -0.197 0.000 2.137 30 G HA2 -0.266 3.694 3.960 -0.001 0.000 0.237 30 G HA3 -0.266 3.694 3.960 -0.001 0.000 0.237 30 G C -0.338 174.377 174.900 -0.308 0.000 1.002 30 G CA 0.139 45.100 45.100 -0.231 0.000 0.702 30 G HN 0.479 8.769 8.290 -0.000 0.000 0.515 31 H N 0.318 119.375 119.070 -0.022 0.000 2.496 31 H HA 0.599 5.155 4.556 -0.001 0.000 0.342 31 H C 0.284 175.599 175.328 -0.021 0.000 1.170 31 H CA -0.433 55.601 56.048 -0.023 0.000 1.274 31 H CB 0.874 30.619 29.762 -0.029 0.000 1.538 31 H HN 0.253 8.533 8.280 -0.000 0.000 0.542 32 E N 1.223 121.488 120.200 0.108 0.000 2.266 32 E HA 0.262 4.612 4.350 -0.001 0.000 0.277 32 E C -0.735 175.880 176.600 0.025 0.000 1.018 32 E CA -0.580 55.847 56.400 0.045 0.000 0.840 32 E CB 2.253 31.968 29.700 0.025 0.000 1.082 32 E HN 0.181 8.541 8.360 -0.000 0.000 0.395 33 V N 4.480 124.391 119.914 -0.006 0.000 2.378 33 V HA 0.291 4.410 4.120 -0.001 0.000 0.288 33 V C -0.111 175.937 176.094 -0.077 0.000 1.016 33 V CA -0.625 61.645 62.300 -0.050 0.000 0.840 33 V CB 0.985 32.769 31.823 -0.064 0.000 0.994 33 V HN 0.459 8.649 8.190 -0.000 0.000 0.431 34 L N 6.457 127.624 121.223 -0.095 0.000 2.282 34 L HA 0.651 4.990 4.340 -0.001 0.000 0.288 34 L C -0.554 176.220 176.870 -0.160 0.000 1.033 34 L CA -0.227 54.552 54.840 -0.102 0.000 0.807 34 L CB 1.454 43.468 42.059 -0.076 0.000 1.209 34 L HN 0.461 8.691 8.230 -0.000 0.000 0.423 35 I N 2.745 123.210 120.570 -0.176 0.000 2.533 35 I HA 0.226 4.396 4.170 -0.001 0.000 0.290 35 I C -0.289 175.743 176.117 -0.141 0.000 1.056 35 I CA -0.589 60.565 61.300 -0.243 0.000 1.057 35 I CB 2.381 40.089 38.000 -0.486 0.000 1.240 35 I HN 0.634 8.844 8.210 -0.000 0.000 0.423 36 Q N 4.667 124.402 119.800 -0.107 0.000 2.286 36 Q HA 0.352 4.691 4.340 -0.001 0.000 0.267 36 Q C 0.070 176.071 176.000 0.001 0.000 1.028 36 Q CA -0.479 55.304 55.803 -0.034 0.000 0.901 36 Q CB 1.138 29.869 28.738 -0.011 0.000 1.183 36 Q HN 0.775 9.045 8.270 -0.000 0.000 0.392 37 A N 3.458 126.292 122.820 0.023 0.000 2.608 37 A HA 0.231 4.551 4.320 -0.001 0.000 0.239 37 A C 1.268 178.896 177.584 0.072 0.000 1.018 37 A CA 1.020 53.090 52.037 0.055 0.000 0.766 37 A CB -0.641 18.387 19.000 0.048 0.000 0.928 37 A HN 1.339 9.489 8.150 -0.000 0.000 0.512 38 G N 1.060 109.923 108.800 0.105 0.000 2.199 38 G HA2 -0.026 3.933 3.960 -0.001 0.000 0.254 38 G HA3 -0.026 3.933 3.960 -0.001 0.000 0.254 38 G C 1.304 176.281 174.900 0.129 0.000 0.982 38 G CA 1.171 46.335 45.100 0.107 0.000 0.632 38 G HN 2.132 10.422 8.290 -0.000 0.000 0.529 39 A N 0.268 123.170 122.820 0.136 0.000 2.032 39 A HA 0.305 4.624 4.320 -0.001 0.000 0.221 39 A C 2.509 180.219 177.584 0.210 0.000 1.165 39 A CA 2.336 54.455 52.037 0.136 0.000 0.645 39 A CB -0.591 18.444 19.000 0.059 0.000 0.807 39 A HN 1.687 9.837 8.150 -0.000 0.000 0.453 40 G N -1.573 107.415 108.800 0.313 0.000 3.088 40 G HA2 0.196 4.156 3.960 -0.001 0.000 0.217 40 G HA3 0.196 4.156 3.960 -0.001 0.000 0.217 40 G C 1.047 176.012 174.900 0.109 0.000 1.159 40 G CA 0.516 45.763 45.100 0.246 0.000 0.760 40 G HN 0.591 8.881 8.290 -0.000 0.000 0.550 41 E N 0.435 120.703 120.200 0.113 0.000 2.077 41 E HA -0.079 4.271 4.350 -0.001 0.000 0.193 41 E C 2.662 179.305 176.600 0.072 0.000 0.989 41 E CA 0.918 57.362 56.400 0.074 0.000 0.800 41 E CB -0.132 29.614 29.700 0.077 0.000 0.746 41 E HN 0.356 8.716 8.360 -0.000 0.000 0.452 42 G N -0.202 108.677 108.800 0.131 0.000 2.462 42 G HA2 -0.211 3.748 3.960 -0.001 0.000 0.220 42 G HA3 -0.211 3.748 3.960 -0.001 0.000 0.220 42 G C 1.362 176.311 174.900 0.081 0.000 1.121 42 G CA 0.806 46.003 45.100 0.163 0.000 0.758 42 G HN 0.135 8.425 8.290 -0.000 0.000 0.559 43 S N 0.136 115.891 115.700 0.092 0.000 2.583 43 S HA 0.501 4.970 4.470 -0.001 0.000 0.239 43 S C 1.285 175.912 174.600 0.045 0.000 0.966 43 S CA 0.414 58.661 58.200 0.078 0.000 0.973 43 S CB 0.271 63.535 63.200 0.108 0.000 0.794 43 S HN 1.197 9.507 8.310 -0.000 0.000 0.463 44 A N 0.978 123.804 122.820 0.010 0.000 2.799 44 A HA -0.212 4.107 4.320 -0.001 0.000 0.287 44 A C 0.149 177.711 177.584 -0.036 0.000 1.484 44 A CA 0.680 52.708 52.037 -0.015 0.000 0.813 44 A CB -2.241 16.746 19.000 -0.022 0.000 1.009 44 A HN 0.548 8.698 8.150 -0.000 0.000 0.545 45 I N 1.505 122.032 120.570 -0.073 0.000 2.330 45 I HA 0.367 4.536 4.170 -0.001 0.000 0.289 45 I C 1.049 177.032 176.117 -0.223 0.000 1.001 45 I CA 0.235 61.403 61.300 -0.221 0.000 1.193 45 I CB 1.713 39.459 38.000 -0.423 0.000 1.345 45 I HN 0.475 8.685 8.210 -0.000 0.000 0.461 46 T N 0.309 114.755 114.554 -0.179 0.000 2.849 46 T HA 0.152 4.502 4.350 -0.001 0.000 0.284 46 T C 0.892 175.560 174.700 -0.054 0.000 1.004 46 T CA -0.699 61.354 62.100 -0.078 0.000 1.021 46 T CB 1.154 69.997 68.868 -0.041 0.000 1.013 46 T HN 0.478 8.718 8.240 -0.000 0.000 0.527 47 D N 1.186 121.629 120.400 0.072 0.000 2.133 47 D HA -0.159 4.481 4.640 -0.001 0.000 0.195 47 D C 2.352 178.727 176.300 0.124 0.000 0.997 47 D CA 1.769 55.866 54.000 0.163 0.000 0.840 47 D CB -0.772 40.101 40.800 0.121 0.000 0.947 47 D HN 0.764 9.134 8.370 -0.000 0.000 0.452 48 A N 1.703 124.555 122.820 0.054 0.000 1.865 48 A HA -0.232 4.087 4.320 -0.001 0.000 0.217 48 A C 1.904 179.506 177.584 0.031 0.000 1.191 48 A CA 1.960 54.020 52.037 0.038 0.000 0.623 48 A CB -0.531 18.478 19.000 0.015 0.000 0.826 48 A HN 0.088 8.238 8.150 -0.000 0.000 0.444 49 D N -0.849 119.533 120.400 -0.029 0.000 2.116 49 D HA -0.177 4.463 4.640 -0.001 0.000 0.193 49 D C 1.695 177.997 176.300 0.003 0.000 0.998 49 D CA 1.436 55.392 54.000 -0.075 0.000 0.836 49 D CB -0.422 40.247 40.800 -0.218 0.000 0.951 49 D HN 0.420 8.790 8.370 -0.000 0.000 0.449 50 F N 1.477 121.434 119.950 0.013 0.000 2.134 50 F HA -0.079 4.448 4.527 -0.001 0.000 0.299 50 F C 2.444 178.248 175.800 0.006 0.000 1.097 50 F CA 0.722 58.725 58.000 0.006 0.000 1.264 50 F CB -0.516 38.485 39.000 0.002 0.000 1.001 50 F HN -0.142 8.158 8.300 -0.000 0.000 0.479 51 K N -0.053 120.471 120.400 0.206 0.000 2.009 51 K HA -0.195 4.125 4.320 -0.001 0.000 0.210 51 K C 2.280 178.931 176.600 0.084 0.000 1.049 51 K CA 1.360 57.714 56.287 0.112 0.000 0.929 51 K CB -0.569 31.980 32.500 0.081 0.000 0.714 51 K HN 0.206 8.456 8.250 -0.000 0.000 0.440 52 A N 1.053 123.917 122.820 0.073 0.000 1.997 52 A HA -0.199 4.121 4.320 -0.001 0.000 0.221 52 A C 2.106 179.725 177.584 0.058 0.000 1.172 52 A CA 2.178 54.246 52.037 0.052 0.000 0.645 52 A CB -0.529 18.494 19.000 0.037 0.000 0.813 52 A HN 0.423 8.573 8.150 -0.000 0.000 0.454 53 A N -2.548 120.322 122.820 0.084 0.000 2.275 53 A HA 0.449 4.769 4.320 -0.001 0.000 0.212 53 A C 1.589 179.215 177.584 0.070 0.000 1.201 53 A CA 1.137 53.223 52.037 0.082 0.000 0.843 53 A CB -0.553 18.514 19.000 0.112 0.000 0.873 53 A HN 1.879 10.029 8.150 -0.000 0.000 0.492 54 G N -2.313 106.525 108.800 0.064 0.000 2.175 54 G HA2 0.208 4.167 3.960 -0.001 0.000 0.182 54 G HA3 0.208 4.167 3.960 -0.001 0.000 0.182 54 G C 0.302 175.221 174.900 0.032 0.000 1.003 54 G CA 0.000 45.125 45.100 0.041 0.000 0.666 54 G HN 1.389 9.679 8.290 -0.000 0.000 0.506 55 A N 0.050 122.894 122.820 0.041 0.000 2.340 55 A HA 0.729 5.049 4.320 -0.001 0.000 0.268 55 A C 0.406 177.988 177.584 -0.003 0.000 1.100 55 A CA 0.006 52.040 52.037 -0.004 0.000 0.803 55 A CB 0.489 19.460 19.000 -0.049 0.000 1.043 55 A HN 0.380 8.530 8.150 -0.000 0.000 0.488 56 Q N 1.327 121.112 119.800 -0.025 0.000 2.322 56 Q HA 0.368 4.708 4.340 -0.001 0.000 0.256 56 Q C -0.827 175.155 176.000 -0.029 0.000 0.960 56 Q CA -0.166 55.628 55.803 -0.016 0.000 0.934 56 Q CB 1.038 29.767 28.738 -0.015 0.000 1.200 56 Q HN 0.638 8.908 8.270 -0.000 0.000 0.435 57 L N 2.857 124.076 121.223 -0.006 0.000 2.371 57 L HA 0.437 4.776 4.340 -0.001 0.000 0.272 57 L C -0.244 176.625 176.870 -0.002 0.000 1.124 57 L CA -0.402 54.435 54.840 -0.004 0.000 0.816 57 L CB 1.091 43.167 42.059 0.028 0.000 1.129 57 L HN 0.338 8.568 8.230 -0.000 0.000 0.448 58 V N 1.572 121.483 119.914 -0.005 0.000 2.686 58 V HA 0.312 4.431 4.120 -0.001 0.000 0.306 58 V C 0.876 176.979 176.094 0.015 0.000 1.065 58 V CA -0.261 62.041 62.300 0.003 0.000 0.894 58 V CB 1.917 33.735 31.823 -0.008 0.000 1.004 58 V HN 0.957 9.147 8.190 -0.000 0.000 0.424 59 G N 3.118 111.932 108.800 0.023 0.000 2.443 59 G HA2 0.032 3.992 3.960 -0.001 0.000 0.219 59 G HA3 0.032 3.992 3.960 -0.001 0.000 0.219 59 G C 0.595 175.518 174.900 0.037 0.000 1.131 59 G CA 1.208 46.325 45.100 0.029 0.000 0.775 59 G HN 0.768 9.058 8.290 -0.000 0.000 0.547 60 T N -4.055 110.525 114.554 0.043 0.000 2.907 60 T HA 0.682 5.032 4.350 -0.001 0.000 0.292 60 T C 1.177 175.930 174.700 0.089 0.000 1.043 60 T CA 0.119 62.254 62.100 0.060 0.000 1.003 60 T CB 2.006 70.908 68.868 0.055 0.000 1.084 60 T HN 0.168 8.408 8.240 -0.000 0.000 0.483 61 A N 1.379 124.274 122.820 0.125 0.000 1.883 61 A HA -0.090 4.230 4.320 -0.001 0.000 0.217 61 A C 1.945 179.729 177.584 0.334 0.000 1.186 61 A CA 1.827 54.007 52.037 0.238 0.000 0.624 61 A CB -1.087 18.074 19.000 0.269 0.000 0.822 61 A HN 0.924 9.074 8.150 -0.000 0.000 0.444 62 D N -0.840 119.683 120.400 0.205 0.000 2.158 62 D HA -0.207 4.433 4.640 -0.001 0.000 0.197 62 D C 2.002 178.411 176.300 0.183 0.000 0.995 62 D CA 1.662 55.763 54.000 0.170 0.000 0.846 62 D CB -0.311 40.536 40.800 0.078 0.000 0.941 62 D HN 0.685 9.055 8.370 -0.000 0.000 0.456 63 Q N 0.118 119.997 119.800 0.131 0.000 2.230 63 Q HA -0.073 4.266 4.340 -0.001 0.000 0.202 63 Q C 2.179 178.226 176.000 0.078 0.000 0.963 63 Q CA 0.493 56.350 55.803 0.090 0.000 0.866 63 Q CB 0.400 29.172 28.738 0.057 0.000 0.931 63 Q HN 0.128 8.398 8.270 -0.000 0.000 0.452 64 V N -0.853 119.105 119.914 0.074 0.000 2.323 64 V HA -0.219 3.900 4.120 -0.001 0.000 0.244 64 V C 1.561 177.641 176.094 -0.023 0.000 1.041 64 V CA 1.582 63.862 62.300 -0.032 0.000 1.025 64 V CB -0.725 31.009 31.823 -0.149 0.000 0.656 64 V HN 0.462 8.652 8.190 -0.000 0.000 0.451 65 W N 0.681 121.981 121.300 0.001 0.000 2.355 65 W HA 0.139 4.799 4.660 0.000 0.000 0.309 65 W C 1.591 178.115 176.519 0.008 0.000 1.206 65 W CA 0.991 58.339 57.345 0.005 0.000 1.284 65 W CB -0.310 29.155 29.460 0.008 0.000 1.145 65 W HN 0.152 8.332 8.180 -0.000 0.000 0.502 66 A N 0.518 123.493 122.820 0.258 0.000 2.363 66 A HA 0.387 4.707 4.320 -0.001 0.000 0.270 66 A C 0.104 177.746 177.584 0.096 0.000 1.121 66 A CA 0.676 52.800 52.037 0.146 0.000 0.800 66 A CB 0.306 19.373 19.000 0.112 0.000 1.052 66 A HN 0.425 8.575 8.150 -0.000 0.000 0.493 67 D N -0.976 119.466 120.400 0.069 0.000 1.817 67 D HA -0.131 4.509 4.640 -0.001 0.000 0.232 67 D C 0.375 176.690 176.300 0.024 0.000 1.089 67 D CA 1.616 55.641 54.000 0.041 0.000 1.366 67 D CB -1.344 39.475 40.800 0.031 0.000 1.434 67 D HN 1.130 9.500 8.370 -0.000 0.000 0.699 68 A N 0.536 123.363 122.820 0.012 0.000 2.328 68 A HA 0.469 4.789 4.320 -0.001 0.000 0.284 68 A C 0.538 178.124 177.584 0.003 0.000 1.160 68 A CA 0.009 52.034 52.037 -0.020 0.000 0.818 68 A CB 0.622 19.571 19.000 -0.084 0.000 1.087 68 A HN 0.152 8.302 8.150 -0.000 0.000 0.504 69 D N 0.883 121.286 120.400 0.004 0.000 2.183 69 D HA 0.045 4.684 4.640 -0.001 0.000 0.205 69 D C 0.149 176.451 176.300 0.002 0.000 0.962 69 D CA 0.984 54.998 54.000 0.022 0.000 0.849 69 D CB 0.022 40.843 40.800 0.034 0.000 0.978 69 D HN 0.361 8.731 8.370 -0.000 0.000 0.488 70 L N 1.033 122.240 121.223 -0.028 0.000 2.343 70 L HA 0.438 4.778 4.340 -0.001 0.000 0.278 70 L C -1.407 175.420 176.870 -0.071 0.000 0.996 70 L CA -0.732 54.083 54.840 -0.041 0.000 0.831 70 L CB 1.505 43.534 42.059 -0.050 0.000 1.232 70 L HN -0.158 8.072 8.230 -0.000 0.000 0.413 71 L N 5.874 127.043 121.223 -0.089 0.000 2.287 71 L HA 0.567 4.906 4.340 -0.001 0.000 0.287 71 L C -1.210 175.582 176.870 -0.130 0.000 1.022 71 L CA -0.303 54.424 54.840 -0.188 0.000 0.814 71 L CB 1.007 42.870 42.059 -0.327 0.000 1.217 71 L HN 0.608 8.838 8.230 -0.000 0.000 0.420 72 L N 5.967 127.112 121.223 -0.130 0.000 2.282 72 L HA 0.551 4.891 4.340 -0.001 0.000 0.288 72 L C -0.113 176.692 176.870 -0.109 0.000 1.033 72 L CA -0.473 54.335 54.840 -0.054 0.000 0.807 72 L CB 1.216 43.269 42.059 -0.010 0.000 1.209 72 L HN 0.624 8.854 8.230 -0.000 0.000 0.423 73 K N 1.556 121.901 120.400 -0.092 0.000 2.409 73 K HA 0.530 4.850 4.320 -0.001 0.000 0.252 73 K C 0.072 176.679 176.600 0.011 0.000 1.036 73 K CA -0.794 55.458 56.287 -0.059 0.000 0.871 73 K CB 2.753 35.221 32.500 -0.053 0.000 1.374 73 K HN 0.204 8.454 8.250 -0.000 0.000 0.459 74 V N 0.414 120.378 119.914 0.083 0.000 2.627 74 V HA 0.068 4.188 4.120 -0.001 0.000 0.239 74 V C 0.478 176.727 176.094 0.258 0.000 1.077 74 V CA 0.873 63.299 62.300 0.210 0.000 1.103 74 V CB 0.099 32.042 31.823 0.200 0.000 0.802 74 V HN 0.549 8.739 8.190 -0.000 0.000 0.482 75 K N 1.368 121.876 120.400 0.180 0.000 2.177 75 K HA 0.314 4.633 4.320 -0.001 0.000 0.238 75 K C -0.071 176.603 176.600 0.123 0.000 1.015 75 K CA -0.578 55.817 56.287 0.180 0.000 0.922 75 K CB 0.839 33.426 32.500 0.145 0.000 1.127 75 K HN 0.334 8.584 8.250 -0.000 0.000 0.469 76 E N 1.586 121.865 120.200 0.131 0.000 2.404 76 E HA 0.125 4.475 4.350 -0.001 0.000 0.261 76 E C -2.462 174.225 176.600 0.145 0.000 1.074 76 E CA -1.752 54.717 56.400 0.116 0.000 0.917 76 E CB -0.374 29.398 29.700 0.120 0.000 0.965 76 E HN 0.136 8.496 8.360 -0.000 0.000 0.433 77 P HA 0.072 4.492 4.420 -0.000 0.000 0.265 77 P C -0.440 176.973 177.300 0.188 0.000 1.193 77 P CA -0.058 63.172 63.100 0.218 0.000 0.765 77 P CB 0.255 32.111 31.700 0.260 0.000 0.823 78 I N 2.271 122.861 120.570 0.034 0.000 2.783 78 I HA 0.301 4.470 4.170 -0.001 0.000 0.312 78 I C 1.633 177.433 176.117 -0.527 0.000 0.988 78 I CA -0.410 60.817 61.300 -0.122 0.000 1.182 78 I CB 0.714 38.668 38.000 -0.077 0.000 1.368 78 I HN 0.441 8.651 8.210 -0.000 0.000 0.511 79 A N 4.275 126.676 122.820 -0.699 0.000 1.881 79 A HA -0.289 4.031 4.320 -0.001 0.000 0.219 79 A C 2.125 179.271 177.584 -0.729 0.000 1.215 79 A CA 2.649 54.053 52.037 -1.055 0.000 0.648 79 A CB -1.503 17.207 19.000 -0.484 0.000 0.832 79 A HN 0.920 9.070 8.150 -0.000 0.000 0.455 80 A N -1.277 121.311 122.820 -0.385 0.000 2.234 80 A HA -0.125 4.194 4.320 -0.001 0.000 0.216 80 A C 1.749 179.179 177.584 -0.257 0.000 1.167 80 A CA 1.782 53.669 52.037 -0.251 0.000 0.698 80 A CB -0.441 18.463 19.000 -0.159 0.000 0.779 80 A HN 0.722 8.872 8.150 -0.000 0.000 0.475 81 E N -2.199 117.813 120.200 -0.314 0.000 2.490 81 E HA 0.049 4.399 4.350 -0.001 0.000 0.209 81 E C 0.950 177.386 176.600 -0.274 0.000 0.971 81 E CA -0.215 55.977 56.400 -0.347 0.000 0.988 81 E CB 0.051 29.580 29.700 -0.285 0.000 1.029 81 E HN 0.633 8.993 8.360 -0.000 0.000 0.496 82 Y N 0.757 120.921 120.300 -0.226 0.000 2.139 82 Y HA -0.188 4.361 4.550 -0.001 0.000 0.282 82 Y C 2.513 178.293 175.900 -0.199 0.000 1.179 82 Y CA 1.411 59.402 58.100 -0.181 0.000 1.161 82 Y CB -1.379 37.015 38.460 -0.110 0.000 0.970 82 Y HN 0.119 8.399 8.280 -0.000 0.000 0.511 83 G N -0.427 108.351 108.800 -0.038 0.000 2.499 83 G HA2 -0.271 3.688 3.960 -0.001 0.000 0.221 83 G HA3 -0.271 3.688 3.960 -0.001 0.000 0.221 83 G C 1.772 176.574 174.900 -0.163 0.000 1.109 83 G CA 0.834 45.879 45.100 -0.092 0.000 0.749 83 G HN 0.374 8.664 8.290 -0.000 0.000 0.568 84 R N -1.248 119.052 120.500 -0.333 0.000 2.280 84 R HA 0.239 4.579 4.340 -0.001 0.000 0.195 84 R C -0.052 176.102 176.300 -0.243 0.000 0.935 84 R CA -0.607 55.242 56.100 -0.418 0.000 1.033 84 R CB 0.050 29.762 30.300 -0.979 0.000 0.964 84 R HN 0.153 8.423 8.270 -0.000 0.000 0.489 85 L N 1.696 122.802 121.223 -0.195 0.000 2.490 85 L HA 0.061 4.401 4.340 -0.001 0.000 0.274 85 L C 0.551 177.445 176.870 0.039 0.000 1.201 85 L CA 1.004 55.838 54.840 -0.010 0.000 0.869 85 L CB 0.154 42.195 42.059 -0.029 0.000 1.123 85 L HN 0.070 8.300 8.230 -0.000 0.000 0.484 86 R N 1.183 121.737 120.500 0.091 0.000 2.930 86 R HA 0.272 4.612 4.340 -0.001 0.000 0.257 86 R C 0.764 177.108 176.300 0.073 0.000 1.107 86 R CA -0.900 55.256 56.100 0.092 0.000 0.999 86 R CB 1.320 31.693 30.300 0.121 0.000 1.209 86 R HN 0.614 8.884 8.270 -0.000 0.000 0.486 87 H N 0.303 119.383 119.070 0.017 0.000 2.329 87 H HA 0.064 4.619 4.556 -0.001 0.000 0.306 87 H C 0.790 176.127 175.328 0.015 0.000 1.062 87 H CA 1.555 57.602 56.048 -0.002 0.000 1.364 87 H CB 0.341 30.098 29.762 -0.009 0.000 1.409 87 H HN 0.723 9.003 8.280 -0.000 0.000 0.519 88 G N 1.145 110.028 108.800 0.138 0.000 3.709 88 G HA2 0.134 4.093 3.960 -0.001 0.000 0.272 88 G HA3 0.134 4.093 3.960 -0.001 0.000 0.272 88 G C -0.168 174.770 174.900 0.063 0.000 1.259 88 G CA -0.297 44.871 45.100 0.113 0.000 1.512 88 G HN 0.464 8.754 8.290 -0.000 0.000 0.625 89 Q N 0.453 120.253 119.800 -0.001 0.000 2.323 89 Q HA 0.547 4.886 4.340 -0.001 0.000 0.271 89 Q C -1.187 174.780 176.000 -0.054 0.000 1.048 89 Q CA -0.939 54.868 55.803 0.007 0.000 0.792 89 Q CB 1.697 30.465 28.738 0.051 0.000 1.280 89 Q HN 0.141 8.411 8.270 -0.000 0.000 0.441 90 I N 4.086 124.627 120.570 -0.048 0.000 2.325 90 I HA 0.261 4.430 4.170 -0.001 0.000 0.291 90 I C -0.639 175.446 176.117 -0.054 0.000 1.019 90 I CA -0.752 60.493 61.300 -0.091 0.000 1.302 90 I CB 1.069 39.032 38.000 -0.062 0.000 1.401 90 I HN 0.545 8.755 8.210 -0.000 0.000 0.485 91 L N 7.834 129.025 121.223 -0.052 0.000 2.322 91 L HA 0.589 4.928 4.340 -0.001 0.000 0.281 91 L C -1.513 175.373 176.870 0.026 0.000 1.014 91 L CA -0.131 54.701 54.840 -0.013 0.000 0.815 91 L CB 1.271 43.341 42.059 0.018 0.000 1.247 91 L HN 0.378 8.608 8.230 -0.000 0.000 0.421 92 F N 4.830 124.667 119.950 -0.188 0.000 2.500 92 F HA 0.755 5.281 4.527 -0.001 0.000 0.349 92 F C -0.299 175.157 175.800 -0.574 0.000 1.127 92 F CA -0.228 57.610 58.000 -0.270 0.000 0.998 92 F CB 1.240 40.194 39.000 -0.078 0.000 1.237 92 F HN 0.692 8.992 8.300 -0.000 0.000 0.439 93 T N 4.466 118.418 114.554 -1.003 0.000 2.700 93 T HA 0.416 4.766 4.350 -0.001 0.000 0.307 93 T C -1.412 172.541 174.700 -1.246 0.000 1.580 93 T CA -0.512 60.767 62.100 -1.369 0.000 0.992 93 T CB 0.388 68.992 68.868 -0.440 0.000 1.577 93 T HN 0.125 8.365 8.240 -0.000 0.000 0.496 94 F N 2.574 122.171 119.950 -0.588 0.000 2.506 94 F HA 0.327 4.854 4.527 -0.001 0.000 0.371 94 F C 1.355 176.989 175.800 -0.277 0.000 1.078 94 F CA -0.099 57.719 58.000 -0.302 0.000 1.195 94 F CB 0.552 39.515 39.000 -0.062 0.000 1.099 94 F HN 0.370 8.670 8.300 -0.000 0.000 0.548 95 L N 1.736 122.870 121.223 -0.148 0.000 2.356 95 L HA 0.105 4.444 4.340 -0.001 0.000 0.193 95 L C 0.275 177.130 176.870 -0.025 0.000 1.087 95 L CA -0.070 54.720 54.840 -0.084 0.000 0.817 95 L CB -0.374 41.636 42.059 -0.082 0.000 1.035 95 L HN 0.621 8.851 8.230 -0.000 0.000 0.482 96 H N -0.431 118.687 119.070 0.080 0.000 2.677 96 H HA -0.159 4.397 4.556 -0.001 0.000 0.321 96 H C 1.113 176.460 175.328 0.032 0.000 1.171 96 H CA -0.052 56.027 56.048 0.051 0.000 1.139 96 H CB -1.681 28.103 29.762 0.037 0.000 1.515 96 H HN 0.219 8.499 8.280 -0.000 0.000 0.423 97 L N -0.552 120.721 121.223 0.084 0.000 2.083 97 L HA -0.208 4.131 4.340 -0.001 0.000 0.209 97 L C 2.729 179.630 176.870 0.050 0.000 1.083 97 L CA 1.260 56.129 54.840 0.048 0.000 0.752 97 L CB -0.454 41.612 42.059 0.012 0.000 0.899 97 L HN 0.685 8.915 8.230 -0.000 0.000 0.433 98 A N 0.175 123.032 122.820 0.062 0.000 2.032 98 A HA -0.212 4.108 4.320 -0.001 0.000 0.221 98 A C 2.386 179.995 177.584 0.042 0.000 1.165 98 A CA 1.847 53.912 52.037 0.047 0.000 0.645 98 A CB -0.572 18.458 19.000 0.049 0.000 0.807 98 A HN 0.436 8.586 8.150 -0.000 0.000 0.453 99 A N -1.725 121.130 122.820 0.058 0.000 2.169 99 A HA 0.384 4.703 4.320 -0.001 0.000 0.212 99 A C 1.116 178.722 177.584 0.036 0.000 1.153 99 A CA 1.051 53.111 52.037 0.038 0.000 0.756 99 A CB -0.171 18.851 19.000 0.035 0.000 0.813 99 A HN 0.698 8.848 8.150 -0.000 0.000 0.471 100 S N -1.119 114.607 115.700 0.043 0.000 2.737 100 S HA 0.370 4.840 4.470 -0.001 0.000 0.269 100 S C 0.505 175.117 174.600 0.020 0.000 1.150 100 S CA -0.588 57.636 58.200 0.040 0.000 1.077 100 S CB 0.816 64.056 63.200 0.066 0.000 1.075 100 S HN 0.466 8.776 8.310 -0.000 0.000 0.476 101 R N 3.697 124.203 120.500 0.011 0.000 2.075 101 R HA -0.007 4.332 4.340 -0.001 0.000 0.232 101 R C 2.114 178.399 176.300 -0.025 0.000 1.126 101 R CA 1.880 57.976 56.100 -0.008 0.000 0.963 101 R CB -0.553 29.743 30.300 -0.006 0.000 0.858 101 R HN 0.722 8.992 8.270 -0.000 0.000 0.435 102 A N 0.715 123.535 122.820 0.000 0.000 1.873 102 A HA -0.269 4.051 4.320 -0.001 0.000 0.218 102 A C 2.535 180.035 177.584 -0.140 0.000 1.193 102 A CA 1.746 53.779 52.037 -0.007 0.000 0.629 102 A CB -1.452 17.618 19.000 0.118 0.000 0.826 102 A HN 0.662 8.812 8.150 -0.000 0.000 0.447 103 C N -0.897 118.366 119.300 -0.061 0.000 2.413 103 C HA -0.116 4.343 4.460 -0.001 0.000 0.276 103 C C 2.991 177.863 174.990 -0.197 0.000 1.236 103 C CA 2.088 61.015 59.018 -0.152 0.000 1.735 103 C CB -1.612 26.155 27.740 0.044 0.000 2.031 103 C HN 0.640 8.870 8.230 -0.000 0.000 0.474 104 T N 0.372 114.861 114.554 -0.108 0.000 2.746 104 T HA -0.149 4.200 4.350 -0.001 0.000 0.267 104 T C 1.346 175.970 174.700 -0.128 0.000 1.039 104 T CA 1.933 63.976 62.100 -0.094 0.000 1.142 104 T CB -0.445 68.391 68.868 -0.053 0.000 0.866 104 T HN 0.570 8.810 8.240 -0.000 0.000 0.444 105 D N 1.324 121.639 120.400 -0.142 0.000 2.092 105 D HA -0.038 4.602 4.640 -0.001 0.000 0.193 105 D C 2.452 178.633 176.300 -0.197 0.000 0.994 105 D CA 1.404 55.319 54.000 -0.142 0.000 0.828 105 D CB -0.638 40.088 40.800 -0.123 0.000 0.963 105 D HN 0.368 8.738 8.370 -0.000 0.000 0.450 106 A N 0.752 123.365 122.820 -0.344 0.000 1.927 106 A HA -0.203 4.116 4.320 -0.001 0.000 0.220 106 A C 2.464 179.892 177.584 -0.261 0.000 1.185 106 A CA 1.310 53.089 52.037 -0.430 0.000 0.639 106 A CB -0.903 17.488 19.000 -1.016 0.000 0.820 106 A HN 0.252 8.402 8.150 -0.000 0.000 0.451 107 L N -0.968 120.122 121.223 -0.221 0.000 2.005 107 L HA -0.168 4.172 4.340 -0.001 0.000 0.207 107 L C 2.626 179.426 176.870 -0.117 0.000 1.072 107 L CA 1.250 56.007 54.840 -0.138 0.000 0.744 107 L CB -0.531 41.462 42.059 -0.109 0.000 0.895 107 L HN 0.390 8.620 8.230 -0.000 0.000 0.433 108 L N -0.819 120.337 121.223 -0.111 0.000 2.093 108 L HA -0.212 4.128 4.340 -0.001 0.000 0.208 108 L C 2.263 179.085 176.870 -0.081 0.000 1.085 108 L CA 0.914 55.698 54.840 -0.093 0.000 0.755 108 L CB -0.661 41.352 42.059 -0.078 0.000 0.904 108 L HN 0.265 8.495 8.230 -0.000 0.000 0.435 109 D N 0.188 120.537 120.400 -0.085 0.000 2.092 109 D HA -0.172 4.467 4.640 -0.001 0.000 0.193 109 D C 2.340 178.614 176.300 -0.043 0.000 0.994 109 D CA 1.963 55.924 54.000 -0.065 0.000 0.828 109 D CB -0.060 40.694 40.800 -0.077 0.000 0.963 109 D HN 0.324 8.694 8.370 -0.000 0.000 0.450 110 S N -0.906 114.762 115.700 -0.053 0.000 2.555 110 S HA 0.115 4.585 4.470 -0.001 0.000 0.230 110 S C 1.744 176.346 174.600 0.004 0.000 0.978 110 S CA 0.970 59.159 58.200 -0.019 0.000 0.934 110 S CB -0.010 63.171 63.200 -0.031 0.000 0.766 110 S HN 0.383 8.693 8.310 -0.000 0.000 0.533 111 G N 0.983 109.756 108.800 -0.045 0.000 2.168 111 G HA2 -0.290 3.670 3.960 -0.001 0.000 0.257 111 G HA3 -0.290 3.670 3.960 -0.001 0.000 0.257 111 G C 0.162 174.879 174.900 -0.305 0.000 0.997 111 G CA 0.541 45.566 45.100 -0.125 0.000 0.708 111 G HN 0.896 9.186 8.290 -0.000 0.000 0.520 112 T N 0.003 114.444 114.554 -0.188 0.000 2.918 112 T HA 0.493 4.842 4.350 -0.001 0.000 0.302 112 T C 0.875 175.452 174.700 -0.206 0.000 1.045 112 T CA 1.031 63.021 62.100 -0.183 0.000 1.114 112 T CB 0.942 69.765 68.868 -0.074 0.000 0.965 112 T HN 1.006 9.246 8.240 -0.000 0.000 0.540 113 T N 2.754 117.167 114.554 -0.234 0.000 2.733 113 T HA 0.538 4.888 4.350 -0.001 0.000 0.294 113 T C -0.195 174.350 174.700 -0.259 0.000 0.956 113 T CA -0.600 61.319 62.100 -0.302 0.000 0.987 113 T CB -0.060 68.466 68.868 -0.570 0.000 0.920 113 T HN 0.762 9.002 8.240 -0.000 0.000 0.470 114 S N 5.073 120.651 115.700 -0.203 0.000 2.513 114 S HA 0.787 5.256 4.470 -0.001 0.000 0.299 114 S C -0.748 173.783 174.600 -0.116 0.000 1.087 114 S CA -0.943 57.178 58.200 -0.131 0.000 1.012 114 S CB 1.113 64.261 63.200 -0.086 0.000 1.044 114 S HN 0.745 9.055 8.310 -0.000 0.000 0.485 115 I N 1.794 122.325 120.570 -0.064 0.000 2.499 115 I HA 0.589 4.759 4.170 -0.001 0.000 0.288 115 I C -0.079 176.078 176.117 0.067 0.000 1.048 115 I CA -1.081 60.212 61.300 -0.010 0.000 1.062 115 I CB 2.036 39.986 38.000 -0.083 0.000 1.238 115 I HN 0.896 9.106 8.210 -0.000 0.000 0.426 116 A N 4.807 127.635 122.820 0.014 0.000 2.289 116 A HA 0.442 4.761 4.320 -0.001 0.000 0.298 116 A C 0.201 177.775 177.584 -0.017 0.000 1.208 116 A CA -0.278 51.716 52.037 -0.072 0.000 0.845 116 A CB 0.243 19.209 19.000 -0.056 0.000 1.125 116 A HN 0.685 8.835 8.150 -0.000 0.000 0.517 117 Y N 1.427 121.564 120.300 -0.272 0.000 2.165 117 Y HA -0.219 4.331 4.550 -0.000 0.000 0.286 117 Y C 2.511 178.316 175.900 -0.158 0.000 1.155 117 Y CA 1.974 59.809 58.100 -0.442 0.000 1.164 117 Y CB -0.241 37.528 38.460 -1.152 0.000 0.978 117 Y HN 0.839 9.119 8.280 -0.000 0.000 0.513 118 E N -0.047 120.250 120.200 0.162 0.000 2.427 118 E HA -0.084 4.266 4.350 -0.001 0.000 0.196 118 E C 1.072 177.751 176.600 0.132 0.000 1.028 118 E CA 1.507 58.059 56.400 0.253 0.000 0.864 118 E CB -0.674 29.187 29.700 0.268 0.000 0.813 118 E HN 0.536 8.896 8.360 -0.000 0.000 0.514 119 T N -1.782 112.816 114.554 0.074 0.000 3.085 119 T HA 0.270 4.620 4.350 -0.001 0.000 0.264 119 T C 0.573 175.288 174.700 0.026 0.000 1.019 119 T CA -0.400 61.730 62.100 0.050 0.000 0.910 119 T CB 0.085 68.975 68.868 0.037 0.000 1.059 119 T HN -0.075 8.165 8.240 -0.000 0.000 0.542 120 V N 2.736 122.655 119.914 0.009 0.000 2.493 120 V HA 0.282 4.402 4.120 -0.001 0.000 0.292 120 V C 0.022 176.099 176.094 -0.027 0.000 1.016 120 V CA 0.167 62.433 62.300 -0.057 0.000 1.097 120 V CB 0.311 32.031 31.823 -0.172 0.000 0.947 120 V HN 0.700 8.890 8.190 -0.000 0.000 0.479 121 Q N 4.207 124.000 119.800 -0.011 0.000 2.271 121 Q HA 0.474 4.813 4.340 -0.001 0.000 0.268 121 Q C -0.314 175.710 176.000 0.040 0.000 1.021 121 Q CA -0.656 55.162 55.803 0.024 0.000 0.802 121 Q CB 2.125 30.881 28.738 0.031 0.000 1.282 121 Q HN 0.823 9.093 8.270 -0.000 0.000 0.431 122 T N 0.237 114.826 114.554 0.058 0.000 2.849 122 T HA 0.509 4.858 4.350 -0.001 0.000 0.284 122 T C 1.336 176.067 174.700 0.052 0.000 1.004 122 T CA -0.025 62.117 62.100 0.070 0.000 1.021 122 T CB 1.228 70.146 68.868 0.083 0.000 1.013 122 T HN 0.724 8.964 8.240 -0.000 0.000 0.527 123 A N 1.361 124.210 122.820 0.049 0.000 1.948 123 A HA -0.143 4.176 4.320 -0.001 0.000 0.220 123 A C 1.816 179.420 177.584 0.033 0.000 1.177 123 A CA 1.935 53.995 52.037 0.038 0.000 0.636 123 A CB -1.201 17.819 19.000 0.034 0.000 0.815 123 A HN 0.998 9.148 8.150 -0.000 0.000 0.449 124 D N -2.126 118.295 120.400 0.035 0.000 2.363 124 D HA 0.274 4.913 4.640 -0.001 0.000 0.226 124 D C 1.169 177.488 176.300 0.033 0.000 1.020 124 D CA 0.969 54.988 54.000 0.031 0.000 0.892 124 D CB -0.711 40.107 40.800 0.030 0.000 0.900 124 D HN 0.836 9.206 8.370 -0.000 0.000 0.531 125 G N -0.727 108.095 108.800 0.036 0.000 2.179 125 G HA2 -0.211 3.748 3.960 -0.001 0.000 0.260 125 G HA3 -0.211 3.748 3.960 -0.001 0.000 0.260 125 G C 0.541 175.466 174.900 0.042 0.000 0.977 125 G CA 0.149 45.271 45.100 0.037 0.000 0.641 125 G HN 0.860 9.150 8.290 -0.000 0.000 0.533 126 A N -0.116 122.731 122.820 0.045 0.000 2.445 126 A HA 0.630 4.949 4.320 -0.001 0.000 0.242 126 A C 0.581 178.199 177.584 0.057 0.000 1.075 126 A CA 0.366 52.434 52.037 0.051 0.000 0.777 126 A CB 0.275 19.307 19.000 0.053 0.000 1.013 126 A HN 0.952 9.102 8.150 -0.000 0.000 0.493 127 L N 4.321 125.582 121.223 0.063 0.000 2.360 127 L HA 0.280 4.619 4.340 -0.001 0.000 0.265 127 L C -1.376 175.540 176.870 0.077 0.000 1.066 127 L CA -1.402 53.480 54.840 0.069 0.000 0.929 127 L CB 1.414 43.522 42.059 0.082 0.000 1.306 127 L HN 0.624 8.854 8.230 -0.000 0.000 0.434 128 P HA -0.118 4.302 4.420 -0.000 0.000 0.225 128 P C 1.209 178.555 177.300 0.077 0.000 1.148 128 P CA 1.058 64.213 63.100 0.090 0.000 0.779 128 P CB 0.460 32.242 31.700 0.138 0.000 0.780 129 L N -1.829 119.424 121.223 0.051 0.000 2.477 129 L HA 0.112 4.451 4.340 -0.001 0.000 0.220 129 L C 2.546 179.496 176.870 0.134 0.000 1.106 129 L CA 0.295 55.135 54.840 0.001 0.000 0.851 129 L CB -0.495 41.465 42.059 -0.165 0.000 0.994 129 L HN -0.097 8.133 8.230 -0.000 0.000 0.462 130 L N -0.111 121.222 121.223 0.184 0.000 2.162 130 L HA 0.009 4.349 4.340 -0.001 0.000 0.205 130 L C 2.887 179.837 176.870 0.134 0.000 1.086 130 L CA 0.714 55.680 54.840 0.209 0.000 0.778 130 L CB -0.436 41.730 42.059 0.178 0.000 0.928 130 L HN 0.206 8.436 8.230 -0.000 0.000 0.446 131 A N 1.302 124.185 122.820 0.105 0.000 1.896 131 A HA -0.205 4.115 4.320 -0.001 0.000 0.220 131 A C -0.201 177.436 177.584 0.088 0.000 1.206 131 A CA 2.227 54.317 52.037 0.088 0.000 0.647 131 A CB -2.036 17.011 19.000 0.077 0.000 0.828 131 A HN 0.281 8.431 8.150 -0.000 0.000 0.455 132 P HA -0.141 4.279 4.420 -0.000 0.000 0.219 132 P C 1.495 178.848 177.300 0.089 0.000 1.146 132 P CA 1.145 64.295 63.100 0.084 0.000 0.808 132 P CB -0.149 31.596 31.700 0.075 0.000 0.779 133 M N -1.254 118.406 119.600 0.100 0.000 2.288 133 M HA -0.007 4.472 4.480 -0.001 0.000 0.266 133 M C 1.919 178.257 176.300 0.063 0.000 1.072 133 M CA 1.385 56.738 55.300 0.088 0.000 1.132 133 M CB -1.562 31.093 32.600 0.092 0.000 1.386 133 M HN -0.102 8.188 8.290 -0.000 0.000 0.432 134 S N 0.511 116.250 115.700 0.066 0.000 2.402 134 S HA -0.102 4.367 4.470 -0.001 0.000 0.229 134 S C 1.771 176.410 174.600 0.064 0.000 1.021 134 S CA 0.974 59.208 58.200 0.057 0.000 0.974 134 S CB -0.131 63.107 63.200 0.064 0.000 0.800 134 S HN 0.521 8.831 8.310 -0.000 0.000 0.484 135 E N 0.721 120.967 120.200 0.076 0.000 2.047 135 E HA -0.090 4.259 4.350 -0.001 0.000 0.191 135 E C 2.119 178.753 176.600 0.057 0.000 0.987 135 E CA 1.120 57.567 56.400 0.080 0.000 0.799 135 E CB -0.225 29.529 29.700 0.090 0.000 0.752 135 E HN 0.246 8.606 8.360 -0.000 0.000 0.449 136 V N 1.611 121.560 119.914 0.058 0.000 2.261 136 V HA -0.303 3.817 4.120 -0.001 0.000 0.246 136 V C 2.387 178.506 176.094 0.041 0.000 1.047 136 V CA 1.975 64.305 62.300 0.051 0.000 1.015 136 V CB -0.851 31.011 31.823 0.065 0.000 0.642 136 V HN 0.331 8.521 8.190 -0.000 0.000 0.446 137 A N 0.526 123.371 122.820 0.042 0.000 1.883 137 A HA -0.144 4.175 4.320 -0.001 0.000 0.217 137 A C 2.430 180.022 177.584 0.013 0.000 1.186 137 A CA 2.186 54.243 52.037 0.032 0.000 0.624 137 A CB -1.378 17.638 19.000 0.027 0.000 0.822 137 A HN 0.550 8.700 8.150 -0.000 0.000 0.444 138 G N -0.634 108.174 108.800 0.013 0.000 2.459 138 G HA2 -0.258 3.701 3.960 -0.001 0.000 0.217 138 G HA3 -0.258 3.701 3.960 -0.001 0.000 0.217 138 G C 1.778 176.662 174.900 -0.027 0.000 1.183 138 G CA 0.976 46.073 45.100 -0.005 0.000 0.776 138 G HN 0.573 8.863 8.290 -0.000 0.000 0.552 139 R N -0.379 120.109 120.500 -0.020 0.000 2.096 139 R HA 0.128 4.468 4.340 -0.001 0.000 0.235 139 R C 2.658 178.940 176.300 -0.030 0.000 1.127 139 R CA 0.677 56.758 56.100 -0.032 0.000 0.968 139 R CB -0.467 29.822 30.300 -0.019 0.000 0.861 139 R HN 0.312 8.582 8.270 -0.000 0.000 0.440 140 L N 0.257 121.471 121.223 -0.015 0.000 2.083 140 L HA -0.180 4.159 4.340 -0.001 0.000 0.209 140 L C 2.598 179.436 176.870 -0.054 0.000 1.083 140 L CA 1.161 55.991 54.840 -0.017 0.000 0.752 140 L CB -0.467 41.603 42.059 0.018 0.000 0.899 140 L HN 0.258 8.488 8.230 -0.000 0.000 0.433 141 A N -0.245 122.540 122.820 -0.059 0.000 1.940 141 A HA -0.231 4.089 4.320 -0.001 0.000 0.219 141 A C 2.463 179.983 177.584 -0.106 0.000 1.176 141 A CA 1.822 53.798 52.037 -0.101 0.000 0.631 141 A CB -0.677 18.282 19.000 -0.068 0.000 0.814 141 A HN 0.462 8.612 8.150 -0.000 0.000 0.446 142 A N -0.562 122.211 122.820 -0.078 0.000 1.898 142 A HA -0.185 4.134 4.320 -0.001 0.000 0.216 142 A C 2.137 179.684 177.584 -0.061 0.000 1.181 142 A CA 1.542 53.535 52.037 -0.073 0.000 0.620 142 A CB -0.544 18.411 19.000 -0.075 0.000 0.819 142 A HN 0.680 8.830 8.150 -0.000 0.000 0.442 143 Q N -0.055 119.712 119.800 -0.056 0.000 2.046 143 Q HA -0.135 4.205 4.340 -0.001 0.000 0.200 143 Q C 2.254 178.237 176.000 -0.028 0.000 0.975 143 Q CA 2.071 57.852 55.803 -0.036 0.000 0.836 143 Q CB -0.745 27.970 28.738 -0.038 0.000 0.896 143 Q HN 0.737 9.007 8.270 -0.000 0.000 0.428 144 V N -1.359 118.503 119.914 -0.086 0.000 2.358 144 V HA -0.054 4.065 4.120 -0.001 0.000 0.246 144 V C 2.133 178.217 176.094 -0.015 0.000 1.047 144 V CA 2.047 64.285 62.300 -0.104 0.000 1.035 144 V CB -1.543 30.011 31.823 -0.448 0.000 0.658 144 V HN 0.325 8.515 8.190 -0.000 0.000 0.452 145 G N 0.051 108.790 108.800 -0.102 0.000 2.418 145 G HA2 -0.150 3.809 3.960 -0.001 0.000 0.217 145 G HA3 -0.150 3.809 3.960 -0.001 0.000 0.217 145 G C 1.750 176.663 174.900 0.022 0.000 1.158 145 G CA 1.338 46.413 45.100 -0.042 0.000 0.771 145 G HN 0.916 9.206 8.290 -0.000 0.000 0.545 146 A N -0.087 122.740 122.820 0.011 0.000 1.902 146 A HA -0.056 4.263 4.320 -0.001 0.000 0.217 146 A C 2.218 179.816 177.584 0.024 0.000 1.181 146 A CA 1.723 53.766 52.037 0.010 0.000 0.623 146 A CB -0.685 18.319 19.000 0.006 0.000 0.818 146 A HN 0.455 8.605 8.150 -0.000 0.000 0.443 147 Y N 0.057 120.307 120.300 -0.083 0.000 2.145 147 Y HA -0.216 4.334 4.550 -0.001 0.000 0.286 147 Y C 2.404 178.189 175.900 -0.191 0.000 1.145 147 Y CA 2.229 60.234 58.100 -0.158 0.000 1.148 147 Y CB -0.218 38.102 38.460 -0.234 0.000 0.981 147 Y HN 0.490 8.770 8.280 -0.000 0.000 0.507 148 H N -1.013 118.126 119.070 0.116 0.000 2.547 148 H HA -0.010 4.546 4.556 -0.001 0.000 0.266 148 H C 1.746 177.068 175.328 -0.010 0.000 0.988 148 H CA 0.488 56.580 56.048 0.074 0.000 1.147 148 H CB 0.267 30.133 29.762 0.173 0.000 1.365 148 H HN 0.294 8.574 8.280 -0.000 0.000 0.589 149 L N 0.641 121.884 121.223 0.034 0.000 2.478 149 L HA 0.049 4.388 4.340 -0.001 0.000 0.223 149 L C 0.830 177.668 176.870 -0.054 0.000 1.140 149 L CA 0.673 55.508 54.840 -0.008 0.000 0.842 149 L CB -0.574 41.471 42.059 -0.023 0.000 0.953 149 L HN 0.108 8.338 8.230 -0.000 0.000 0.452 150 M N -0.941 118.584 119.600 -0.125 0.000 2.243 150 M HA 0.046 4.525 4.480 -0.001 0.000 0.341 150 M C 1.575 177.819 176.300 -0.094 0.000 1.130 150 M CA 0.129 55.338 55.300 -0.152 0.000 1.162 150 M CB 0.643 33.070 32.600 -0.289 0.000 1.497 150 M HN -0.028 8.262 8.290 -0.000 0.000 0.456 151 R N 0.788 121.245 120.500 -0.071 0.000 2.115 151 R HA -0.087 4.253 4.340 -0.001 0.000 0.230 151 R C 1.576 177.856 176.300 -0.033 0.000 1.111 151 R CA 1.425 57.502 56.100 -0.038 0.000 0.976 151 R CB -0.175 30.105 30.300 -0.033 0.000 0.870 151 R HN 0.759 9.029 8.270 -0.000 0.000 0.445 152 T N 0.789 115.307 114.554 -0.059 0.000 3.051 152 T HA -0.045 4.305 4.350 -0.001 0.000 0.269 152 T C 1.048 175.729 174.700 -0.032 0.000 1.127 152 T CA 0.903 62.972 62.100 -0.051 0.000 1.107 152 T CB 0.100 68.916 68.868 -0.086 0.000 0.898 152 T HN 0.230 8.470 8.240 -0.000 0.000 0.517 153 Q N -0.673 119.108 119.800 -0.032 0.000 2.179 153 Q HA 0.339 4.678 4.340 -0.001 0.000 0.213 153 Q C 1.452 177.513 176.000 0.102 0.000 0.833 153 Q CA 0.405 56.243 55.803 0.058 0.000 0.990 153 Q CB 0.961 29.739 28.738 0.067 0.000 1.132 153 Q HN 0.521 8.791 8.270 -0.000 0.000 0.493 154 G N 0.316 109.147 108.800 0.053 0.000 2.175 154 G HA2 -0.232 3.728 3.960 -0.001 0.000 0.244 154 G HA3 -0.232 3.728 3.960 -0.001 0.000 0.244 154 G C 0.508 175.435 174.900 0.044 0.000 0.982 154 G CA -0.088 45.044 45.100 0.054 0.000 0.641 154 G HN 0.566 8.856 8.290 -0.000 0.000 0.527 155 G N -1.037 107.785 108.800 0.037 0.000 2.547 155 G HA2 0.506 4.466 3.960 -0.001 0.000 0.291 155 G HA3 0.506 4.466 3.960 -0.001 0.000 0.291 155 G C 0.796 175.696 174.900 0.001 0.000 1.211 155 G CA 0.359 45.472 45.100 0.023 0.000 0.950 155 G HN 0.454 8.744 8.290 -0.000 0.000 0.504 156 R N -0.617 119.879 120.500 -0.006 0.000 2.211 156 R HA -0.001 4.339 4.340 -0.001 0.000 0.240 156 R C 1.637 177.925 176.300 -0.020 0.000 1.144 156 R CA 1.455 57.547 56.100 -0.013 0.000 0.992 156 R CB -0.386 29.904 30.300 -0.017 0.000 0.869 156 R HN 1.252 9.522 8.270 -0.000 0.000 0.462 157 G N 0.067 108.851 108.800 -0.028 0.000 2.204 157 G HA2 -0.215 3.745 3.960 -0.001 0.000 0.244 157 G HA3 -0.215 3.745 3.960 -0.001 0.000 0.244 157 G C -0.337 174.541 174.900 -0.037 0.000 1.062 157 G CA 0.179 45.257 45.100 -0.037 0.000 0.798 157 G HN 0.497 8.787 8.290 -0.000 0.000 0.496 158 V N -1.370 118.522 119.914 -0.038 0.000 2.628 158 V HA 0.883 5.003 4.120 -0.001 0.000 0.306 158 V C 0.294 176.363 176.094 -0.041 0.000 1.045 158 V CA -1.576 60.702 62.300 -0.036 0.000 0.905 158 V CB 1.864 33.668 31.823 -0.031 0.000 0.997 158 V HN 0.883 9.073 8.190 -0.000 0.000 0.436 159 L N 7.140 128.340 121.223 -0.039 0.000 2.367 159 L HA 0.361 4.701 4.340 -0.001 0.000 0.275 159 L C 1.294 178.142 176.870 -0.037 0.000 1.129 159 L CA 0.193 55.010 54.840 -0.039 0.000 0.839 159 L CB 1.077 43.115 42.059 -0.034 0.000 1.133 159 L HN 0.865 9.095 8.230 -0.000 0.000 0.453 160 M N 3.641 123.218 119.600 -0.038 0.000 2.204 160 M HA -0.203 4.277 4.480 -0.001 0.000 0.255 160 M C 1.563 177.838 176.300 -0.041 0.000 1.073 160 M CA 2.318 57.594 55.300 -0.041 0.000 1.084 160 M CB -1.682 30.894 32.600 -0.041 0.000 1.289 160 M HN 0.832 9.122 8.290 -0.000 0.000 0.419 161 G N -1.236 107.542 108.800 -0.037 0.000 3.042 161 G HA2 0.392 4.352 3.960 -0.001 0.000 0.212 161 G HA3 0.392 4.352 3.960 -0.001 0.000 0.212 161 G C 0.848 175.731 174.900 -0.029 0.000 1.166 161 G CA 0.569 45.648 45.100 -0.035 0.000 0.767 161 G HN 0.859 9.149 8.290 -0.000 0.000 0.546 162 G N -0.928 107.855 108.800 -0.028 0.000 2.692 162 G HA2 0.104 4.064 3.960 -0.001 0.000 0.248 162 G HA3 0.104 4.064 3.960 -0.001 0.000 0.248 162 G C -0.037 174.851 174.900 -0.020 0.000 1.340 162 G CA 0.432 45.518 45.100 -0.023 0.000 0.896 162 G HN 1.506 9.796 8.290 -0.000 0.000 0.570 163 V N -4.227 115.677 119.914 -0.017 0.000 3.130 163 V HA 0.843 4.963 4.120 -0.001 0.000 0.310 163 V C -2.596 173.491 176.094 -0.011 0.000 1.158 163 V CA -1.982 60.310 62.300 -0.014 0.000 1.029 163 V CB 1.645 33.460 31.823 -0.014 0.000 1.057 163 V HN 0.827 9.017 8.190 -0.000 0.000 0.436 164 P HA 0.342 4.762 4.420 -0.000 0.000 0.262 164 P C 0.937 178.233 177.300 -0.007 0.000 1.182 164 P CA 2.004 65.100 63.100 -0.007 0.000 0.761 164 P CB 0.512 32.209 31.700 -0.006 0.000 0.795 165 G N 1.122 109.919 108.800 -0.006 0.000 2.194 165 G HA2 -0.170 3.789 3.960 -0.001 0.000 0.236 165 G HA3 -0.170 3.789 3.960 -0.001 0.000 0.236 165 G C -0.128 174.768 174.900 -0.006 0.000 0.987 165 G CA -0.079 45.017 45.100 -0.005 0.000 0.635 165 G HN 0.557 8.847 8.290 -0.000 0.000 0.520 166 V N 0.470 120.379 119.914 -0.008 0.000 2.638 166 V HA 0.634 4.754 4.120 -0.001 0.000 0.306 166 V C 0.110 176.197 176.094 -0.012 0.000 1.052 166 V CA -1.239 61.054 62.300 -0.010 0.000 0.885 166 V CB 1.916 33.732 31.823 -0.012 0.000 0.999 166 V HN 0.235 8.425 8.190 -0.000 0.000 0.424 167 E N 6.223 126.416 120.200 -0.012 0.000 2.452 167 E HA 0.216 4.566 4.350 -0.001 0.000 0.261 167 E C -2.113 174.476 176.600 -0.019 0.000 0.987 167 E CA -1.013 55.379 56.400 -0.013 0.000 0.926 167 E CB 0.561 30.255 29.700 -0.011 0.000 0.934 167 E HN 0.473 8.833 8.360 -0.000 0.000 0.452 168 P HA 0.190 4.610 4.420 -0.000 0.000 0.279 168 P C -1.040 176.240 177.300 -0.033 0.000 1.282 168 P CA -0.565 62.517 63.100 -0.030 0.000 0.788 168 P CB 0.546 32.224 31.700 -0.037 0.000 1.139 169 A N 0.113 122.910 122.820 -0.039 0.000 2.386 169 A HA 0.171 4.490 4.320 -0.001 0.000 0.248 169 A C -0.034 177.522 177.584 -0.046 0.000 1.082 169 A CA -0.018 51.994 52.037 -0.041 0.000 0.789 169 A CB -0.744 18.230 19.000 -0.044 0.000 1.025 169 A HN 0.586 8.736 8.150 -0.000 0.000 0.490 170 D N 0.853 121.228 120.400 -0.042 0.000 2.373 170 D HA 0.469 5.108 4.640 -0.001 0.000 0.227 170 D C -0.958 175.313 176.300 -0.049 0.000 1.091 170 D CA -0.025 53.951 54.000 -0.041 0.000 0.840 170 D CB 0.893 41.676 40.800 -0.027 0.000 1.060 170 D HN 0.194 8.564 8.370 -0.000 0.000 0.502 171 V N 4.873 124.751 119.914 -0.060 0.000 2.448 171 V HA 0.425 4.545 4.120 -0.001 0.000 0.295 171 V C -0.148 175.912 176.094 -0.056 0.000 1.025 171 V CA -0.909 61.353 62.300 -0.063 0.000 0.859 171 V CB 1.576 33.352 31.823 -0.077 0.000 0.988 171 V HN 0.487 8.677 8.190 -0.000 0.000 0.431 172 V N 5.172 125.058 119.914 -0.047 0.000 2.513 172 V HA 0.811 4.931 4.120 -0.001 0.000 0.299 172 V C -0.695 175.386 176.094 -0.022 0.000 1.035 172 V CA -0.372 61.909 62.300 -0.032 0.000 0.889 172 V CB 1.984 33.794 31.823 -0.022 0.000 0.988 172 V HN 0.539 8.729 8.190 -0.000 0.000 0.440 173 V N 7.060 126.965 119.914 -0.015 0.000 2.409 173 V HA 0.499 4.619 4.120 -0.001 0.000 0.291 173 V C 0.045 176.149 176.094 0.016 0.000 1.020 173 V CA -0.408 61.891 62.300 -0.002 0.000 0.848 173 V CB 1.466 33.277 31.823 -0.020 0.000 0.990 173 V HN 0.843 9.033 8.190 -0.000 0.000 0.430 174 I N 4.640 125.232 120.570 0.037 0.000 2.297 174 I HA 0.706 4.876 4.170 -0.001 0.000 0.291 174 I C 0.756 176.889 176.117 0.027 0.000 1.033 174 I CA 0.077 61.400 61.300 0.039 0.000 1.253 174 I CB 1.047 39.093 38.000 0.076 0.000 1.396 174 I HN 0.873 9.083 8.210 -0.000 0.000 0.476 175 G N 4.386 113.199 108.800 0.021 0.000 3.226 175 G HA2 0.145 4.104 3.960 -0.001 0.000 0.685 175 G HA3 0.145 4.104 3.960 -0.001 0.000 0.685 175 G C -0.335 174.591 174.900 0.043 0.000 1.207 175 G CA -0.348 44.767 45.100 0.024 0.000 0.877 175 G HN 0.889 9.179 8.290 -0.000 0.000 0.585 176 A N 1.555 124.407 122.820 0.053 0.000 2.630 176 A HA 0.771 5.090 4.320 -0.001 0.000 0.290 176 A C 1.460 179.102 177.584 0.097 0.000 1.267 176 A CA 1.192 53.281 52.037 0.086 0.000 0.950 176 A CB -0.168 18.885 19.000 0.087 0.000 1.144 176 A HN 2.081 10.231 8.150 -0.000 0.000 0.527 177 G N -1.011 107.838 108.800 0.081 0.000 2.494 177 G HA2 0.318 4.278 3.960 -0.001 0.000 0.270 177 G HA3 0.318 4.278 3.960 -0.001 0.000 0.270 177 G C 1.005 175.978 174.900 0.122 0.000 1.423 177 G CA 0.701 45.849 45.100 0.079 0.000 1.055 177 G HN 0.140 8.430 8.290 -0.000 0.000 0.536 178 T N 0.699 115.318 114.554 0.108 0.000 2.684 178 T HA -0.110 4.240 4.350 -0.001 0.000 0.267 178 T C 2.758 177.561 174.700 0.172 0.000 1.036 178 T CA 2.053 64.244 62.100 0.152 0.000 1.148 178 T CB -0.458 68.474 68.868 0.107 0.000 0.863 178 T HN 0.570 8.810 8.240 -0.000 0.000 0.436 179 A N 1.133 124.016 122.820 0.105 0.000 1.898 179 A HA 0.158 4.477 4.320 -0.001 0.000 0.216 179 A C 2.603 180.223 177.584 0.060 0.000 1.181 179 A CA 1.817 53.896 52.037 0.070 0.000 0.620 179 A CB -1.259 17.764 19.000 0.038 0.000 0.819 179 A HN 0.514 8.664 8.150 -0.000 0.000 0.442 180 G N -1.549 107.296 108.800 0.075 0.000 2.402 180 G HA2 -0.242 3.718 3.960 -0.001 0.000 0.216 180 G HA3 -0.242 3.718 3.960 -0.001 0.000 0.216 180 G C 1.540 176.489 174.900 0.081 0.000 1.162 180 G CA 1.214 46.350 45.100 0.061 0.000 0.777 180 G HN 0.607 8.897 8.290 -0.000 0.000 0.539 181 Y N 1.986 122.311 120.300 0.041 0.000 2.114 181 Y HA -0.195 4.355 4.550 -0.001 0.000 0.282 181 Y C 2.461 178.403 175.900 0.071 0.000 1.165 181 Y CA 2.320 60.465 58.100 0.074 0.000 1.148 181 Y CB -0.544 37.974 38.460 0.098 0.000 0.972 181 Y HN 0.260 8.540 8.280 -0.000 0.000 0.504 182 N N -0.026 118.583 118.700 -0.152 0.000 2.216 182 N HA -0.067 4.673 4.740 -0.001 0.000 0.183 182 N C 1.979 177.373 175.510 -0.193 0.000 1.017 182 N CA 1.173 54.072 53.050 -0.253 0.000 0.861 182 N CB -0.379 38.086 38.487 -0.037 0.000 0.986 182 N HN 0.503 8.883 8.380 -0.000 0.000 0.428 183 A N 0.846 123.597 122.820 -0.114 0.000 1.877 183 A HA -0.001 4.319 4.320 -0.001 0.000 0.216 183 A C 2.273 179.770 177.584 -0.145 0.000 1.186 183 A CA 1.741 53.717 52.037 -0.101 0.000 0.620 183 A CB -1.059 17.904 19.000 -0.061 0.000 0.822 183 A HN 0.321 8.471 8.150 -0.000 0.000 0.443 184 A N 0.008 122.725 122.820 -0.171 0.000 1.877 184 A HA -0.192 4.127 4.320 -0.001 0.000 0.216 184 A C 2.237 179.622 177.584 -0.331 0.000 1.186 184 A CA 2.023 53.922 52.037 -0.230 0.000 0.620 184 A CB -0.546 18.326 19.000 -0.213 0.000 0.822 184 A HN 0.609 8.759 8.150 -0.000 0.000 0.443 185 R N -0.463 119.816 120.500 -0.368 0.000 2.083 185 R HA -0.145 4.195 4.340 -0.001 0.000 0.237 185 R C 1.768 177.965 176.300 -0.171 0.000 1.137 185 R CA 2.073 58.000 56.100 -0.287 0.000 0.951 185 R CB -0.351 29.780 30.300 -0.282 0.000 0.851 185 R HN 0.413 8.683 8.270 -0.000 0.000 0.434 186 I N 1.157 121.634 120.570 -0.155 0.000 2.286 186 I HA -0.094 4.076 4.170 -0.001 0.000 0.245 186 I C 2.583 178.638 176.117 -0.103 0.000 1.104 186 I CA 1.372 62.611 61.300 -0.101 0.000 1.397 186 I CB -1.721 36.230 38.000 -0.081 0.000 1.072 186 I HN 0.340 8.550 8.210 -0.000 0.000 0.417 187 A N 1.208 123.953 122.820 -0.125 0.000 1.892 187 A HA -0.314 4.006 4.320 -0.001 0.000 0.218 187 A C 2.216 179.723 177.584 -0.129 0.000 1.188 187 A CA 2.510 54.477 52.037 -0.118 0.000 0.631 187 A CB -1.288 17.636 19.000 -0.125 0.000 0.822 187 A HN 0.546 8.696 8.150 -0.000 0.000 0.447 188 N N -0.452 118.140 118.700 -0.180 0.000 2.120 188 N HA -0.042 4.698 4.740 -0.001 0.000 0.188 188 N C 1.730 177.175 175.510 -0.109 0.000 1.024 188 N CA 1.769 54.708 53.050 -0.186 0.000 0.852 188 N CB -0.530 37.763 38.487 -0.322 0.000 1.003 188 N HN 0.307 8.687 8.380 -0.000 0.000 0.424 189 G N -0.029 108.722 108.800 -0.081 0.000 2.479 189 G HA2 -0.183 3.777 3.960 -0.001 0.000 0.220 189 G HA3 -0.183 3.777 3.960 -0.001 0.000 0.220 189 G C 1.244 176.121 174.900 -0.038 0.000 1.115 189 G CA 0.570 45.648 45.100 -0.036 0.000 0.757 189 G HN 0.353 8.643 8.290 -0.000 0.000 0.560 190 M N 0.228 119.797 119.600 -0.052 0.000 2.561 190 M HA 0.220 4.700 4.480 -0.001 0.000 0.238 190 M C 1.805 178.078 176.300 -0.045 0.000 1.131 190 M CA 0.721 55.995 55.300 -0.044 0.000 1.046 190 M CB 0.400 32.973 32.600 -0.046 0.000 1.532 190 M HN 0.364 8.654 8.290 -0.000 0.000 0.497 191 G N 0.913 109.681 108.800 -0.053 0.000 2.157 191 G HA2 -0.190 3.770 3.960 -0.001 0.000 0.239 191 G HA3 -0.190 3.770 3.960 -0.001 0.000 0.239 191 G C 0.202 175.064 174.900 -0.063 0.000 0.982 191 G CA 0.066 45.135 45.100 -0.051 0.000 0.650 191 G HN 0.672 8.962 8.290 -0.000 0.000 0.527 192 A N -0.012 122.762 122.820 -0.078 0.000 2.351 192 A HA 0.737 5.057 4.320 -0.001 0.000 0.257 192 A C 0.826 178.343 177.584 -0.112 0.000 1.087 192 A CA 1.077 53.063 52.037 -0.084 0.000 0.798 192 A CB 0.582 19.530 19.000 -0.086 0.000 1.033 192 A HN 1.616 9.766 8.150 -0.000 0.000 0.488 193 T N 0.825 115.314 114.554 -0.109 0.000 2.780 193 T HA 0.498 4.848 4.350 -0.001 0.000 0.294 193 T C -0.634 173.965 174.700 -0.169 0.000 0.949 193 T CA -0.358 61.647 62.100 -0.158 0.000 1.074 193 T CB -0.159 68.631 68.868 -0.129 0.000 0.910 193 T HN 0.548 8.788 8.240 -0.000 0.000 0.501 194 V N 5.706 125.474 119.914 -0.244 0.000 2.487 194 V HA 0.522 4.641 4.120 -0.001 0.000 0.298 194 V C 0.161 176.158 176.094 -0.161 0.000 1.028 194 V CA -0.752 61.435 62.300 -0.189 0.000 0.860 194 V CB 2.162 33.854 31.823 -0.218 0.000 0.991 194 V HN 1.088 9.278 8.190 -0.000 0.000 0.427 195 T N 4.081 118.599 114.554 -0.060 0.000 2.807 195 T HA 0.586 4.935 4.350 -0.001 0.000 0.279 195 T C -0.518 174.185 174.700 0.005 0.000 0.993 195 T CA -0.462 61.650 62.100 0.021 0.000 0.970 195 T CB 1.802 70.717 68.868 0.078 0.000 0.950 195 T HN 0.652 8.892 8.240 -0.000 0.000 0.441 196 V N 4.189 124.117 119.914 0.024 0.000 2.513 196 V HA 0.797 4.917 4.120 -0.001 0.000 0.299 196 V C -1.372 174.745 176.094 0.037 0.000 1.035 196 V CA -0.899 61.415 62.300 0.023 0.000 0.889 196 V CB 1.094 32.929 31.823 0.021 0.000 0.988 196 V HN 0.777 8.967 8.190 -0.000 0.000 0.440 197 L N 6.071 127.307 121.223 0.022 0.000 2.322 197 L HA 0.760 5.100 4.340 -0.001 0.000 0.281 197 L C -0.241 176.620 176.870 -0.014 0.000 1.014 197 L CA 0.009 54.851 54.840 0.004 0.000 0.815 197 L CB 1.659 43.714 42.059 -0.006 0.000 1.247 197 L HN 0.794 9.024 8.230 -0.000 0.000 0.421 198 D N 1.361 121.734 120.400 -0.044 0.000 2.622 198 D HA 0.271 4.910 4.640 -0.001 0.000 0.255 198 D C 0.024 176.227 176.300 -0.162 0.000 1.246 198 D CA -0.395 53.569 54.000 -0.059 0.000 0.795 198 D CB 2.486 43.288 40.800 0.003 0.000 1.369 198 D HN 0.415 8.785 8.370 -0.000 0.000 0.425 199 I N -0.266 120.207 120.570 -0.162 0.000 3.793 199 I HA 0.247 4.416 4.170 -0.001 0.000 0.315 199 I C -0.017 176.114 176.117 0.023 0.000 1.275 199 I CA 0.253 61.413 61.300 -0.234 0.000 1.214 199 I CB -1.092 36.789 38.000 -0.199 0.000 1.018 199 I HN 0.186 8.396 8.210 -0.000 0.000 0.439 200 N N 1.778 120.503 118.700 0.042 0.000 2.485 200 N HA 0.387 5.127 4.740 -0.001 0.000 0.243 200 N C 0.999 176.573 175.510 0.107 0.000 0.987 200 N CA -0.323 52.777 53.050 0.083 0.000 0.940 200 N CB 0.950 39.469 38.487 0.053 0.000 1.122 200 N HN 0.120 8.500 8.380 -0.000 0.000 0.509 201 I N 1.690 122.345 120.570 0.141 0.000 2.546 201 I HA -0.174 3.996 4.170 -0.001 0.000 0.255 201 I C 1.091 177.261 176.117 0.088 0.000 1.163 201 I CA 0.593 61.974 61.300 0.135 0.000 1.457 201 I CB -0.067 38.014 38.000 0.135 0.000 1.092 201 I HN 0.611 8.821 8.210 -0.000 0.000 0.434 202 D N 1.328 121.770 120.400 0.070 0.000 2.144 202 D HA -0.150 4.490 4.640 -0.001 0.000 0.200 202 D C 2.127 178.457 176.300 0.050 0.000 0.978 202 D CA 1.164 55.195 54.000 0.051 0.000 0.833 202 D CB -0.013 40.810 40.800 0.039 0.000 0.961 202 D HN 0.261 8.631 8.370 -0.000 0.000 0.470 203 K N 0.240 120.673 120.400 0.055 0.000 2.057 203 K HA -0.038 4.282 4.320 -0.001 0.000 0.207 203 K C 2.249 178.895 176.600 0.077 0.000 1.049 203 K CA 0.589 56.910 56.287 0.057 0.000 0.931 203 K CB -0.045 32.489 32.500 0.056 0.000 0.714 203 K HN 0.105 8.355 8.250 -0.000 0.000 0.440 204 L N 0.283 121.558 121.223 0.087 0.000 2.141 204 L HA -0.142 4.198 4.340 -0.001 0.000 0.209 204 L C 2.393 179.322 176.870 0.098 0.000 1.094 204 L CA 1.023 55.923 54.840 0.101 0.000 0.763 204 L CB -0.364 41.760 42.059 0.109 0.000 0.908 204 L HN 0.145 8.375 8.230 -0.000 0.000 0.437 205 R N 0.101 120.648 120.500 0.079 0.000 2.081 205 R HA -0.190 4.149 4.340 -0.001 0.000 0.235 205 R C 2.309 178.648 176.300 0.065 0.000 1.131 205 R CA 1.543 57.683 56.100 0.067 0.000 0.960 205 R CB -0.368 29.961 30.300 0.049 0.000 0.856 205 R HN 0.502 8.772 8.270 -0.000 0.000 0.436 206 Q N 0.220 120.053 119.800 0.055 0.000 2.084 206 Q HA -0.154 4.186 4.340 -0.001 0.000 0.202 206 Q C 2.006 178.059 176.000 0.087 0.000 0.978 206 Q CA 1.153 56.979 55.803 0.038 0.000 0.844 206 Q CB -0.102 28.637 28.738 0.000 0.000 0.898 206 Q HN 0.129 8.399 8.270 -0.000 0.000 0.426 207 L N 0.732 122.048 121.223 0.154 0.000 2.141 207 L HA -0.160 4.179 4.340 -0.001 0.000 0.209 207 L C 1.789 178.843 176.870 0.305 0.000 1.094 207 L CA 1.794 56.809 54.840 0.292 0.000 0.763 207 L CB -0.564 41.655 42.059 0.267 0.000 0.908 207 L HN 0.208 8.438 8.230 -0.000 0.000 0.437 208 D N -1.090 119.425 120.400 0.191 0.000 2.178 208 D HA -0.117 4.523 4.640 -0.001 0.000 0.202 208 D C 2.152 178.535 176.300 0.139 0.000 0.974 208 D CA 1.113 55.213 54.000 0.168 0.000 0.841 208 D CB 0.253 41.123 40.800 0.116 0.000 0.953 208 D HN 0.258 8.628 8.370 -0.000 0.000 0.478 209 A N 0.280 123.156 122.820 0.093 0.000 1.854 209 A HA -0.099 4.221 4.320 -0.001 0.000 0.214 209 A C 2.149 179.735 177.584 0.005 0.000 1.192 209 A CA 1.543 53.605 52.037 0.042 0.000 0.611 209 A CB -0.839 18.170 19.000 0.015 0.000 0.832 209 A HN 0.330 8.480 8.150 -0.000 0.000 0.442 210 E N -1.167 119.011 120.200 -0.036 0.000 2.118 210 E HA -0.185 4.165 4.350 -0.001 0.000 0.195 210 E C 0.540 176.908 176.600 -0.387 0.000 0.992 210 E CA 1.413 57.660 56.400 -0.255 0.000 0.804 210 E CB -0.168 29.314 29.700 -0.362 0.000 0.741 210 E HN 0.628 8.988 8.360 -0.000 0.000 0.458 211 F N -0.663 119.328 119.950 0.068 0.000 2.708 211 F HA 0.244 4.771 4.527 -0.001 0.000 0.300 211 F C 1.144 176.971 175.800 0.045 0.000 1.118 211 F CA -0.595 57.438 58.000 0.054 0.000 1.307 211 F CB -0.152 38.877 39.000 0.049 0.000 0.986 211 F HN 0.098 8.398 8.300 -0.000 0.000 0.522 212 C N 0.865 120.253 119.300 0.146 0.000 0.205 212 C HA -0.359 4.101 4.460 -0.001 0.000 0.018 212 C C 2.919 177.997 174.990 0.147 0.000 0.178 212 C CA 1.329 60.418 59.018 0.117 0.000 0.501 212 C CB -1.114 26.676 27.740 0.082 0.000 3.212 212 C HN 0.704 8.934 8.230 -0.000 0.000 1.118 213 G N -0.221 108.655 108.800 0.127 0.000 2.484 213 G HA2 -0.099 3.860 3.960 -0.001 0.000 0.218 213 G HA3 -0.099 3.860 3.960 -0.001 0.000 0.218 213 G C 1.454 176.457 174.900 0.170 0.000 1.130 213 G CA 1.029 46.216 45.100 0.144 0.000 0.784 213 G HN 0.762 9.052 8.290 -0.000 0.000 0.543 214 R N -0.228 120.356 120.500 0.140 0.000 2.097 214 R HA -0.009 4.330 4.340 -0.001 0.000 0.236 214 R C 0.609 176.850 176.300 -0.099 0.000 1.135 214 R CA 0.738 56.863 56.100 0.042 0.000 0.934 214 R CB -0.401 29.945 30.300 0.076 0.000 0.846 214 R HN 0.298 8.568 8.270 -0.000 0.000 0.431 215 I N 2.076 122.591 120.570 -0.091 0.000 2.379 215 I HA 0.003 4.173 4.170 -0.001 0.000 0.290 215 I C -0.040 176.094 176.117 0.029 0.000 1.063 215 I CA -0.299 60.886 61.300 -0.192 0.000 1.351 215 I CB 0.763 38.540 38.000 -0.372 0.000 1.410 215 I HN 0.128 8.338 8.210 -0.000 0.000 0.505 216 H N 4.004 123.058 119.070 -0.026 0.000 2.707 216 H HA 0.307 4.863 4.556 -0.001 0.000 0.359 216 H C 0.199 175.536 175.328 0.016 0.000 1.113 216 H CA -0.477 55.574 56.048 0.005 0.000 1.422 216 H CB 0.834 30.595 29.762 -0.001 0.000 1.443 216 H HN 0.548 8.828 8.280 -0.000 0.000 0.591 217 T N 0.513 115.168 114.554 0.169 0.000 2.876 217 T HA 0.711 5.061 4.350 -0.001 0.000 0.289 217 T C -0.070 174.691 174.700 0.101 0.000 1.014 217 T CA -1.161 61.010 62.100 0.118 0.000 0.986 217 T CB 2.253 71.189 68.868 0.114 0.000 1.021 217 T HN 0.509 8.749 8.240 -0.000 0.000 0.458 218 R N 1.170 121.727 120.500 0.095 0.000 2.621 218 R HA 0.395 4.735 4.340 -0.001 0.000 0.284 218 R C -1.563 174.811 176.300 0.123 0.000 0.998 218 R CA -0.953 55.210 56.100 0.106 0.000 0.895 218 R CB 1.943 32.293 30.300 0.084 0.000 1.195 218 R HN 0.785 9.055 8.270 -0.000 0.000 0.450 219 Y N 1.710 122.036 120.300 0.044 0.000 2.620 219 Y HA -0.025 4.524 4.550 -0.001 0.000 0.330 219 Y C 0.481 176.411 175.900 0.050 0.000 1.186 219 Y CA 0.920 59.046 58.100 0.044 0.000 1.467 219 Y CB 1.098 39.581 38.460 0.039 0.000 1.262 219 Y HN 0.445 8.725 8.280 -0.000 0.000 0.550 220 S N 5.120 120.466 115.700 -0.590 0.000 3.983 220 S HA 0.164 4.633 4.470 -0.001 0.000 0.194 220 S C -0.381 174.033 174.600 -0.309 0.000 1.464 220 S CA -0.349 57.645 58.200 -0.343 0.000 1.021 220 S CB -1.409 61.644 63.200 -0.244 0.000 1.424 220 S HN 0.717 9.027 8.310 -0.000 0.000 0.473 221 S N 1.415 117.057 115.700 -0.096 0.000 2.603 221 S HA 0.555 5.025 4.470 -0.001 0.000 0.268 221 S C 1.580 176.225 174.600 0.075 0.000 1.317 221 S CA -0.305 57.935 58.200 0.067 0.000 1.012 221 S CB 1.212 64.548 63.200 0.228 0.000 0.926 221 S HN 0.553 8.863 8.310 -0.000 0.000 0.539 222 A N 0.782 123.655 122.820 0.089 0.000 1.978 222 A HA -0.088 4.232 4.320 -0.001 0.000 0.220 222 A C 1.829 179.475 177.584 0.103 0.000 1.170 222 A CA 1.623 53.707 52.037 0.079 0.000 0.636 222 A CB -1.223 17.824 19.000 0.079 0.000 0.810 222 A HN 1.016 9.166 8.150 -0.000 0.000 0.448 223 Y N -0.033 120.279 120.300 0.019 0.000 2.220 223 Y HA -0.084 4.465 4.550 -0.001 0.000 0.291 223 Y C 2.326 178.235 175.900 0.015 0.000 1.129 223 Y CA 2.020 60.129 58.100 0.014 0.000 1.161 223 Y CB -0.032 38.442 38.460 0.023 0.000 0.997 223 Y HN 0.352 8.632 8.280 -0.000 0.000 0.522 224 E N 0.278 120.596 120.200 0.196 0.000 2.107 224 E HA -0.147 4.203 4.350 -0.001 0.000 0.191 224 E C 2.161 178.767 176.600 0.010 0.000 0.982 224 E CA 0.849 57.314 56.400 0.108 0.000 0.809 224 E CB -0.531 29.271 29.700 0.171 0.000 0.756 224 E HN 0.460 8.820 8.360 -0.000 0.000 0.459 225 L N 1.013 122.242 121.223 0.010 0.000 1.989 225 L HA -0.219 4.121 4.340 -0.001 0.000 0.211 225 L C 1.803 178.646 176.870 -0.044 0.000 1.071 225 L CA 2.093 56.926 54.840 -0.012 0.000 0.749 225 L CB -0.782 41.276 42.059 -0.001 0.000 0.890 225 L HN 0.258 8.488 8.230 -0.000 0.000 0.431 226 E N -0.508 119.648 120.200 -0.073 0.000 2.038 226 E HA -0.215 4.135 4.350 -0.001 0.000 0.195 226 E C 2.009 178.525 176.600 -0.141 0.000 1.000 226 E CA 1.243 57.574 56.400 -0.115 0.000 0.803 226 E CB -0.389 29.212 29.700 -0.164 0.000 0.750 226 E HN 0.692 9.052 8.360 -0.000 0.000 0.448 227 G N 0.860 109.545 108.800 -0.192 0.000 2.440 227 G HA2 -0.294 3.665 3.960 -0.001 0.000 0.218 227 G HA3 -0.294 3.665 3.960 -0.001 0.000 0.218 227 G C 1.635 176.483 174.900 -0.087 0.000 1.154 227 G CA 1.067 46.069 45.100 -0.164 0.000 0.767 227 G HN 0.371 8.661 8.290 -0.000 0.000 0.552 228 A N -0.053 122.731 122.820 -0.060 0.000 1.897 228 A HA 0.156 4.475 4.320 -0.001 0.000 0.215 228 A C 2.583 180.141 177.584 -0.043 0.000 1.181 228 A CA 1.656 53.672 52.037 -0.034 0.000 0.620 228 A CB -0.587 18.405 19.000 -0.014 0.000 0.821 228 A HN 0.248 8.398 8.150 -0.000 0.000 0.443 229 V N 0.135 120.016 119.914 -0.054 0.000 2.407 229 V HA -0.253 3.867 4.120 -0.001 0.000 0.248 229 V C 2.416 178.474 176.094 -0.060 0.000 1.055 229 V CA 2.308 64.569 62.300 -0.066 0.000 1.049 229 V CB -0.625 31.153 31.823 -0.076 0.000 0.662 229 V HN 0.534 8.724 8.190 -0.000 0.000 0.455 230 K N 0.221 120.588 120.400 -0.055 0.000 2.148 230 K HA -0.113 4.207 4.320 -0.001 0.000 0.204 230 K C 2.032 178.612 176.600 -0.033 0.000 1.050 230 K CA 1.159 57.423 56.287 -0.039 0.000 0.942 230 K CB -0.077 32.394 32.500 -0.049 0.000 0.724 230 K HN 0.545 8.796 8.250 -0.000 0.000 0.446 231 R N -0.283 120.195 120.500 -0.037 0.000 2.334 231 R HA 0.289 4.628 4.340 -0.001 0.000 0.216 231 R C 0.199 176.480 176.300 -0.031 0.000 0.905 231 R CA -0.065 56.018 56.100 -0.029 0.000 1.064 231 R CB 0.305 30.591 30.300 -0.023 0.000 1.046 231 R HN -0.095 8.175 8.270 -0.000 0.000 0.508 232 A N 1.750 124.546 122.820 -0.041 0.000 2.388 232 A HA 0.160 4.480 4.320 -0.001 0.000 0.257 232 A C 0.233 177.787 177.584 -0.051 0.000 1.095 232 A CA -0.550 51.458 52.037 -0.047 0.000 0.791 232 A CB 0.534 19.498 19.000 -0.060 0.000 1.029 232 A HN 0.180 8.330 8.150 -0.000 0.000 0.489 233 D N 0.512 120.884 120.400 -0.048 0.000 2.249 233 D HA 0.057 4.697 4.640 -0.001 0.000 0.205 233 D C 0.149 176.414 176.300 -0.059 0.000 0.962 233 D CA 0.888 54.859 54.000 -0.047 0.000 0.860 233 D CB 0.323 41.100 40.800 -0.039 0.000 0.955 233 D HN 0.346 8.716 8.370 -0.000 0.000 0.505 234 L N 1.229 122.412 121.223 -0.066 0.000 2.464 234 L HA 0.344 4.684 4.340 -0.001 0.000 0.266 234 L C -1.729 175.091 176.870 -0.082 0.000 0.965 234 L CA -0.519 54.277 54.840 -0.074 0.000 0.833 234 L CB 2.639 44.662 42.059 -0.060 0.000 1.296 234 L HN -0.341 7.889 8.230 -0.000 0.000 0.405 235 V N 5.673 125.523 119.914 -0.105 0.000 2.588 235 V HA 0.512 4.631 4.120 -0.001 0.000 0.304 235 V C -0.211 175.880 176.094 -0.006 0.000 1.042 235 V CA -0.399 61.847 62.300 -0.090 0.000 0.877 235 V CB 2.212 33.911 31.823 -0.207 0.000 0.996 235 V HN 0.541 8.731 8.190 -0.000 0.000 0.425 236 I N 3.745 124.344 120.570 0.048 0.000 2.382 236 I HA 0.498 4.668 4.170 -0.001 0.000 0.285 236 I C 0.798 176.994 176.117 0.131 0.000 1.007 236 I CA -0.348 60.999 61.300 0.080 0.000 1.142 236 I CB 1.786 39.788 38.000 0.003 0.000 1.289 236 I HN 0.732 8.942 8.210 -0.000 0.000 0.453 237 G N 4.334 113.235 108.800 0.168 0.000 2.338 237 G HA2 0.495 4.455 3.960 -0.001 0.000 0.295 237 G HA3 0.495 4.455 3.960 -0.001 0.000 0.295 237 G C 0.311 175.156 174.900 -0.092 0.000 1.132 237 G CA -0.174 44.913 45.100 -0.022 0.000 0.922 237 G HN 0.797 9.087 8.290 -0.000 0.000 0.427 238 A N 2.994 125.791 122.820 -0.038 0.000 2.605 238 A HA 0.441 4.760 4.320 -0.001 0.000 0.292 238 A C 0.301 177.874 177.584 -0.018 0.000 1.055 238 A CA -0.123 51.898 52.037 -0.027 0.000 0.969 238 A CB 0.635 19.635 19.000 0.000 0.000 1.236 238 A HN 0.550 8.700 8.150 -0.000 0.000 0.534 239 V N 1.692 121.587 119.914 -0.033 0.000 2.352 239 V HA 0.156 4.276 4.120 -0.001 0.000 0.253 239 V C -0.501 175.576 176.094 -0.029 0.000 1.083 239 V CA 0.096 62.384 62.300 -0.020 0.000 0.993 239 V CB 0.321 32.135 31.823 -0.016 0.000 1.111 239 V HN 0.403 8.593 8.190 -0.000 0.000 0.490 240 L N 5.924 127.140 121.223 -0.013 0.000 2.288 240 L HA 0.431 4.770 4.340 -0.001 0.000 0.283 240 L C 0.408 177.280 176.870 0.003 0.000 1.072 240 L CA 0.317 55.151 54.840 -0.011 0.000 0.862 240 L CB 1.174 43.232 42.059 -0.001 0.000 1.245 240 L HN 0.531 8.761 8.230 -0.000 0.000 0.432 241 V N 5.819 125.733 119.914 -0.001 0.000 2.390 241 V HA 0.417 4.537 4.120 -0.001 0.000 0.260 241 V C -0.374 175.731 176.094 0.018 0.000 1.043 241 V CA -0.033 62.273 62.300 0.009 0.000 1.047 241 V CB -0.687 31.140 31.823 0.006 0.000 1.066 241 V HN 0.653 8.843 8.190 -0.000 0.000 0.481 242 P HA -0.313 4.107 4.420 -0.000 0.000 0.228 242 P C 1.235 178.566 177.300 0.052 0.000 0.798 242 P CA 3.102 66.227 63.100 0.042 0.000 1.070 242 P CB -0.095 31.630 31.700 0.041 0.000 0.714 243 G N -4.167 104.661 108.800 0.047 0.000 4.008 243 G HA2 0.584 4.544 3.960 -0.001 0.000 0.278 243 G HA3 0.584 4.544 3.960 -0.001 0.000 0.278 243 G C 0.627 175.551 174.900 0.040 0.000 1.021 243 G CA 1.411 46.545 45.100 0.057 0.000 0.833 243 G HN 0.840 9.130 8.290 -0.000 0.000 0.454 244 A N 0.888 123.725 122.820 0.027 0.000 3.293 244 A HA 0.724 5.043 4.320 -0.001 0.000 0.163 244 A C 1.385 178.973 177.584 0.007 0.000 2.052 244 A CA 0.822 52.870 52.037 0.018 0.000 1.062 244 A CB 0.325 19.335 19.000 0.017 0.000 1.908 244 A HN 0.100 8.250 8.150 -0.000 0.000 0.790 245 K N -2.127 118.275 120.400 0.003 0.000 2.412 245 K HA 0.496 4.815 4.320 -0.001 0.000 0.202 245 K C -0.162 176.431 176.600 -0.013 0.000 1.102 245 K CA 0.972 57.255 56.287 -0.006 0.000 1.027 245 K CB 0.652 33.151 32.500 -0.001 0.000 0.931 245 K HN 1.847 10.097 8.250 -0.000 0.000 0.557 246 A N 1.575 124.389 122.820 -0.009 0.000 2.425 246 A HA -0.050 4.270 4.320 -0.001 0.000 0.682 246 A C -2.732 174.847 177.584 -0.007 0.000 0.148 246 A CA -0.258 51.769 52.037 -0.017 0.000 0.059 246 A CB -1.482 17.495 19.000 -0.039 0.000 3.953 246 A HN 0.225 8.375 8.150 -0.000 0.000 0.545 247 P HA 0.423 4.843 4.420 -0.000 0.000 0.277 247 P C -0.689 176.629 177.300 0.029 0.000 1.240 247 P CA -0.235 62.875 63.100 0.017 0.000 0.798 247 P CB 0.667 32.378 31.700 0.019 0.000 0.979 248 K N 2.614 123.044 120.400 0.049 0.000 2.273 248 K HA 0.226 4.546 4.320 -0.001 0.000 0.287 248 K C 0.541 177.203 176.600 0.104 0.000 1.089 248 K CA -0.160 56.179 56.287 0.087 0.000 0.909 248 K CB 0.405 32.961 32.500 0.093 0.000 1.123 248 K HN 0.471 8.721 8.250 -0.000 0.000 0.473 249 L N 1.514 122.819 121.223 0.137 0.000 2.556 249 L HA 0.104 4.443 4.340 -0.001 0.000 0.226 249 L C 0.288 177.244 176.870 0.143 0.000 1.089 249 L CA 0.099 55.012 54.840 0.122 0.000 0.864 249 L CB 0.626 42.748 42.059 0.104 0.000 1.067 249 L HN 0.145 8.375 8.230 -0.000 0.000 0.477 250 V N 0.306 120.353 119.914 0.221 0.000 2.378 250 V HA 0.296 4.415 4.120 -0.001 0.000 0.288 250 V C 0.196 176.392 176.094 0.170 0.000 1.016 250 V CA -0.669 61.722 62.300 0.153 0.000 0.840 250 V CB 1.429 33.278 31.823 0.043 0.000 0.994 250 V HN 0.248 8.438 8.190 -0.000 0.000 0.431 251 S N 3.582 119.355 115.700 0.122 0.000 2.646 251 S HA 0.323 4.792 4.470 -0.001 0.000 0.276 251 S C 0.913 175.600 174.600 0.145 0.000 1.222 251 S CA -0.620 57.657 58.200 0.128 0.000 1.014 251 S CB 1.133 64.391 63.200 0.097 0.000 0.991 251 S HN 0.572 8.882 8.310 -0.000 0.000 0.533 252 N N 1.541 120.329 118.700 0.146 0.000 2.149 252 N HA -0.120 4.620 4.740 -0.001 0.000 0.188 252 N C 1.888 177.528 175.510 0.217 0.000 1.019 252 N CA 1.521 54.674 53.050 0.171 0.000 0.857 252 N CB -0.786 37.767 38.487 0.110 0.000 0.997 252 N HN 0.750 9.130 8.380 -0.000 0.000 0.426 253 S N 0.591 116.391 115.700 0.166 0.000 2.383 253 S HA 0.006 4.475 4.470 -0.001 0.000 0.227 253 S C 1.887 176.617 174.600 0.217 0.000 1.026 253 S CA 0.384 58.682 58.200 0.164 0.000 0.981 253 S CB -0.187 63.093 63.200 0.133 0.000 0.818 253 S HN 0.303 8.613 8.310 -0.000 0.000 0.472 254 L N 1.694 123.013 121.223 0.160 0.000 2.017 254 L HA -0.030 4.310 4.340 -0.001 0.000 0.208 254 L C 2.622 179.572 176.870 0.134 0.000 1.073 254 L CA 2.046 56.966 54.840 0.134 0.000 0.745 254 L CB -0.704 41.389 42.059 0.056 0.000 0.894 254 L HN 0.459 8.689 8.230 -0.000 0.000 0.432 255 V N -0.176 119.817 119.914 0.132 0.000 2.469 255 V HA -0.246 3.874 4.120 -0.001 0.000 0.251 255 V C 2.493 178.639 176.094 0.086 0.000 1.064 255 V CA 1.790 64.167 62.300 0.128 0.000 1.066 255 V CB -0.790 31.163 31.823 0.216 0.000 0.667 255 V HN 0.462 8.652 8.190 -0.000 0.000 0.461 256 A N -0.950 121.880 122.820 0.017 0.000 2.131 256 A HA -0.203 4.117 4.320 -0.001 0.000 0.220 256 A C 1.939 179.278 177.584 -0.408 0.000 1.158 256 A CA 1.756 53.549 52.037 -0.407 0.000 0.665 256 A CB -0.873 17.695 19.000 -0.720 0.000 0.795 256 A HN 0.864 9.014 8.150 -0.000 0.000 0.460 257 H N -1.567 117.447 119.070 -0.093 0.000 2.551 257 H HA 0.263 4.818 4.556 -0.001 0.000 0.271 257 H C 0.357 175.650 175.328 -0.058 0.000 0.984 257 H CA -0.103 55.900 56.048 -0.075 0.000 1.164 257 H CB -0.030 29.693 29.762 -0.064 0.000 1.437 257 H HN 0.465 8.745 8.280 -0.000 0.000 0.550 258 M N 1.049 120.665 119.600 0.027 0.000 2.202 258 M HA 0.127 4.607 4.480 -0.001 0.000 0.316 258 M C 0.546 176.840 176.300 -0.011 0.000 1.138 258 M CA -0.069 55.233 55.300 0.003 0.000 1.151 258 M CB 1.064 33.656 32.600 -0.014 0.000 1.422 258 M HN -0.107 8.183 8.290 -0.000 0.000 0.471 259 K N 1.409 121.800 120.400 -0.016 0.000 2.436 259 K HA 0.127 4.446 4.320 -0.001 0.000 0.275 259 K C -2.320 174.272 176.600 -0.013 0.000 0.999 259 K CA -1.076 55.201 56.287 -0.016 0.000 0.980 259 K CB -0.242 32.247 32.500 -0.019 0.000 0.919 259 K HN 0.249 8.499 8.250 -0.000 0.000 0.484 260 P HA -0.009 4.411 4.420 -0.000 0.000 0.268 260 P C 0.454 177.753 177.300 -0.001 0.000 1.204 260 P CA 0.480 63.579 63.100 -0.002 0.000 0.768 260 P CB 0.720 32.418 31.700 -0.004 0.000 0.842 261 G N 1.355 110.160 108.800 0.007 0.000 2.179 261 G HA2 -0.169 3.791 3.960 -0.001 0.000 0.260 261 G HA3 -0.169 3.791 3.960 -0.001 0.000 0.260 261 G C 0.448 175.345 174.900 -0.005 0.000 0.977 261 G CA -0.001 45.103 45.100 0.006 0.000 0.641 261 G HN 0.857 9.147 8.290 -0.000 0.000 0.533 262 A N -0.470 122.340 122.820 -0.016 0.000 2.445 262 A HA 0.665 4.985 4.320 -0.001 0.000 0.242 262 A C 0.690 178.243 177.584 -0.052 0.000 1.075 262 A CA 0.631 52.644 52.037 -0.040 0.000 0.777 262 A CB 1.103 20.069 19.000 -0.056 0.000 1.013 262 A HN 1.886 10.036 8.150 -0.000 0.000 0.493 263 V N 3.795 123.667 119.914 -0.070 0.000 2.513 263 V HA 0.685 4.804 4.120 -0.001 0.000 0.299 263 V C -0.938 175.053 176.094 -0.171 0.000 1.035 263 V CA -0.884 61.364 62.300 -0.087 0.000 0.889 263 V CB 1.320 33.137 31.823 -0.010 0.000 0.988 263 V HN 0.688 8.878 8.190 -0.000 0.000 0.440 264 L N 6.764 127.815 121.223 -0.286 0.000 2.333 264 L HA 0.604 4.944 4.340 -0.001 0.000 0.280 264 L C -0.542 176.244 176.870 -0.140 0.000 1.004 264 L CA -0.614 53.986 54.840 -0.400 0.000 0.820 264 L CB 1.729 43.150 42.059 -1.063 0.000 1.247 264 L HN 0.532 8.762 8.230 -0.000 0.000 0.416 265 V N 2.326 122.270 119.914 0.050 0.000 2.384 265 V HA 0.306 4.426 4.120 -0.001 0.000 0.287 265 V C -0.297 175.873 176.094 0.127 0.000 1.020 265 V CA -0.582 61.774 62.300 0.092 0.000 0.850 265 V CB 2.149 33.941 31.823 -0.051 0.000 0.987 265 V HN 0.601 8.791 8.190 -0.000 0.000 0.436 266 D N 4.251 124.684 120.400 0.055 0.000 2.454 266 D HA 0.387 5.027 4.640 -0.001 0.000 0.225 266 D C 0.831 177.070 176.300 -0.101 0.000 1.081 266 D CA -0.217 53.648 54.000 -0.225 0.000 0.864 266 D CB 1.400 42.027 40.800 -0.287 0.000 1.040 266 D HN 0.466 8.836 8.370 -0.000 0.000 0.517 267 I N 2.021 122.526 120.570 -0.108 0.000 2.928 267 I HA -0.100 4.069 4.170 -0.001 0.000 0.266 267 I C 1.943 178.011 176.117 -0.081 0.000 1.234 267 I CA 0.391 61.657 61.300 -0.056 0.000 1.483 267 I CB 0.189 38.163 38.000 -0.044 0.000 1.097 267 I HN 0.351 8.561 8.210 -0.000 0.000 0.455 268 A N 0.222 122.957 122.820 -0.142 0.000 2.302 268 A HA 0.065 4.385 4.320 -0.001 0.000 0.219 268 A C 1.913 179.431 177.584 -0.110 0.000 1.243 268 A CA 0.089 52.051 52.037 -0.124 0.000 0.856 268 A CB -0.430 18.484 19.000 -0.144 0.000 0.893 268 A HN 0.304 8.454 8.150 -0.000 0.000 0.491 269 I N 0.574 121.088 120.570 -0.093 0.000 2.142 269 I HA -0.148 4.021 4.170 -0.001 0.000 0.240 269 I C 0.211 176.284 176.117 -0.073 0.000 1.078 269 I CA 0.930 62.191 61.300 -0.064 0.000 1.343 269 I CB -0.304 37.682 38.000 -0.024 0.000 1.046 269 I HN 0.300 8.510 8.210 -0.000 0.000 0.405 270 D N 1.873 122.220 120.400 -0.090 0.000 2.478 270 D HA -0.098 4.542 4.640 -0.001 0.000 0.234 270 D C 0.902 177.122 176.300 -0.133 0.000 1.154 270 D CA 0.893 54.814 54.000 -0.132 0.000 0.874 270 D CB 0.100 40.800 40.800 -0.167 0.000 1.198 270 D HN 0.509 8.879 8.370 -0.000 0.000 0.455 271 Q N 0.330 120.039 119.800 -0.152 0.000 2.481 271 Q HA -0.295 4.044 4.340 -0.001 0.000 0.258 271 Q C 0.662 176.619 176.000 -0.072 0.000 0.961 271 Q CA 1.778 57.514 55.803 -0.110 0.000 1.121 271 Q CB -1.810 26.869 28.738 -0.099 0.000 1.503 271 Q HN 0.987 9.257 8.270 -0.000 0.000 0.544 272 G N -1.523 107.237 108.800 -0.066 0.000 2.339 272 G HA2 0.164 4.124 3.960 -0.001 0.000 0.209 272 G HA3 0.164 4.124 3.960 -0.001 0.000 0.209 272 G C 1.078 175.956 174.900 -0.038 0.000 1.015 272 G CA 0.485 45.559 45.100 -0.043 0.000 0.635 272 G HN 1.953 10.243 8.290 -0.000 0.000 0.499 273 G N -1.757 107.003 108.800 -0.067 0.000 2.730 273 G HA2 0.242 4.202 3.960 -0.001 0.000 0.686 273 G HA3 0.242 4.202 3.960 -0.001 0.000 0.686 273 G C 0.958 175.784 174.900 -0.124 0.000 1.343 273 G CA 0.828 45.867 45.100 -0.103 0.000 0.826 273 G HN 2.171 10.461 8.290 -0.000 0.000 0.582 274 C N -1.022 118.117 119.300 -0.269 0.000 3.525 274 C HA 0.732 5.191 4.460 -0.001 0.000 0.289 274 C C 0.726 175.696 174.990 -0.034 0.000 1.496 274 C CA -0.923 57.987 59.018 -0.181 0.000 1.804 274 C CB -1.437 26.183 27.740 -0.200 0.000 2.708 274 C HN 0.641 8.871 8.230 -0.000 0.000 0.642 275 F N 1.427 121.443 119.950 0.110 0.000 2.432 275 F HA 0.429 4.956 4.527 -0.001 0.000 0.329 275 F C 1.740 177.655 175.800 0.191 0.000 1.076 275 F CA -0.775 57.329 58.000 0.173 0.000 1.018 275 F CB 0.953 40.122 39.000 0.282 0.000 1.201 275 F HN 0.066 8.366 8.300 -0.000 0.000 0.489 276 E N 1.945 122.366 120.200 0.369 0.000 2.058 276 E HA -0.146 4.204 4.350 -0.001 0.000 0.194 276 E C 2.109 178.821 176.600 0.186 0.000 0.997 276 E CA 1.273 57.802 56.400 0.215 0.000 0.801 276 E CB -0.225 29.572 29.700 0.161 0.000 0.746 276 E HN 0.925 9.285 8.360 -0.000 0.000 0.450 277 G N 0.241 109.166 108.800 0.209 0.000 2.848 277 G HA2 -0.049 3.911 3.960 -0.001 0.000 0.208 277 G HA3 -0.049 3.911 3.960 -0.001 0.000 0.208 277 G C 0.375 175.312 174.900 0.062 0.000 1.152 277 G CA -0.071 45.010 45.100 -0.032 0.000 0.789 277 G HN 0.048 8.338 8.290 -0.000 0.000 0.531 278 S N 0.114 116.021 115.700 0.344 0.000 2.576 278 S HA 0.554 5.023 4.470 -0.001 0.000 0.276 278 S C 0.255 174.982 174.600 0.213 0.000 1.339 278 S CA -0.218 58.237 58.200 0.425 0.000 1.039 278 S CB 1.280 64.693 63.200 0.355 0.000 0.902 278 S HN 0.416 8.726 8.310 -0.000 0.000 0.516 279 R N 2.543 123.183 120.500 0.233 0.000 2.560 279 R HA 0.231 4.571 4.340 -0.001 0.000 0.267 279 R C -3.260 173.085 176.300 0.076 0.000 1.150 279 R CA -1.662 54.464 56.100 0.043 0.000 0.997 279 R CB 1.595 31.786 30.300 -0.182 0.000 1.250 279 R HN 0.378 8.648 8.270 -0.000 0.000 0.433 280 P HA 0.006 4.426 4.420 -0.000 0.000 0.262 280 P C -0.306 176.974 177.300 -0.032 0.000 1.182 280 P CA 0.358 63.448 63.100 -0.018 0.000 0.761 280 P CB 0.774 32.442 31.700 -0.053 0.000 0.795 281 T N -0.371 114.157 114.554 -0.044 0.000 2.883 281 T HA 0.739 5.089 4.350 -0.001 0.000 0.284 281 T C 0.059 174.657 174.700 -0.170 0.000 1.041 281 T CA -0.642 61.420 62.100 -0.064 0.000 1.007 281 T CB 1.456 70.314 68.868 -0.017 0.000 1.220 281 T HN 0.522 8.762 8.240 -0.000 0.000 0.552 282 T N -2.030 112.431 114.554 -0.156 0.000 2.916 282 T HA 0.472 4.822 4.350 -0.001 0.000 0.292 282 T C 0.338 174.914 174.700 -0.206 0.000 1.064 282 T CA -0.881 61.081 62.100 -0.230 0.000 1.011 282 T CB 0.900 69.719 68.868 -0.081 0.000 1.152 282 T HN 0.568 8.808 8.240 -0.000 0.000 0.510 283 Y N 0.809 121.100 120.300 -0.016 0.000 2.207 283 Y HA -0.130 4.420 4.550 -0.000 0.000 0.287 283 Y C 2.597 178.471 175.900 -0.043 0.000 1.156 283 Y CA 1.608 59.706 58.100 -0.004 0.000 1.182 283 Y CB -0.228 38.266 38.460 0.057 0.000 0.979 283 Y HN 0.747 9.027 8.280 -0.000 0.000 0.521 284 D N -1.390 119.034 120.400 0.040 0.000 2.194 284 D HA -0.129 4.511 4.640 -0.001 0.000 0.204 284 D C 0.115 176.145 176.300 -0.450 0.000 0.964 284 D CA 1.153 55.039 54.000 -0.191 0.000 0.846 284 D CB -0.404 40.242 40.800 -0.256 0.000 0.962 284 D HN 0.381 8.751 8.370 -0.000 0.000 0.490 285 H N 0.579 119.674 119.070 0.042 0.000 2.541 285 H HA 0.256 4.811 4.556 -0.001 0.000 0.246 285 H C -1.772 173.539 175.328 -0.028 0.000 1.341 285 H CA -1.456 54.607 56.048 0.025 0.000 1.469 285 H CB 1.796 31.572 29.762 0.024 0.000 1.472 285 H HN 0.102 8.382 8.280 -0.000 0.000 0.503 286 P HA -0.048 4.372 4.420 -0.000 0.000 0.221 286 P C 0.691 177.808 177.300 -0.305 0.000 1.155 286 P CA 0.815 63.759 63.100 -0.261 0.000 0.812 286 P CB 0.513 32.026 31.700 -0.310 0.000 0.801 287 T N -1.604 112.889 114.554 -0.103 0.000 2.932 287 T HA 0.691 5.041 4.350 -0.001 0.000 0.289 287 T C -0.532 174.239 174.700 0.117 0.000 1.039 287 T CA -0.805 61.247 62.100 -0.079 0.000 1.024 287 T CB 1.578 70.392 68.868 -0.090 0.000 1.090 287 T HN 0.063 8.303 8.240 -0.000 0.000 0.496 288 F N -1.291 118.686 119.950 0.045 0.000 2.645 288 F HA 0.857 5.383 4.527 -0.001 0.000 0.310 288 F C -0.652 175.176 175.800 0.046 0.000 1.102 288 F CA -1.925 56.087 58.000 0.021 0.000 0.952 288 F CB 0.842 39.823 39.000 -0.031 0.000 1.326 288 F HN 0.867 9.167 8.300 -0.000 0.000 0.456 289 A N 1.429 124.359 122.820 0.182 0.000 2.354 289 A HA 0.709 5.028 4.320 -0.001 0.000 0.269 289 A C -1.079 176.554 177.584 0.080 0.000 1.109 289 A CA -0.613 51.477 52.037 0.089 0.000 0.800 289 A CB 0.840 19.885 19.000 0.074 0.000 1.045 289 A HN 0.899 9.049 8.150 -0.000 0.000 0.489 290 V N 4.207 124.123 119.914 0.004 0.000 2.447 290 V HA 0.341 4.460 4.120 -0.001 0.000 0.292 290 V C -0.381 175.738 176.094 0.041 0.000 1.021 290 V CA -0.423 61.816 62.300 -0.101 0.000 0.850 290 V CB 0.839 32.457 31.823 -0.342 0.000 1.005 290 V HN 1.019 9.209 8.190 -0.000 0.000 0.426 291 H N 4.008 123.082 119.070 0.008 0.000 2.592 291 H HA -0.164 4.391 4.556 -0.001 0.000 0.323 291 H C 0.974 176.307 175.328 0.008 0.000 1.117 291 H CA 1.120 57.169 56.048 0.001 0.000 1.120 291 H CB -1.006 28.753 29.762 -0.005 0.000 1.561 291 H HN 1.025 9.305 8.280 -0.000 0.000 0.409 292 D N -2.467 118.006 120.400 0.122 0.000 2.978 292 D HA -0.172 4.468 4.640 -0.001 0.000 0.205 292 D C 0.820 177.162 176.300 0.071 0.000 1.093 292 D CA 1.896 55.941 54.000 0.076 0.000 1.006 292 D CB -1.059 39.770 40.800 0.048 0.000 1.116 292 D HN 0.752 9.122 8.370 -0.000 0.000 0.419 293 T N -2.110 112.507 114.554 0.104 0.000 2.948 293 T HA 0.642 4.991 4.350 -0.001 0.000 0.285 293 T C -0.201 174.563 174.700 0.106 0.000 1.019 293 T CA -0.972 61.183 62.100 0.092 0.000 1.013 293 T CB 2.459 71.390 68.868 0.106 0.000 1.117 293 T HN 0.005 8.245 8.240 -0.000 0.000 0.533 294 L N 1.334 122.594 121.223 0.063 0.000 2.325 294 L HA 0.600 4.940 4.340 -0.001 0.000 0.281 294 L C -1.336 175.530 176.870 -0.007 0.000 1.004 294 L CA -1.053 53.806 54.840 0.032 0.000 0.823 294 L CB 0.727 42.803 42.059 0.028 0.000 1.236 294 L HN 0.758 8.988 8.230 -0.000 0.000 0.415 295 F N 4.165 123.878 119.950 -0.394 0.000 2.421 295 F HA 0.380 4.907 4.527 -0.001 0.000 0.337 295 F C -0.777 174.818 175.800 -0.342 0.000 1.105 295 F CA -0.364 57.373 58.000 -0.439 0.000 1.049 295 F CB 1.392 39.826 39.000 -0.945 0.000 1.139 295 F HN 0.414 8.714 8.300 -0.000 0.000 0.479 296 Y N 3.430 123.641 120.300 -0.150 0.000 2.326 296 Y HA 0.432 4.981 4.550 -0.001 0.000 0.329 296 Y C -0.790 175.105 175.900 -0.008 0.000 0.973 296 Y CA -0.751 57.280 58.100 -0.115 0.000 1.162 296 Y CB 1.156 39.517 38.460 -0.165 0.000 1.147 296 Y HN 0.639 8.919 8.280 -0.000 0.000 0.456 297 C N 6.260 125.537 119.300 -0.039 0.000 3.061 297 C HA 0.280 4.739 4.460 -0.001 0.000 0.249 297 C C -0.383 174.578 174.990 -0.049 0.000 2.060 297 C CA -0.772 58.296 59.018 0.084 0.000 1.649 297 C CB -1.048 26.828 27.740 0.228 0.000 3.268 297 C HN 0.648 8.878 8.230 -0.000 0.000 0.457 298 V N 2.631 122.433 119.914 -0.187 0.000 2.529 298 V HA 0.333 4.453 4.120 -0.001 0.000 0.292 298 V C 1.015 177.030 176.094 -0.131 0.000 1.028 298 V CA 0.415 62.569 62.300 -0.244 0.000 1.074 298 V CB 0.423 32.055 31.823 -0.319 0.000 0.958 298 V HN 0.668 8.858 8.190 -0.000 0.000 0.481 299 A N 4.860 127.563 122.820 -0.195 0.000 2.407 299 A HA 0.375 4.695 4.320 -0.001 0.000 0.248 299 A C 1.064 178.576 177.584 -0.120 0.000 1.082 299 A CA 0.303 52.259 52.037 -0.135 0.000 0.785 299 A CB -0.221 18.698 19.000 -0.135 0.000 1.020 299 A HN 1.237 9.387 8.150 -0.000 0.000 0.489 300 N N 1.248 119.922 118.700 -0.043 0.000 2.783 300 N HA -0.162 4.578 4.740 -0.001 0.000 0.247 300 N C 0.740 176.332 175.510 0.137 0.000 1.089 300 N CA 0.793 53.857 53.050 0.023 0.000 0.690 300 N CB -0.894 37.608 38.487 0.026 0.000 0.991 300 N HN 0.801 9.181 8.380 -0.000 0.000 0.552 301 M N 0.119 119.793 119.600 0.123 0.000 2.108 301 M HA -0.123 4.356 4.480 -0.001 0.000 0.261 301 M C -1.019 175.405 176.300 0.207 0.000 1.066 301 M CA 2.014 57.441 55.300 0.211 0.000 1.107 301 M CB -0.703 31.997 32.600 0.166 0.000 1.356 301 M HN 0.207 8.497 8.290 -0.000 0.000 0.406 302 P HA -0.096 4.324 4.420 -0.000 0.000 0.223 302 P C 0.623 178.021 177.300 0.162 0.000 1.144 302 P CA 1.392 64.569 63.100 0.129 0.000 0.783 302 P CB -0.260 31.499 31.700 0.099 0.000 0.771 303 A N -0.117 122.831 122.820 0.214 0.000 2.168 303 A HA -0.082 4.237 4.320 -0.001 0.000 0.215 303 A C 2.066 179.805 177.584 0.258 0.000 1.152 303 A CA 1.513 53.701 52.037 0.251 0.000 0.716 303 A CB -1.127 18.037 19.000 0.272 0.000 0.794 303 A HN 0.328 8.478 8.150 -0.000 0.000 0.465 304 S N -0.574 115.231 115.700 0.175 0.000 2.558 304 S HA 0.157 4.627 4.470 -0.001 0.000 0.217 304 S C 0.581 175.169 174.600 -0.020 0.000 0.975 304 S CA 0.540 58.749 58.200 0.014 0.000 0.912 304 S CB -0.358 62.844 63.200 0.004 0.000 0.776 304 S HN 0.912 9.222 8.310 -0.000 0.000 0.526 305 V N -1.565 118.373 119.914 0.039 0.000 2.446 305 V HA 0.465 4.585 4.120 -0.001 0.000 0.257 305 V C -2.157 173.967 176.094 0.050 0.000 1.036 305 V CA -1.807 60.502 62.300 0.014 0.000 1.196 305 V CB 0.508 32.340 31.823 0.016 0.000 1.446 305 V HN -0.003 8.187 8.190 -0.000 0.000 0.558 306 P HA -0.170 4.250 4.420 -0.000 0.000 0.218 306 P C 1.551 178.920 177.300 0.115 0.000 1.148 306 P CA 1.523 64.691 63.100 0.113 0.000 0.822 306 P CB 0.509 32.294 31.700 0.142 0.000 0.784 307 K N -0.254 120.192 120.400 0.076 0.000 2.057 307 K HA -0.093 4.227 4.320 -0.001 0.000 0.207 307 K C 1.945 178.631 176.600 0.144 0.000 1.049 307 K CA 1.931 58.284 56.287 0.111 0.000 0.931 307 K CB -0.695 31.823 32.500 0.031 0.000 0.714 307 K HN -0.010 8.240 8.250 -0.000 0.000 0.440 308 T N -0.044 114.556 114.554 0.078 0.000 2.732 308 T HA -0.117 4.233 4.350 -0.001 0.000 0.261 308 T C 1.943 176.725 174.700 0.136 0.000 1.040 308 T CA 1.616 63.763 62.100 0.077 0.000 1.145 308 T CB -0.297 68.594 68.868 0.039 0.000 0.866 308 T HN 0.481 8.721 8.240 -0.000 0.000 0.427 309 S N 0.894 116.670 115.700 0.126 0.000 2.461 309 S HA -0.051 4.418 4.470 -0.001 0.000 0.228 309 S C 2.120 176.801 174.600 0.135 0.000 1.005 309 S CA 0.886 59.162 58.200 0.127 0.000 0.942 309 S CB -0.865 62.406 63.200 0.119 0.000 0.776 309 S HN 0.358 8.668 8.310 -0.000 0.000 0.514 310 T N 1.363 116.005 114.554 0.147 0.000 2.684 310 T HA -0.072 4.278 4.350 -0.001 0.000 0.267 310 T C 1.327 176.052 174.700 0.043 0.000 1.036 310 T CA 1.769 63.922 62.100 0.088 0.000 1.148 310 T CB -0.520 68.391 68.868 0.073 0.000 0.863 310 T HN 0.536 8.776 8.240 -0.000 0.000 0.436 311 Y N 1.093 121.411 120.300 0.030 0.000 2.220 311 Y HA 0.092 4.642 4.550 -0.001 0.000 0.291 311 Y C 2.646 178.554 175.900 0.014 0.000 1.129 311 Y CA 0.682 58.793 58.100 0.019 0.000 1.161 311 Y CB -0.669 37.798 38.460 0.012 0.000 0.997 311 Y HN 0.185 8.465 8.280 -0.000 0.000 0.522 312 A N -0.264 122.663 122.820 0.180 0.000 1.877 312 A HA -0.194 4.125 4.320 -0.001 0.000 0.216 312 A C 2.162 179.781 177.584 0.059 0.000 1.186 312 A CA 1.770 53.872 52.037 0.107 0.000 0.620 312 A CB -1.076 17.982 19.000 0.097 0.000 0.822 312 A HN 0.422 8.572 8.150 -0.000 0.000 0.443 313 L N 0.379 121.627 121.223 0.041 0.000 2.005 313 L HA -0.118 4.221 4.340 -0.001 0.000 0.207 313 L C 2.769 179.570 176.870 -0.114 0.000 1.072 313 L CA 3.074 57.892 54.840 -0.036 0.000 0.744 313 L CB -1.050 41.002 42.059 -0.013 0.000 0.895 313 L HN 0.556 8.786 8.230 -0.000 0.000 0.433 314 T N -3.395 111.104 114.554 -0.092 0.000 2.951 314 T HA -0.096 4.253 4.350 -0.001 0.000 0.268 314 T C 1.777 176.438 174.700 -0.066 0.000 1.073 314 T CA 1.101 63.132 62.100 -0.115 0.000 1.134 314 T CB -0.639 68.153 68.868 -0.126 0.000 0.884 314 T HN 0.324 8.564 8.240 -0.000 0.000 0.479 315 N N 2.345 121.035 118.700 -0.016 0.000 2.120 315 N HA 0.071 4.810 4.740 -0.001 0.000 0.188 315 N C 2.210 177.721 175.510 0.000 0.000 1.024 315 N CA 1.554 54.613 53.050 0.014 0.000 0.852 315 N CB -0.813 37.709 38.487 0.057 0.000 1.003 315 N HN 0.639 9.019 8.380 -0.000 0.000 0.424 316 A N 0.421 123.235 122.820 -0.010 0.000 1.898 316 A HA -0.111 4.208 4.320 -0.001 0.000 0.216 316 A C 2.343 179.945 177.584 0.030 0.000 1.181 316 A CA 2.156 54.198 52.037 0.008 0.000 0.620 316 A CB -1.137 17.862 19.000 -0.001 0.000 0.819 316 A HN 0.498 8.648 8.150 -0.000 0.000 0.442 317 T N -2.787 111.725 114.554 -0.070 0.000 2.915 317 T HA -0.130 4.219 4.350 -0.001 0.000 0.269 317 T C 1.863 176.628 174.700 0.109 0.000 1.071 317 T CA 1.456 63.541 62.100 -0.024 0.000 1.132 317 T CB -0.484 68.178 68.868 -0.342 0.000 0.878 317 T HN 0.348 8.588 8.240 -0.000 0.000 0.479 318 M N 2.278 121.890 119.600 0.020 0.000 2.110 318 M HA -0.077 4.403 4.480 -0.001 0.000 0.257 318 M C -0.784 175.513 176.300 -0.006 0.000 1.071 318 M CA 2.386 57.693 55.300 0.012 0.000 1.096 318 M CB -0.804 31.789 32.600 -0.011 0.000 1.300 318 M HN 0.196 8.486 8.290 -0.000 0.000 0.411 319 P HA -0.147 4.273 4.420 -0.000 0.000 0.220 319 P C 0.734 177.903 177.300 -0.219 0.000 1.148 319 P CA 1.558 64.541 63.100 -0.195 0.000 0.803 319 P CB -0.396 31.112 31.700 -0.320 0.000 0.782 320 Y N -0.034 120.319 120.300 0.089 0.000 2.220 320 Y HA -0.114 4.436 4.550 -0.000 0.000 0.291 320 Y C 2.687 178.638 175.900 0.086 0.000 1.129 320 Y CA 0.666 58.835 58.100 0.115 0.000 1.161 320 Y CB -1.657 36.960 38.460 0.263 0.000 0.997 320 Y HN -0.274 8.006 8.280 -0.000 0.000 0.522 321 V N 0.429 120.529 119.914 0.310 0.000 2.282 321 V HA -0.333 3.786 4.120 -0.001 0.000 0.249 321 V C 2.304 178.405 176.094 0.012 0.000 1.057 321 V CA 1.918 64.327 62.300 0.182 0.000 1.032 321 V CB -0.941 30.978 31.823 0.161 0.000 0.645 321 V HN 0.385 8.575 8.190 -0.000 0.000 0.447 322 L N -0.572 120.644 121.223 -0.012 0.000 2.017 322 L HA -0.202 4.137 4.340 -0.001 0.000 0.208 322 L C 2.615 179.423 176.870 -0.104 0.000 1.073 322 L CA 1.833 56.632 54.840 -0.067 0.000 0.745 322 L CB -0.736 41.295 42.059 -0.046 0.000 0.894 322 L HN 0.349 8.579 8.230 -0.000 0.000 0.432 323 E N 0.224 120.388 120.200 -0.059 0.000 2.085 323 E HA -0.231 4.119 4.350 -0.001 0.000 0.194 323 E C 2.384 178.952 176.600 -0.053 0.000 0.994 323 E CA 1.182 57.562 56.400 -0.034 0.000 0.801 323 E CB -0.110 29.621 29.700 0.052 0.000 0.743 323 E HN 0.437 8.797 8.360 -0.000 0.000 0.453 324 L N 0.212 121.399 121.223 -0.059 0.000 1.994 324 L HA -0.214 4.126 4.340 -0.001 0.000 0.208 324 L C 2.588 179.385 176.870 -0.121 0.000 1.071 324 L CA 1.226 56.017 54.840 -0.082 0.000 0.745 324 L CB -0.430 41.544 42.059 -0.141 0.000 0.892 324 L HN 0.148 8.378 8.230 -0.000 0.000 0.431 325 A N -0.605 122.088 122.820 -0.212 0.000 1.933 325 A HA -0.226 4.093 4.320 -0.001 0.000 0.218 325 A C 1.930 179.327 177.584 -0.311 0.000 1.175 325 A CA 1.954 53.752 52.037 -0.399 0.000 0.628 325 A CB -0.466 18.083 19.000 -0.753 0.000 0.814 325 A HN 0.366 8.516 8.150 -0.000 0.000 0.444 326 D N -1.448 118.799 120.400 -0.256 0.000 2.183 326 D HA -0.055 4.585 4.640 -0.001 0.000 0.203 326 D C 1.076 177.205 176.300 -0.285 0.000 0.969 326 D CA 1.071 54.924 54.000 -0.245 0.000 0.842 326 D CB -0.120 40.316 40.800 -0.606 0.000 0.957 326 D HN 0.592 8.962 8.370 -0.000 0.000 0.484 327 H N -1.181 117.885 119.070 -0.006 0.000 3.058 327 H HA 0.386 4.941 4.556 -0.001 0.000 0.266 327 H C 1.136 176.419 175.328 -0.074 0.000 1.135 327 H CA 0.511 56.538 56.048 -0.036 0.000 1.174 327 H CB 0.763 30.495 29.762 -0.050 0.000 1.581 327 H HN 0.054 8.334 8.280 -0.000 0.000 0.553 328 G N 1.531 110.348 108.800 0.029 0.000 2.856 328 G HA2 -0.266 3.693 3.960 -0.001 0.000 0.674 328 G HA3 -0.266 3.693 3.960 -0.001 0.000 0.674 328 G C 1.145 176.009 174.900 -0.061 0.000 1.519 328 G CA -0.021 45.072 45.100 -0.012 0.000 0.940 328 G HN 0.454 8.744 8.290 -0.000 0.000 0.564 329 W N 1.452 122.704 121.300 -0.080 0.000 2.354 329 W HA 0.015 4.674 4.660 -0.001 0.000 0.315 329 W C 1.143 177.596 176.519 -0.110 0.000 1.206 329 W CA 0.895 58.167 57.345 -0.121 0.000 1.290 329 W CB -0.544 28.820 29.460 -0.161 0.000 1.152 329 W HN 0.749 8.929 8.180 -0.000 0.000 0.489 330 R N 1.614 121.297 120.500 -1.362 0.000 2.537 330 R HA 0.305 4.644 4.340 -0.001 0.000 0.280 330 R C 0.757 176.750 176.300 -0.511 0.000 1.058 330 R CA 1.461 56.934 56.100 -1.045 0.000 1.057 330 R CB 0.679 30.117 30.300 -1.438 0.000 0.973 330 R HN 0.411 8.681 8.270 -0.000 0.000 0.438 331 A N 2.966 125.610 122.820 -0.293 0.000 1.303 331 A HA -0.273 4.047 4.320 -0.001 0.000 0.208 331 A C 1.540 179.057 177.584 -0.111 0.000 0.554 331 A CA 0.704 52.624 52.037 -0.194 0.000 1.109 331 A CB -2.290 16.593 19.000 -0.194 0.000 1.465 331 A HN 0.916 9.066 8.150 -0.000 0.000 0.722 332 A N -0.752 122.037 122.820 -0.052 0.000 1.873 332 A HA -0.164 4.156 4.320 -0.001 0.000 0.218 332 A C 2.292 179.882 177.584 0.009 0.000 1.193 332 A CA 2.802 54.853 52.037 0.022 0.000 0.629 332 A CB -1.516 17.508 19.000 0.040 0.000 0.826 332 A HN 1.570 9.720 8.150 -0.000 0.000 0.447 333 C N -1.605 117.691 119.300 -0.006 0.000 2.435 333 C HA 0.015 4.475 4.460 -0.001 0.000 0.279 333 C C 2.772 177.756 174.990 -0.009 0.000 1.321 333 C CA 1.009 60.035 59.018 0.014 0.000 1.752 333 C CB -1.369 26.407 27.740 0.061 0.000 1.959 333 C HN 0.651 8.881 8.230 -0.000 0.000 0.500 334 R N 0.952 121.420 120.500 -0.054 0.000 2.115 334 R HA -0.082 4.257 4.340 -0.001 0.000 0.226 334 R C 2.123 178.398 176.300 -0.042 0.000 1.100 334 R CA 1.492 57.557 56.100 -0.058 0.000 0.980 334 R CB -0.065 30.175 30.300 -0.100 0.000 0.875 334 R HN 0.482 8.752 8.270 -0.000 0.000 0.445 335 S N 0.183 115.858 115.700 -0.042 0.000 2.414 335 S HA -0.026 4.444 4.470 -0.001 0.000 0.227 335 S C 0.558 175.164 174.600 0.010 0.000 1.022 335 S CA 0.392 58.575 58.200 -0.027 0.000 0.958 335 S CB 0.062 63.237 63.200 -0.041 0.000 0.797 335 S HN 0.216 8.526 8.310 -0.000 0.000 0.493 336 N N 1.018 119.738 118.700 0.033 0.000 2.623 336 N HA 0.343 5.083 4.740 -0.001 0.000 0.256 336 N C -2.642 172.909 175.510 0.069 0.000 1.045 336 N CA -2.234 50.860 53.050 0.073 0.000 0.863 336 N CB 1.569 40.135 38.487 0.131 0.000 1.182 336 N HN -0.162 8.218 8.380 -0.000 0.000 0.523 337 P HA -0.048 4.372 4.420 -0.000 0.000 0.218 337 P C 0.918 178.245 177.300 0.044 0.000 1.149 337 P CA 0.909 64.034 63.100 0.042 0.000 0.817 337 P CB 0.349 32.071 31.700 0.037 0.000 0.785 338 A N -0.336 122.525 122.820 0.068 0.000 1.902 338 A HA -0.169 4.150 4.320 -0.001 0.000 0.217 338 A C 2.245 179.814 177.584 -0.024 0.000 1.181 338 A CA 1.291 53.355 52.037 0.046 0.000 0.623 338 A CB -1.619 17.451 19.000 0.116 0.000 0.818 338 A HN 0.140 8.290 8.150 -0.000 0.000 0.443 339 L N -0.894 120.327 121.223 -0.002 0.000 2.093 339 L HA -0.166 4.174 4.340 -0.001 0.000 0.208 339 L C 2.970 179.826 176.870 -0.025 0.000 1.085 339 L CA 1.254 56.059 54.840 -0.057 0.000 0.755 339 L CB -0.470 41.610 42.059 0.034 0.000 0.904 339 L HN 0.463 8.693 8.230 -0.000 0.000 0.435 340 A N -0.263 122.563 122.820 0.010 0.000 1.972 340 A HA -0.192 4.127 4.320 -0.001 0.000 0.219 340 A C 2.064 179.656 177.584 0.013 0.000 1.169 340 A CA 1.217 53.266 52.037 0.020 0.000 0.635 340 A CB -0.289 18.729 19.000 0.030 0.000 0.810 340 A HN 0.306 8.456 8.150 -0.000 0.000 0.446 341 K N -0.353 120.052 120.400 0.009 0.000 2.360 341 K HA -0.116 4.203 4.320 -0.001 0.000 0.201 341 K C 1.738 178.342 176.600 0.005 0.000 1.046 341 K CA 1.123 57.416 56.287 0.010 0.000 0.940 341 K CB -0.520 31.987 32.500 0.012 0.000 0.748 341 K HN 0.495 8.745 8.250 -0.000 0.000 0.465 342 G N 0.869 109.667 108.800 -0.004 0.000 2.683 342 G HA2 0.008 3.968 3.960 -0.001 0.000 0.213 342 G HA3 0.008 3.968 3.960 -0.001 0.000 0.213 342 G C 0.632 175.528 174.900 -0.007 0.000 1.142 342 G CA -0.392 44.710 45.100 0.004 0.000 0.793 342 G HN 0.114 8.404 8.290 -0.000 0.000 0.534 343 L N 1.643 122.858 121.223 -0.015 0.000 2.601 343 L HA 0.050 4.389 4.340 -0.001 0.000 0.277 343 L C 1.134 177.984 176.870 -0.033 0.000 1.219 343 L CA -0.085 54.736 54.840 -0.032 0.000 0.915 343 L CB 1.196 43.251 42.059 -0.007 0.000 1.160 343 L HN 0.101 8.331 8.230 -0.000 0.000 0.494 344 S N 0.240 115.906 115.700 -0.057 0.000 2.818 344 S HA 0.140 4.609 4.470 -0.001 0.000 0.251 344 S C 0.244 174.811 174.600 -0.055 0.000 1.083 344 S CA -0.054 58.118 58.200 -0.046 0.000 0.871 344 S CB 1.069 64.240 63.200 -0.047 0.000 0.831 344 S HN 0.687 8.997 8.310 -0.000 0.000 0.470 345 T N 1.512 116.015 114.554 -0.084 0.000 3.041 345 T HA 0.423 4.773 4.350 -0.001 0.000 0.321 345 T C -2.000 172.637 174.700 -0.104 0.000 1.184 345 T CA -0.371 61.676 62.100 -0.088 0.000 1.050 345 T CB 1.475 70.286 68.868 -0.095 0.000 1.159 345 T HN 0.333 8.573 8.240 -0.000 0.000 0.469 346 H N 2.642 121.576 119.070 -0.227 0.000 3.179 346 H HA 0.197 4.753 4.556 -0.001 0.000 0.331 346 H C -0.716 174.493 175.328 -0.199 0.000 1.013 346 H CA -0.318 55.545 56.048 -0.309 0.000 1.430 346 H CB 0.951 30.464 29.762 -0.415 0.000 1.895 346 H HN 0.890 9.170 8.280 -0.000 0.000 0.468 347 E N 3.227 123.062 120.200 -0.608 0.000 2.210 347 E HA -0.259 4.091 4.350 -0.001 0.000 0.201 347 E C 1.050 177.532 176.600 -0.197 0.000 1.339 347 E CA 1.063 57.203 56.400 -0.433 0.000 0.699 347 E CB -1.217 28.167 29.700 -0.526 0.000 1.126 347 E HN 1.124 9.484 8.360 -0.000 0.000 0.355 348 G N -1.134 107.581 108.800 -0.142 0.000 2.245 348 G HA2 -0.357 3.603 3.960 -0.001 0.000 0.264 348 G HA3 -0.357 3.603 3.960 -0.001 0.000 0.264 348 G C 0.367 175.225 174.900 -0.069 0.000 0.985 348 G CA 0.259 45.308 45.100 -0.084 0.000 0.625 348 G HN 1.047 9.337 8.290 -0.000 0.000 0.536 349 A N -0.051 122.725 122.820 -0.073 0.000 2.331 349 A HA 0.767 5.087 4.320 -0.001 0.000 0.283 349 A C -0.059 177.505 177.584 -0.034 0.000 1.142 349 A CA -0.096 51.918 52.037 -0.038 0.000 0.812 349 A CB 1.143 20.136 19.000 -0.012 0.000 1.074 349 A HN 1.457 9.607 8.150 -0.000 0.000 0.497 350 L N 3.002 124.210 121.223 -0.024 0.000 2.264 350 L HA 0.490 4.829 4.340 -0.001 0.000 0.289 350 L C -0.020 176.844 176.870 -0.010 0.000 1.044 350 L CA 0.135 54.961 54.840 -0.023 0.000 0.807 350 L CB 0.753 42.798 42.059 -0.022 0.000 1.192 350 L HN 0.679 8.909 8.230 -0.000 0.000 0.425 351 L N 3.492 124.709 121.223 -0.010 0.000 2.728 351 L HA 0.320 4.660 4.340 -0.001 0.000 0.238 351 L C 0.549 177.422 176.870 0.004 0.000 1.143 351 L CA 0.066 54.907 54.840 0.002 0.000 0.937 351 L CB 0.198 42.259 42.059 0.002 0.000 1.225 351 L HN 0.711 8.941 8.230 -0.000 0.000 0.507 352 S N -0.354 115.346 115.700 0.001 0.000 2.474 352 S HA 0.196 4.665 4.470 -0.001 0.000 0.321 352 S C 0.788 175.393 174.600 0.009 0.000 1.080 352 S CA -0.545 57.658 58.200 0.006 0.000 1.106 352 S CB 1.897 65.099 63.200 0.004 0.000 0.984 352 S HN 0.264 8.574 8.310 -0.000 0.000 0.464 353 E N 4.579 124.786 120.200 0.012 0.000 2.023 353 E HA -0.145 4.205 4.350 -0.001 0.000 0.196 353 E C 2.589 179.198 176.600 0.014 0.000 1.003 353 E CA 2.286 58.694 56.400 0.013 0.000 0.809 353 E CB -0.312 29.397 29.700 0.015 0.000 0.755 353 E HN 0.799 9.159 8.360 -0.000 0.000 0.449 354 R N 0.251 120.762 120.500 0.018 0.000 2.119 354 R HA -0.159 4.181 4.340 -0.001 0.000 0.246 354 R C 2.543 178.855 176.300 0.020 0.000 1.146 354 R CA 2.000 58.113 56.100 0.021 0.000 0.962 354 R CB -1.684 28.633 30.300 0.028 0.000 0.863 354 R HN 0.189 8.459 8.270 -0.000 0.000 0.442 355 V N 0.131 120.056 119.914 0.018 0.000 2.346 355 V HA -0.037 4.082 4.120 -0.001 0.000 0.244 355 V C 2.998 179.097 176.094 0.008 0.000 1.037 355 V CA 1.466 63.775 62.300 0.015 0.000 1.029 355 V CB -0.707 31.123 31.823 0.013 0.000 0.663 355 V HN 0.772 8.962 8.190 -0.000 0.000 0.454 356 A N 0.162 122.986 122.820 0.005 0.000 1.859 356 A HA -0.298 4.021 4.320 -0.001 0.000 0.217 356 A C 2.399 179.985 177.584 0.004 0.000 1.198 356 A CA 2.976 55.015 52.037 0.002 0.000 0.629 356 A CB -1.337 17.665 19.000 0.002 0.000 0.830 356 A HN 0.494 8.644 8.150 -0.000 0.000 0.446 357 T N -0.257 114.301 114.554 0.007 0.000 2.665 357 T HA -0.182 4.168 4.350 -0.001 0.000 0.268 357 T C 1.743 176.447 174.700 0.007 0.000 1.035 357 T CA 1.610 63.714 62.100 0.007 0.000 1.151 357 T CB -0.422 68.451 68.868 0.009 0.000 0.862 357 T HN 0.543 8.783 8.240 -0.000 0.000 0.438 358 D N 0.453 120.859 120.400 0.009 0.000 2.183 358 D HA 0.008 4.648 4.640 -0.001 0.000 0.203 358 D C 1.028 177.332 176.300 0.007 0.000 0.969 358 D CA 0.498 54.504 54.000 0.010 0.000 0.842 358 D CB -0.036 40.773 40.800 0.015 0.000 0.957 358 D HN 0.272 8.642 8.370 -0.000 0.000 0.484 359 L N 0.744 121.971 121.223 0.006 0.000 3.048 359 L HA 0.254 4.593 4.340 -0.001 0.000 0.234 359 L C 1.093 177.962 176.870 -0.001 0.000 1.318 359 L CA -0.005 54.837 54.840 0.003 0.000 1.109 359 L CB -0.381 41.679 42.059 0.001 0.000 1.480 359 L HN 0.096 8.326 8.230 -0.000 0.000 0.495 360 G N 0.071 108.871 108.800 0.000 0.000 2.622 360 G HA2 -0.470 3.490 3.960 -0.001 0.000 0.307 360 G HA3 -0.470 3.490 3.960 -0.001 0.000 0.307 360 G C 0.829 175.728 174.900 -0.002 0.000 1.226 360 G CA 0.904 46.003 45.100 -0.001 0.000 0.997 360 G HN 0.370 8.660 8.290 -0.000 0.000 0.551 361 V N 0.217 120.128 119.914 -0.005 0.000 2.239 361 V HA 0.133 4.252 4.120 -0.001 0.000 0.236 361 V C 0.967 177.058 176.094 -0.006 0.000 1.040 361 V CA 3.981 66.278 62.300 -0.005 0.000 0.996 361 V CB -1.983 29.835 31.823 -0.007 0.000 0.640 361 V HN 0.669 8.859 8.190 -0.000 0.000 0.456 362 P HA -0.266 4.154 4.420 -0.000 0.000 0.234 362 P C 0.504 177.800 177.300 -0.007 0.000 1.067 362 P CA 3.935 67.028 63.100 -0.012 0.000 1.034 362 P CB -0.636 31.054 31.700 -0.016 0.000 0.739 363 F N -5.328 114.619 119.950 -0.004 0.000 2.194 363 F HA 0.091 4.617 4.527 -0.001 0.000 0.318 363 F C 0.457 176.257 175.800 0.000 0.000 1.116 363 F CA -1.196 56.804 58.000 -0.001 0.000 0.905 363 F CB -2.109 36.890 39.000 -0.001 0.000 4.082 363 F HN 0.020 8.320 8.300 -0.000 0.000 0.166 364 T N 1.581 116.138 114.554 0.004 0.000 2.748 364 T HA 0.523 4.872 4.350 -0.001 0.000 0.304 364 T C -0.287 174.419 174.700 0.011 0.000 1.041 364 T CA 0.678 62.782 62.100 0.007 0.000 1.033 364 T CB 1.287 70.162 68.868 0.011 0.000 0.995 364 T HN 0.856 9.096 8.240 -0.000 0.000 0.536 365 E N 1.581 121.790 120.200 0.016 0.000 2.343 365 E HA 0.264 4.613 4.350 -0.001 0.000 0.260 365 E C -1.802 174.816 176.600 0.030 0.000 0.908 365 E CA -1.738 54.676 56.400 0.024 0.000 0.814 365 E CB 1.742 31.461 29.700 0.031 0.000 1.302 365 E HN 0.281 8.641 8.360 -0.000 0.000 0.408 366 P HA -0.229 4.191 4.420 -0.000 0.000 0.217 366 P C -0.342 176.979 177.300 0.035 0.000 1.162 366 P CA 1.457 64.573 63.100 0.027 0.000 0.901 366 P CB 0.238 31.953 31.700 0.025 0.000 0.793 367 A N -1.909 120.938 122.820 0.045 0.000 0.738 367 A HA 0.364 4.683 4.320 -0.001 0.000 0.182 367 A C 0.413 178.027 177.584 0.050 0.000 0.914 367 A CA 0.160 52.230 52.037 0.056 0.000 0.820 367 A CB -1.011 18.017 19.000 0.047 0.000 0.426 367 A HN 0.386 8.536 8.150 -0.000 0.000 0.448 368 S N -1.137 114.601 115.700 0.064 0.000 2.518 368 S HA 0.176 4.646 4.470 -0.001 0.000 0.174 368 S C 1.569 176.216 174.600 0.078 0.000 0.802 368 S CA 1.175 59.407 58.200 0.052 0.000 1.700 368 S CB -1.175 62.050 63.200 0.041 0.000 1.216 368 S HN 2.060 10.370 8.310 -0.000 0.000 0.574 369 V N 1.965 121.947 119.914 0.114 0.000 3.330 369 V HA 0.425 4.544 4.120 -0.001 0.000 0.273 369 V C 1.309 177.512 176.094 0.182 0.000 1.179 369 V CA 1.609 64.023 62.300 0.189 0.000 1.174 369 V CB -0.745 31.228 31.823 0.250 0.000 0.794 369 V HN 0.596 8.786 8.190 -0.000 0.000 0.527 370 L N 1.448 122.728 121.223 0.096 0.000 3.029 370 L HA 0.609 4.949 4.340 -0.001 0.000 0.231 370 L C 1.214 178.077 176.870 -0.012 0.000 1.327 370 L CA -0.194 54.652 54.840 0.010 0.000 1.166 370 L CB -0.357 41.701 42.059 -0.001 0.000 1.532 370 L HN 0.357 8.587 8.230 -0.000 0.000 0.473 371 A N 0.000 122.825 122.820 0.008 0.000 2.254 371 A HA 0.000 4.320 4.320 -0.001 0.000 0.244 371 A CA 0.000 52.041 52.037 0.007 0.000 0.836 371 A CB 0.000 19.012 19.000 0.021 0.000 0.831 371 A HN 0.000 8.150 8.150 -0.000 0.000 0.486