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 1pcq_1_E DATA FIRST_RESID 2 DATA SEQUENCE AAKDVKFGND ARVKMLRGVN VLADAVKVTL GPKGRNVVLD KSFGAPTITK DATA SEQUENCE DGVSVAREIE LEDKFENMGA QMVKEVASKA NDAAGDGTTT ATVLAQAIIT DATA SEQUENCE EGLKAVAAGM NPMDLKRGID KAVTAAVEEL KALSVPCSDS KAIAQVGTIS DATA SEQUENCE ANSDETVGKL IAEAMDKVGK EGVITVEDGT GLQDELDVVE GMQFDRGYLS DATA SEQUENCE PYFINKPETG AVELESPFIL LADKKISNIR EMLPVLEAVA KAGKPLLIIA DATA SEQUENCE EDVEGEALAT LVVNTMRGIV KVAAVKAPGF GDRRKAMLQD IATLTGGTVI DATA SEQUENCE SEEIGMELEK ATLEDLGQAK RVVINKDTTT IIDGVGEEAA IQGRVAQIRQ DATA SEQUENCE QIEEATSDYD REKLQERVAK LAGGVAVIKV GAATEVEMKE KKARVEDALH DATA SEQUENCE ATRAAVEEGV VAGGGVALIR VASKLADLRG QNEDQNVGIK VALRAMEAPL DATA SEQUENCE RQIVLNCGEE PSVVANTVKG GDGNYGYNAA TEEYGNMIDM GILDPTKVTR DATA SEQUENCE SALQYAASVA GLMITTECMV TDLP VARS RESID RESNAME ATOMNAME SS_SHIFT SHIFT RC_SHIFT HM_SHIFT EF_SHIFT SIGMA FORMAT %4d %4s %4s %9.3f %9.3f %9.3f %9.3f %9.3f %9.3f 2 A HA 0.000 4.320 4.320 -0.000 0.000 0.244 2 A C 0.000 177.574 177.584 -0.016 0.000 1.274 2 A CA 0.000 52.026 52.037 -0.017 0.000 0.836 2 A CB 0.000 18.985 19.000 -0.025 0.000 0.831 3 A N 1.882 124.695 122.820 -0.012 0.000 2.565 3 A HA 0.493 4.813 4.320 0.000 0.000 0.237 3 A C 0.260 177.833 177.584 -0.018 0.000 1.053 3 A CA 0.468 52.500 52.037 -0.008 0.000 0.755 3 A CB -0.115 18.883 19.000 -0.003 0.000 0.980 3 A HN 0.607 8.757 8.150 -0.000 0.000 0.506 4 K N 1.708 122.101 120.400 -0.012 0.000 2.156 4 K HA 0.390 4.710 4.320 0.000 0.000 0.250 4 K C -0.961 175.636 176.600 -0.006 0.000 0.955 4 K CA -0.727 55.546 56.287 -0.024 0.000 0.855 4 K CB 1.416 33.903 32.500 -0.021 0.000 1.101 4 K HN 0.727 8.977 8.250 -0.000 0.000 0.434 5 D N 1.509 121.898 120.400 -0.018 0.000 2.193 5 D HA 0.285 4.925 4.640 0.000 0.000 0.244 5 D C -1.156 175.223 176.300 0.132 0.000 1.064 5 D CA -0.507 53.530 54.000 0.062 0.000 0.845 5 D CB 1.291 42.120 40.800 0.048 0.000 1.148 5 D HN 0.247 8.617 8.370 -0.000 0.000 0.464 6 V N 1.240 121.224 119.914 0.117 0.000 2.531 6 V HA 0.649 4.769 4.120 0.000 0.000 0.301 6 V C -0.881 175.121 176.094 -0.153 0.000 1.034 6 V CA -0.643 61.646 62.300 -0.019 0.000 0.865 6 V CB 1.672 33.405 31.823 -0.150 0.000 0.995 6 V HN 0.377 8.567 8.190 -0.000 0.000 0.424 7 K N 4.528 124.733 120.400 -0.326 0.000 2.318 7 K HA 0.682 5.002 4.320 0.000 0.000 0.249 7 K C -1.721 174.556 176.600 -0.540 0.000 0.942 7 K CA -0.473 55.560 56.287 -0.423 0.000 0.808 7 K CB 2.517 34.606 32.500 -0.685 0.000 1.189 7 K HN 0.724 8.974 8.250 -0.000 0.000 0.428 8 F N 0.134 120.024 119.950 -0.099 0.000 2.522 8 F HA 0.382 4.909 4.527 0.000 0.000 0.324 8 F C 1.197 176.956 175.800 -0.069 0.000 1.077 8 F CA 0.256 58.219 58.000 -0.062 0.000 0.944 8 F CB 1.940 40.919 39.000 -0.036 0.000 1.175 8 F HN 0.861 9.161 8.300 -0.000 0.000 0.468 9 G N 2.526 111.426 108.800 0.165 0.000 2.591 9 G HA2 -0.495 3.465 3.960 0.000 0.000 0.298 9 G HA3 -0.495 3.465 3.960 0.000 0.000 0.298 9 G C 0.968 175.882 174.900 0.024 0.000 1.195 9 G CA 0.997 46.148 45.100 0.086 0.000 0.989 9 G HN 0.802 9.092 8.290 -0.000 0.000 0.551 10 N N 0.845 119.554 118.700 0.014 0.000 2.120 10 N HA -0.064 4.676 4.740 0.000 0.000 0.188 10 N C 1.758 177.247 175.510 -0.035 0.000 1.024 10 N CA 2.440 55.485 53.050 -0.008 0.000 0.852 10 N CB -0.291 38.193 38.487 -0.005 0.000 1.003 10 N HN 0.523 8.903 8.380 -0.000 0.000 0.424 11 D N 0.074 120.447 120.400 -0.045 0.000 2.092 11 D HA -0.123 4.517 4.640 0.000 0.000 0.193 11 D C 1.898 178.092 176.300 -0.176 0.000 0.994 11 D CA 1.587 55.527 54.000 -0.099 0.000 0.828 11 D CB -0.819 39.917 40.800 -0.106 0.000 0.963 11 D HN 0.435 8.805 8.370 -0.000 0.000 0.450 12 A N 0.686 123.386 122.820 -0.199 0.000 1.917 12 A HA -0.240 4.080 4.320 0.000 0.000 0.219 12 A C 2.188 179.685 177.584 -0.145 0.000 1.182 12 A CA 1.670 53.548 52.037 -0.264 0.000 0.633 12 A CB -0.453 18.425 19.000 -0.203 0.000 0.819 12 A HN 0.124 8.274 8.150 -0.000 0.000 0.448 13 R N -1.057 119.395 120.500 -0.080 0.000 2.062 13 R HA -0.014 4.326 4.340 0.000 0.000 0.229 13 R C 2.108 178.387 176.300 -0.034 0.000 1.128 13 R CA 1.227 57.303 56.100 -0.039 0.000 0.960 13 R CB -0.510 29.779 30.300 -0.019 0.000 0.855 13 R HN 0.374 8.644 8.270 -0.000 0.000 0.432 14 V N 2.067 121.957 119.914 -0.041 0.000 2.282 14 V HA -0.310 3.810 4.120 0.000 0.000 0.249 14 V C 2.226 178.305 176.094 -0.025 0.000 1.057 14 V CA 1.742 64.025 62.300 -0.029 0.000 1.032 14 V CB -0.397 31.408 31.823 -0.030 0.000 0.645 14 V HN 0.274 8.464 8.190 -0.000 0.000 0.447 15 K N -0.528 119.843 120.400 -0.048 0.000 2.026 15 K HA -0.149 4.171 4.320 0.000 0.000 0.208 15 K C 2.108 178.721 176.600 0.023 0.000 1.048 15 K CA 1.702 57.981 56.287 -0.014 0.000 0.929 15 K CB -0.623 31.848 32.500 -0.048 0.000 0.713 15 K HN 0.444 8.694 8.250 -0.000 0.000 0.439 16 M N 0.755 120.361 119.600 0.010 0.000 2.202 16 M HA -0.171 4.309 4.480 0.000 0.000 0.262 16 M C 2.027 178.342 176.300 0.024 0.000 1.063 16 M CA 1.201 56.520 55.300 0.032 0.000 1.097 16 M CB 0.004 32.617 32.600 0.022 0.000 1.382 16 M HN 0.080 8.370 8.290 -0.000 0.000 0.413 17 L N 0.247 121.478 121.223 0.013 0.000 2.068 17 L HA -0.077 4.263 4.340 0.000 0.000 0.204 17 L C 2.261 179.139 176.870 0.014 0.000 1.076 17 L CA 1.671 56.518 54.840 0.012 0.000 0.753 17 L CB -0.674 41.388 42.059 0.006 0.000 0.910 17 L HN 0.182 8.412 8.230 -0.000 0.000 0.439 18 R N -0.212 120.297 120.500 0.014 0.000 2.133 18 R HA -0.199 4.141 4.340 0.000 0.000 0.247 18 R C 2.111 178.424 176.300 0.022 0.000 1.151 18 R CA 1.377 57.488 56.100 0.017 0.000 0.971 18 R CB -1.114 29.197 30.300 0.019 0.000 0.866 18 R HN 0.634 8.904 8.270 -0.000 0.000 0.447 19 G N 0.539 109.356 108.800 0.029 0.000 2.484 19 G HA2 -0.244 3.716 3.960 0.000 0.000 0.215 19 G HA3 -0.244 3.716 3.960 0.000 0.000 0.215 19 G C 1.486 176.398 174.900 0.021 0.000 1.219 19 G CA 1.065 46.183 45.100 0.029 0.000 0.791 19 G HN 0.152 8.442 8.290 -0.000 0.000 0.550 20 V N 1.673 121.599 119.914 0.020 0.000 2.250 20 V HA -0.353 3.767 4.120 0.000 0.000 0.250 20 V C 2.523 178.625 176.094 0.014 0.000 1.060 20 V CA 2.435 64.745 62.300 0.017 0.000 1.030 20 V CB -1.096 30.737 31.823 0.017 0.000 0.643 20 V HN 0.487 8.677 8.190 -0.000 0.000 0.445 21 N N -0.074 118.634 118.700 0.013 0.000 2.037 21 N HA -0.204 4.536 4.740 0.000 0.000 0.196 21 N C 1.753 177.269 175.510 0.010 0.000 1.034 21 N CA 1.708 54.765 53.050 0.011 0.000 0.861 21 N CB -0.392 38.101 38.487 0.010 0.000 1.039 21 N HN 0.328 8.708 8.380 -0.000 0.000 0.427 22 V N 1.691 121.612 119.914 0.011 0.000 2.252 22 V HA -0.230 3.890 4.120 0.000 0.000 0.249 22 V C 2.253 178.352 176.094 0.008 0.000 1.056 22 V CA 1.433 63.739 62.300 0.009 0.000 1.022 22 V CB -0.729 31.100 31.823 0.010 0.000 0.641 22 V HN 0.379 8.569 8.190 -0.000 0.000 0.445 23 L N 0.925 122.153 121.223 0.009 0.000 1.970 23 L HA -0.153 4.187 4.340 0.000 0.000 0.212 23 L C 2.562 179.437 176.870 0.008 0.000 1.071 23 L CA 2.880 57.725 54.840 0.008 0.000 0.751 23 L CB -1.774 40.290 42.059 0.009 0.000 0.889 23 L HN 0.303 8.533 8.230 -0.000 0.000 0.432 24 A N 0.020 122.845 122.820 0.010 0.000 1.869 24 A HA -0.295 4.025 4.320 0.000 0.000 0.218 24 A C 1.918 179.507 177.584 0.008 0.000 1.203 24 A CA 2.249 54.292 52.037 0.010 0.000 0.638 24 A CB -1.121 17.886 19.000 0.011 0.000 0.831 24 A HN 0.609 8.759 8.150 -0.000 0.000 0.450 25 D N -0.059 120.345 120.400 0.007 0.000 2.190 25 D HA -0.080 4.560 4.640 0.000 0.000 0.200 25 D C 2.074 178.377 176.300 0.005 0.000 0.992 25 D CA 1.567 55.570 54.000 0.006 0.000 0.854 25 D CB -0.479 40.324 40.800 0.005 0.000 0.936 25 D HN 0.499 8.869 8.370 -0.000 0.000 0.462 26 A N 0.257 123.079 122.820 0.004 0.000 1.968 26 A HA -0.053 4.267 4.320 0.000 0.000 0.217 26 A C 2.427 180.013 177.584 0.003 0.000 1.169 26 A CA 0.834 52.873 52.037 0.003 0.000 0.638 26 A CB -0.296 18.705 19.000 0.002 0.000 0.812 26 A HN 0.165 8.315 8.150 -0.000 0.000 0.446 27 V N -0.245 119.671 119.914 0.005 0.000 2.446 27 V HA -0.142 3.978 4.120 0.000 0.000 0.244 27 V C 2.249 178.347 176.094 0.006 0.000 1.039 27 V CA 1.707 64.010 62.300 0.005 0.000 1.045 27 V CB -0.561 31.266 31.823 0.006 0.000 0.681 27 V HN 0.478 8.668 8.190 -0.000 0.000 0.459 28 K N 0.627 121.031 120.400 0.007 0.000 2.144 28 K HA -0.229 4.092 4.320 0.000 0.000 0.209 28 K C 1.995 178.598 176.600 0.006 0.000 1.047 28 K CA 1.998 58.290 56.287 0.007 0.000 0.927 28 K CB -0.521 31.983 32.500 0.007 0.000 0.716 28 K HN 0.584 8.834 8.250 -0.000 0.000 0.454 29 V N -0.975 118.941 119.914 0.004 0.000 3.078 29 V HA -0.128 3.992 4.120 0.000 0.000 0.265 29 V C 1.855 177.951 176.094 0.003 0.000 1.122 29 V CA 1.978 64.280 62.300 0.003 0.000 1.141 29 V CB -0.977 30.847 31.823 0.002 0.000 0.735 29 V HN 0.366 8.556 8.190 -0.000 0.000 0.498 30 T N -2.431 112.125 114.554 0.003 0.000 3.086 30 T HA 0.309 4.659 4.350 0.000 0.000 0.250 30 T C 0.458 175.161 174.700 0.004 0.000 1.074 30 T CA -0.146 61.956 62.100 0.003 0.000 0.988 30 T CB -0.072 68.797 68.868 0.001 0.000 0.988 30 T HN 0.374 8.614 8.240 -0.000 0.000 0.530 31 L N 2.683 123.910 121.223 0.007 0.000 2.410 31 L HA 0.577 4.917 4.340 0.000 0.000 0.273 31 L C 0.672 177.548 176.870 0.010 0.000 1.144 31 L CA 1.516 56.362 54.840 0.009 0.000 0.863 31 L CB -0.446 41.620 42.059 0.012 0.000 1.140 31 L HN 0.661 8.891 8.230 -0.000 0.000 0.463 32 G N 4.456 113.262 108.800 0.009 0.000 2.712 32 G HA2 -0.146 3.814 3.960 0.000 0.000 0.683 32 G HA3 -0.146 3.814 3.960 0.000 0.000 0.683 32 G C -2.220 172.682 174.900 0.003 0.000 1.320 32 G CA -0.322 44.784 45.100 0.009 0.000 0.847 32 G HN 0.532 8.822 8.290 -0.000 0.000 0.553 33 P HA 0.005 4.425 4.420 -0.000 0.000 0.221 33 P C 0.950 178.246 177.300 -0.007 0.000 1.150 33 P CA 1.274 64.368 63.100 -0.009 0.000 0.800 33 P CB 0.092 31.779 31.700 -0.022 0.000 0.787 34 K N 0.442 120.841 120.400 -0.000 0.000 2.577 34 K HA 0.249 4.569 4.320 0.000 0.000 0.210 34 K C 1.033 177.635 176.600 0.004 0.000 1.048 34 K CA -0.281 56.007 56.287 0.002 0.000 1.188 34 K CB 0.183 32.688 32.500 0.007 0.000 0.910 34 K HN 0.068 8.318 8.250 -0.000 0.000 0.483 35 G N 1.193 109.994 108.800 0.003 0.000 2.483 35 G HA2 0.133 4.093 3.960 0.000 0.000 0.248 35 G HA3 0.133 4.093 3.960 0.000 0.000 0.248 35 G C -0.070 174.830 174.900 0.000 0.000 1.248 35 G CA -0.390 44.711 45.100 0.003 0.000 0.838 35 G HN 0.214 8.504 8.290 -0.000 0.000 0.566 36 R N 0.441 120.942 120.500 0.000 0.000 2.843 36 R HA 0.363 4.704 4.340 0.000 0.000 0.232 36 R C -0.445 175.854 176.300 -0.002 0.000 1.305 36 R CA -1.002 55.097 56.100 -0.001 0.000 1.096 36 R CB 0.855 31.154 30.300 -0.001 0.000 1.455 36 R HN 0.454 8.724 8.270 -0.000 0.000 0.520 37 N N -0.244 118.454 118.700 -0.003 0.000 2.472 37 N HA 0.369 5.109 4.740 0.000 0.000 0.289 37 N C -0.993 174.515 175.510 -0.005 0.000 1.156 37 N CA -0.461 52.587 53.050 -0.004 0.000 0.940 37 N CB 1.832 40.316 38.487 -0.005 0.000 1.200 37 N HN 0.119 8.499 8.380 -0.000 0.000 0.511 38 V N 0.973 120.884 119.914 -0.005 0.000 2.555 38 V HA 0.388 4.508 4.120 0.000 0.000 0.302 38 V C -0.081 176.007 176.094 -0.009 0.000 1.038 38 V CA -0.854 61.442 62.300 -0.006 0.000 0.887 38 V CB 2.005 33.825 31.823 -0.005 0.000 0.991 38 V HN 0.293 8.483 8.190 -0.000 0.000 0.434 39 V N 5.902 125.808 119.914 -0.012 0.000 2.383 39 V HA 0.435 4.555 4.120 0.000 0.000 0.275 39 V C -0.205 175.876 176.094 -0.022 0.000 1.036 39 V CA -0.400 61.890 62.300 -0.017 0.000 0.889 39 V CB 1.224 33.035 31.823 -0.021 0.000 0.985 39 V HN 0.613 8.803 8.190 -0.000 0.000 0.459 40 L N 3.917 125.125 121.223 -0.024 0.000 2.294 40 L HA 0.483 4.823 4.340 0.000 0.000 0.283 40 L C 0.084 176.918 176.870 -0.059 0.000 1.015 40 L CA -0.566 54.256 54.840 -0.029 0.000 0.831 40 L CB 1.281 43.334 42.059 -0.010 0.000 1.217 40 L HN 0.515 8.745 8.230 -0.000 0.000 0.420 41 D N 3.438 123.788 120.400 -0.083 0.000 2.390 41 D HA 0.145 4.785 4.640 0.000 0.000 0.236 41 D C -0.391 175.756 176.300 -0.255 0.000 1.189 41 D CA 0.593 54.505 54.000 -0.145 0.000 0.887 41 D CB 0.745 41.464 40.800 -0.135 0.000 1.198 41 D HN 0.373 8.743 8.370 -0.000 0.000 0.444 42 K N 0.884 121.024 120.400 -0.433 0.000 2.707 42 K HA 0.120 4.440 4.320 0.000 0.000 0.283 42 K C 0.850 176.818 176.600 -1.054 0.000 1.105 42 K CA -0.284 55.403 56.287 -1.000 0.000 1.018 42 K CB 1.009 33.179 32.500 -0.550 0.000 1.315 42 K HN 0.335 8.585 8.250 -0.000 0.000 0.495 43 S N 2.570 117.595 115.700 -1.126 0.000 2.377 43 S HA -0.280 4.190 4.470 0.000 0.000 0.224 43 S C 1.565 176.021 174.600 -0.240 0.000 1.042 43 S CA 1.790 59.719 58.200 -0.451 0.000 1.086 43 S CB -0.793 62.318 63.200 -0.148 0.000 0.995 43 S HN 0.521 8.831 8.310 -0.000 0.000 0.428 44 F N 2.631 122.576 119.950 -0.008 0.000 2.442 44 F HA -0.191 4.336 4.527 0.000 0.000 0.279 44 F C 1.948 177.743 175.800 -0.007 0.000 1.191 44 F CA 0.739 58.734 58.000 -0.008 0.000 1.443 44 F CB -1.990 37.005 39.000 -0.009 0.000 0.833 44 F HN 0.568 8.868 8.300 -0.000 0.000 0.539 45 G N -1.377 107.497 108.800 0.122 0.000 3.135 45 G HA2 0.664 4.625 3.960 0.000 0.000 0.159 45 G HA3 0.664 4.625 3.960 0.000 0.000 0.159 45 G C -0.770 174.116 174.900 -0.023 0.000 1.244 45 G CA -0.331 44.800 45.100 0.051 0.000 0.965 45 G HN 0.655 8.945 8.290 -0.000 0.000 0.599 46 A N 0.017 122.829 122.820 -0.013 0.000 2.332 46 A HA 0.671 4.991 4.320 0.000 0.000 0.258 46 A C -1.972 175.584 177.584 -0.048 0.000 1.087 46 A CA -0.718 51.300 52.037 -0.032 0.000 0.802 46 A CB -0.277 18.714 19.000 -0.016 0.000 1.042 46 A HN 0.402 8.552 8.150 -0.000 0.000 0.489 47 P HA 0.193 4.613 4.420 -0.000 0.000 0.271 47 P C -0.224 177.057 177.300 -0.031 0.000 1.238 47 P CA 0.220 63.283 63.100 -0.061 0.000 0.794 47 P CB 0.369 32.035 31.700 -0.056 0.000 0.959 48 T N 1.072 115.611 114.554 -0.025 0.000 2.824 48 T HA 0.562 4.912 4.350 0.000 0.000 0.282 48 T C -0.138 174.556 174.700 -0.010 0.000 0.993 48 T CA -0.267 61.828 62.100 -0.008 0.000 0.967 48 T CB 0.195 69.066 68.868 0.004 0.000 0.960 48 T HN 0.094 8.334 8.240 -0.000 0.000 0.441 49 I N 2.527 123.093 120.570 -0.007 0.000 2.359 49 I HA 0.588 4.758 4.170 0.000 0.000 0.294 49 I C 0.475 176.590 176.117 -0.004 0.000 0.987 49 I CA -0.215 61.081 61.300 -0.007 0.000 1.225 49 I CB 1.961 39.957 38.000 -0.007 0.000 1.366 49 I HN 0.454 8.664 8.210 -0.000 0.000 0.466 50 T N 4.060 118.611 114.554 -0.004 0.000 2.982 50 T HA 0.278 4.629 4.350 0.000 0.000 0.321 50 T C 0.120 174.817 174.700 -0.004 0.000 1.229 50 T CA -0.616 61.482 62.100 -0.003 0.000 1.044 50 T CB 1.468 70.335 68.868 -0.002 0.000 1.184 50 T HN 0.709 8.949 8.240 -0.000 0.000 0.477 51 K N 1.666 122.063 120.400 -0.004 0.000 2.361 51 K HA 0.178 4.498 4.320 0.000 0.000 0.194 51 K C 0.038 176.635 176.600 -0.005 0.000 1.032 51 K CA -0.019 56.265 56.287 -0.004 0.000 1.048 51 K CB 0.296 32.794 32.500 -0.004 0.000 0.842 51 K HN 0.502 8.752 8.250 -0.000 0.000 0.526 52 D N -0.081 120.315 120.400 -0.007 0.000 2.344 52 D HA 0.075 4.715 4.640 0.000 0.000 0.253 52 D C 1.166 177.461 176.300 -0.009 0.000 1.255 52 D CA 0.091 54.084 54.000 -0.011 0.000 0.894 52 D CB 1.078 41.867 40.800 -0.018 0.000 1.067 52 D HN 0.243 8.613 8.370 -0.000 0.000 0.492 53 G N 2.850 111.646 108.800 -0.006 0.000 2.556 53 G HA2 -0.316 3.644 3.960 0.000 0.000 0.220 53 G HA3 -0.316 3.644 3.960 0.000 0.000 0.220 53 G C 1.533 176.431 174.900 -0.004 0.000 1.156 53 G CA 0.945 46.044 45.100 -0.002 0.000 0.766 53 G HN 0.511 8.801 8.290 -0.000 0.000 0.583 54 V N 0.312 120.220 119.914 -0.010 0.000 2.407 54 V HA -0.125 3.995 4.120 0.000 0.000 0.248 54 V C 2.912 179.001 176.094 -0.009 0.000 1.055 54 V CA 2.796 65.088 62.300 -0.012 0.000 1.049 54 V CB -0.322 31.488 31.823 -0.022 0.000 0.662 54 V HN 0.348 8.538 8.190 -0.000 0.000 0.455 55 S N -0.483 115.212 115.700 -0.008 0.000 2.368 55 S HA -0.144 4.326 4.470 0.000 0.000 0.224 55 S C 1.845 176.447 174.600 0.003 0.000 1.029 55 S CA 1.573 59.772 58.200 -0.002 0.000 0.988 55 S CB -0.097 63.102 63.200 -0.002 0.000 0.838 55 S HN 0.515 8.825 8.310 -0.000 0.000 0.462 56 V N 1.975 121.890 119.914 0.001 0.000 2.295 56 V HA -0.206 3.914 4.120 0.000 0.000 0.246 56 V C 2.625 178.721 176.094 0.003 0.000 1.049 56 V CA 1.736 64.037 62.300 0.002 0.000 1.024 56 V CB -1.249 30.575 31.823 0.001 0.000 0.648 56 V HN 0.529 8.719 8.190 -0.000 0.000 0.447 57 A N 0.384 123.205 122.820 0.001 0.000 1.865 57 A HA -0.250 4.070 4.320 0.000 0.000 0.217 57 A C 2.280 179.865 177.584 0.001 0.000 1.191 57 A CA 1.908 53.946 52.037 0.001 0.000 0.623 57 A CB -0.619 18.380 19.000 -0.002 0.000 0.826 57 A HN 0.514 8.664 8.150 -0.000 0.000 0.444 58 R N -0.303 120.197 120.500 0.001 0.000 2.316 58 R HA -0.110 4.230 4.340 0.000 0.000 0.232 58 R C 1.057 177.365 176.300 0.012 0.000 1.137 58 R CA 1.162 57.264 56.100 0.003 0.000 1.012 58 R CB -0.171 30.131 30.300 0.003 0.000 0.859 58 R HN 0.567 8.837 8.270 -0.000 0.000 0.474 59 E N 0.098 120.307 120.200 0.014 0.000 2.431 59 E HA 0.092 4.442 4.350 0.000 0.000 0.200 59 E C 0.470 177.078 176.600 0.014 0.000 0.995 59 E CA 0.070 56.482 56.400 0.021 0.000 0.915 59 E CB 0.474 30.187 29.700 0.021 0.000 0.930 59 E HN 0.126 8.486 8.360 -0.000 0.000 0.496 60 I N 2.097 122.672 120.570 0.008 0.000 2.471 60 I HA 0.158 4.328 4.170 0.000 0.000 0.286 60 I C 0.331 176.451 176.117 0.005 0.000 1.079 60 I CA 0.302 61.605 61.300 0.006 0.000 1.398 60 I CB 0.354 38.358 38.000 0.005 0.000 1.403 60 I HN -0.035 8.175 8.210 -0.000 0.000 0.530 61 E N 6.143 126.345 120.200 0.005 0.000 2.311 61 E HA 0.422 4.772 4.350 0.000 0.000 0.281 61 E C -1.797 174.803 176.600 0.000 0.000 0.905 61 E CA -0.638 55.763 56.400 0.001 0.000 0.778 61 E CB 1.832 31.534 29.700 0.002 0.000 1.240 61 E HN 0.246 8.606 8.360 -0.000 0.000 0.410 62 L N 2.904 124.127 121.223 -0.001 0.000 2.365 62 L HA 0.379 4.719 4.340 0.000 0.000 0.267 62 L C 1.433 178.300 176.870 -0.005 0.000 1.033 62 L CA 0.062 54.902 54.840 0.001 0.000 0.802 62 L CB 1.083 43.147 42.059 0.009 0.000 1.267 62 L HN 0.820 9.050 8.230 -0.000 0.000 0.457 63 E N -0.386 119.813 120.200 -0.002 0.000 2.075 63 E HA -0.092 4.258 4.350 0.000 0.000 0.190 63 E C -0.034 176.558 176.600 -0.013 0.000 0.969 63 E CA 0.025 56.420 56.400 -0.008 0.000 0.815 63 E CB 0.304 30.002 29.700 -0.004 0.000 0.776 63 E HN 0.656 9.016 8.360 -0.000 0.000 0.457 64 D N 1.242 121.644 120.400 0.005 0.000 2.434 64 D HA -0.078 4.563 4.640 0.000 0.000 0.252 64 D C 0.716 177.010 176.300 -0.011 0.000 1.185 64 D CA 0.231 54.242 54.000 0.019 0.000 0.886 64 D CB 0.951 41.789 40.800 0.063 0.000 1.148 64 D HN -0.028 8.342 8.370 -0.000 0.000 0.483 65 K N 3.445 123.784 120.400 -0.101 0.000 2.211 65 K HA -0.119 4.201 4.320 0.000 0.000 0.203 65 K C 1.708 178.173 176.600 -0.226 0.000 1.050 65 K CA 0.827 56.986 56.287 -0.213 0.000 0.945 65 K CB -0.105 32.179 32.500 -0.359 0.000 0.732 65 K HN 0.480 8.730 8.250 -0.000 0.000 0.451 66 F N 1.589 121.527 119.950 -0.020 0.000 2.149 66 F HA -0.035 4.492 4.527 0.000 0.000 0.294 66 F C 2.329 178.119 175.800 -0.017 0.000 1.095 66 F CA 0.919 58.905 58.000 -0.023 0.000 1.276 66 F CB -0.515 38.469 39.000 -0.026 0.000 1.023 66 F HN 0.052 8.352 8.300 -0.000 0.000 0.480 67 E N 0.083 120.392 120.200 0.182 0.000 2.097 67 E HA -0.298 4.052 4.350 0.000 0.000 0.196 67 E C 1.885 178.519 176.600 0.056 0.000 1.000 67 E CA 1.490 57.947 56.400 0.095 0.000 0.804 67 E CB -0.436 29.306 29.700 0.070 0.000 0.740 67 E HN 0.282 8.642 8.360 -0.000 0.000 0.454 68 N N 0.642 119.361 118.700 0.032 0.000 2.094 68 N HA -0.199 4.541 4.740 0.000 0.000 0.191 68 N C 1.727 177.243 175.510 0.010 0.000 1.023 68 N CA 1.470 54.524 53.050 0.007 0.000 0.857 68 N CB -0.065 38.410 38.487 -0.021 0.000 1.013 68 N HN 0.100 8.480 8.380 -0.000 0.000 0.426 69 M N -0.644 118.968 119.600 0.020 0.000 2.086 69 M HA -0.042 4.438 4.480 0.000 0.000 0.261 69 M C 2.121 178.440 176.300 0.031 0.000 1.067 69 M CA 1.667 56.981 55.300 0.023 0.000 1.116 69 M CB -0.674 31.953 32.600 0.045 0.000 1.348 69 M HN 0.334 8.624 8.290 -0.000 0.000 0.407 70 G N 0.071 108.899 108.800 0.046 0.000 2.631 70 G HA2 -0.328 3.632 3.960 0.000 0.000 0.219 70 G HA3 -0.328 3.632 3.960 0.000 0.000 0.219 70 G C 1.527 176.441 174.900 0.023 0.000 1.214 70 G CA 1.463 46.584 45.100 0.035 0.000 0.785 70 G HN 0.582 8.872 8.290 -0.000 0.000 0.596 71 A N -0.683 122.150 122.820 0.021 0.000 1.940 71 A HA -0.095 4.225 4.320 0.000 0.000 0.219 71 A C 2.365 179.954 177.584 0.008 0.000 1.176 71 A CA 2.115 54.159 52.037 0.013 0.000 0.631 71 A CB -0.363 18.644 19.000 0.012 0.000 0.814 71 A HN 0.369 8.519 8.150 -0.000 0.000 0.446 72 Q N -1.176 118.627 119.800 0.006 0.000 2.369 72 Q HA 0.019 4.359 4.340 0.000 0.000 0.206 72 Q C 1.928 177.928 176.000 -0.001 0.000 0.963 72 Q CA 1.013 56.816 55.803 -0.000 0.000 0.894 72 Q CB -0.203 28.532 28.738 -0.005 0.000 0.965 72 Q HN 0.792 9.062 8.270 -0.000 0.000 0.475 73 M N -0.732 118.871 119.600 0.005 0.000 2.398 73 M HA -0.087 4.393 4.480 0.000 0.000 0.261 73 M C 2.134 178.438 176.300 0.006 0.000 1.125 73 M CA 0.727 56.031 55.300 0.006 0.000 1.183 73 M CB 0.055 32.662 32.600 0.012 0.000 1.322 73 M HN 0.001 8.291 8.290 -0.000 0.000 0.467 74 V N -0.268 119.652 119.914 0.010 0.000 2.469 74 V HA -0.276 3.844 4.120 0.000 0.000 0.251 74 V C 2.090 178.187 176.094 0.005 0.000 1.064 74 V CA 1.987 64.294 62.300 0.012 0.000 1.066 74 V CB -1.450 30.382 31.823 0.015 0.000 0.667 74 V HN 0.518 8.708 8.190 -0.000 0.000 0.461 75 K N 0.616 121.016 120.400 0.000 0.000 2.286 75 K HA -0.286 4.034 4.320 0.000 0.000 0.203 75 K C 2.166 178.755 176.600 -0.019 0.000 1.045 75 K CA 2.008 58.291 56.287 -0.007 0.000 0.935 75 K CB -0.160 32.336 32.500 -0.007 0.000 0.737 75 K HN 0.696 8.946 8.250 -0.000 0.000 0.460 76 E N 0.302 120.489 120.200 -0.021 0.000 2.216 76 E HA -0.117 4.233 4.350 0.000 0.000 0.192 76 E C 1.908 178.469 176.600 -0.064 0.000 0.988 76 E CA 0.755 57.128 56.400 -0.044 0.000 0.834 76 E CB 0.164 29.840 29.700 -0.038 0.000 0.772 76 E HN 0.305 8.665 8.360 -0.000 0.000 0.479 77 V N 0.157 120.057 119.914 -0.024 0.000 2.261 77 V HA -0.169 3.951 4.120 0.000 0.000 0.246 77 V C 2.200 178.285 176.094 -0.016 0.000 1.047 77 V CA 2.103 64.403 62.300 0.001 0.000 1.015 77 V CB -0.556 31.303 31.823 0.059 0.000 0.642 77 V HN 0.267 8.457 8.190 -0.000 0.000 0.446 78 A N -0.359 122.457 122.820 -0.008 0.000 1.972 78 A HA -0.160 4.160 4.320 0.000 0.000 0.219 78 A C 2.574 180.138 177.584 -0.034 0.000 1.169 78 A CA 2.313 54.346 52.037 -0.006 0.000 0.635 78 A CB -1.019 17.980 19.000 -0.002 0.000 0.810 78 A HN 0.711 8.861 8.150 -0.000 0.000 0.446 79 S N -0.991 114.675 115.700 -0.056 0.000 2.357 79 S HA -0.120 4.351 4.470 0.000 0.000 0.221 79 S C 2.210 176.736 174.600 -0.123 0.000 1.031 79 S CA 1.426 59.583 58.200 -0.072 0.000 0.982 79 S CB -0.253 62.907 63.200 -0.065 0.000 0.853 79 S HN 0.426 8.736 8.310 -0.000 0.000 0.458 80 K N 1.369 121.637 120.400 -0.220 0.000 2.025 80 K HA 0.064 4.384 4.320 0.000 0.000 0.207 80 K C 2.345 178.706 176.600 -0.398 0.000 1.049 80 K CA 1.244 57.268 56.287 -0.438 0.000 0.933 80 K CB -1.089 30.921 32.500 -0.817 0.000 0.714 80 K HN 0.385 8.635 8.250 -0.000 0.000 0.438 81 A N 2.237 124.934 122.820 -0.205 0.000 1.896 81 A HA -0.297 4.023 4.320 0.000 0.000 0.220 81 A C 2.080 179.700 177.584 0.061 0.000 1.206 81 A CA 2.350 54.455 52.037 0.112 0.000 0.647 81 A CB -1.053 18.031 19.000 0.140 0.000 0.828 81 A HN 0.568 8.718 8.150 -0.000 0.000 0.455 82 N N -0.481 118.217 118.700 -0.003 0.000 2.149 82 N HA -0.190 4.550 4.740 0.000 0.000 0.188 82 N C 0.904 176.419 175.510 0.009 0.000 1.019 82 N CA 1.718 54.762 53.050 -0.010 0.000 0.857 82 N CB -0.277 38.188 38.487 -0.036 0.000 0.997 82 N HN 0.531 8.911 8.380 -0.000 0.000 0.426 83 D N 0.113 120.508 120.400 -0.008 0.000 2.224 83 D HA -0.034 4.606 4.640 0.000 0.000 0.205 83 D C 1.579 177.918 176.300 0.065 0.000 0.965 83 D CA 0.657 54.667 54.000 0.016 0.000 0.852 83 D CB 0.064 40.850 40.800 -0.024 0.000 0.947 83 D HN 0.391 8.761 8.370 -0.000 0.000 0.494 84 A N 1.116 123.989 122.820 0.089 0.000 1.884 84 A HA 0.364 4.684 4.320 0.000 0.000 0.212 84 A C 2.204 179.877 177.584 0.148 0.000 1.265 84 A CA 1.151 53.276 52.037 0.145 0.000 0.626 84 A CB -0.545 18.616 19.000 0.268 0.000 0.943 84 A HN 0.184 8.334 8.150 -0.000 0.000 0.466 85 A N -1.912 121.003 122.820 0.158 0.000 1.831 85 A HA 0.385 4.705 4.320 0.000 0.000 0.213 85 A C 2.071 179.758 177.584 0.171 0.000 1.223 85 A CA 2.133 54.253 52.037 0.139 0.000 0.604 85 A CB -0.973 18.099 19.000 0.120 0.000 0.878 85 A HN 1.933 10.083 8.150 -0.000 0.000 0.450 86 G N -2.103 106.767 108.800 0.116 0.000 2.211 86 G HA2 -0.073 3.887 3.960 0.000 0.000 0.201 86 G HA3 -0.073 3.887 3.960 0.000 0.000 0.201 86 G C -0.171 174.700 174.900 -0.048 0.000 0.997 86 G CA 0.575 45.679 45.100 0.006 0.000 0.652 86 G HN 0.811 9.101 8.290 -0.000 0.000 0.500 87 D N -1.996 118.417 120.400 0.021 0.000 2.692 87 D HA 0.557 5.197 4.640 0.000 0.000 0.303 87 D C 1.104 177.423 176.300 0.033 0.000 1.278 87 D CA 0.951 54.959 54.000 0.014 0.000 0.852 87 D CB 0.744 41.561 40.800 0.028 0.000 1.375 87 D HN 1.332 9.702 8.370 -0.000 0.000 0.453 88 G N -0.217 108.600 108.800 0.027 0.000 2.162 88 G HA2 -0.332 3.628 3.960 0.000 0.000 0.260 88 G HA3 -0.332 3.628 3.960 0.000 0.000 0.260 88 G C 1.017 175.941 174.900 0.040 0.000 0.976 88 G CA 1.838 46.960 45.100 0.036 0.000 0.655 88 G HN 0.790 9.080 8.290 -0.000 0.000 0.533 89 T N -2.403 112.169 114.554 0.030 0.000 2.720 89 T HA -0.129 4.221 4.350 0.000 0.000 0.268 89 T C 2.215 176.929 174.700 0.023 0.000 1.037 89 T CA 2.546 64.662 62.100 0.026 0.000 1.144 89 T CB -0.680 68.192 68.868 0.006 0.000 0.864 89 T HN 0.359 8.599 8.240 -0.000 0.000 0.444 90 T N 1.758 116.323 114.554 0.017 0.000 2.737 90 T HA -0.089 4.261 4.350 0.000 0.000 0.265 90 T C 2.264 176.977 174.700 0.022 0.000 1.038 90 T CA 1.792 63.901 62.100 0.016 0.000 1.144 90 T CB -1.001 67.874 68.868 0.012 0.000 0.866 90 T HN 0.489 8.729 8.240 -0.000 0.000 0.434 91 T N 2.123 116.692 114.554 0.025 0.000 2.607 91 T HA -0.143 4.207 4.350 0.000 0.000 0.267 91 T C 2.360 177.081 174.700 0.034 0.000 1.049 91 T CA 1.514 63.630 62.100 0.027 0.000 1.162 91 T CB -0.824 68.061 68.868 0.028 0.000 0.863 91 T HN 0.435 8.675 8.240 -0.000 0.000 0.424 92 A N 1.179 124.027 122.820 0.046 0.000 1.909 92 A HA -0.282 4.038 4.320 0.000 0.000 0.221 92 A C 2.539 180.153 177.584 0.049 0.000 1.223 92 A CA 2.857 54.932 52.037 0.062 0.000 0.658 92 A CB -1.595 17.460 19.000 0.092 0.000 0.831 92 A HN 0.537 8.687 8.150 -0.000 0.000 0.462 93 T N -0.554 114.022 114.554 0.037 0.000 2.720 93 T HA -0.113 4.237 4.350 0.000 0.000 0.268 93 T C 1.841 176.556 174.700 0.025 0.000 1.037 93 T CA 1.675 63.791 62.100 0.028 0.000 1.144 93 T CB -0.454 68.426 68.868 0.020 0.000 0.864 93 T HN 0.224 8.464 8.240 -0.000 0.000 0.444 94 V N 1.140 121.068 119.914 0.023 0.000 2.548 94 V HA -0.035 4.085 4.120 0.000 0.000 0.249 94 V C 2.399 178.505 176.094 0.020 0.000 1.055 94 V CA 1.134 63.445 62.300 0.019 0.000 1.065 94 V CB -0.678 31.155 31.823 0.017 0.000 0.681 94 V HN 0.409 8.599 8.190 -0.000 0.000 0.462 95 L N 0.228 121.466 121.223 0.024 0.000 2.027 95 L HA -0.110 4.230 4.340 0.000 0.000 0.206 95 L C 2.788 179.673 176.870 0.025 0.000 1.074 95 L CA 1.589 56.443 54.840 0.023 0.000 0.745 95 L CB -0.746 41.329 42.059 0.026 0.000 0.898 95 L HN 0.343 8.573 8.230 -0.000 0.000 0.433 96 A N 0.278 123.117 122.820 0.031 0.000 1.908 96 A HA -0.304 4.016 4.320 0.000 0.000 0.218 96 A C 2.178 179.776 177.584 0.024 0.000 1.181 96 A CA 2.052 54.107 52.037 0.031 0.000 0.627 96 A CB -0.669 18.353 19.000 0.037 0.000 0.818 96 A HN 0.589 8.739 8.150 -0.000 0.000 0.445 97 Q N -0.376 119.437 119.800 0.021 0.000 2.291 97 Q HA 0.126 4.466 4.340 0.000 0.000 0.205 97 Q C 1.714 177.722 176.000 0.015 0.000 0.970 97 Q CA 1.867 57.680 55.803 0.017 0.000 0.876 97 Q CB -0.390 28.357 28.738 0.015 0.000 0.935 97 Q HN 0.490 8.760 8.270 -0.000 0.000 0.455 98 A N 0.798 123.627 122.820 0.015 0.000 1.887 98 A HA 0.071 4.391 4.320 0.000 0.000 0.212 98 A C 2.075 179.667 177.584 0.013 0.000 1.198 98 A CA 0.866 52.911 52.037 0.013 0.000 0.628 98 A CB -0.496 18.511 19.000 0.013 0.000 0.847 98 A HN 0.411 8.561 8.150 -0.000 0.000 0.449 99 I N 0.058 120.637 120.570 0.015 0.000 2.118 99 I HA -0.329 3.841 4.170 0.000 0.000 0.241 99 I C 2.348 178.473 176.117 0.014 0.000 1.070 99 I CA 1.704 63.013 61.300 0.014 0.000 1.327 99 I CB -0.516 37.494 38.000 0.017 0.000 1.034 99 I HN 0.297 8.507 8.210 -0.000 0.000 0.405 100 I N 0.438 121.017 120.570 0.015 0.000 2.127 100 I HA -0.314 3.856 4.170 0.000 0.000 0.241 100 I C 2.610 178.734 176.117 0.011 0.000 1.075 100 I CA 1.914 63.222 61.300 0.014 0.000 1.334 100 I CB -0.660 37.350 38.000 0.015 0.000 1.040 100 I HN 0.270 8.480 8.210 -0.000 0.000 0.405 101 T N -0.158 114.402 114.554 0.010 0.000 2.720 101 T HA -0.171 4.179 4.350 0.000 0.000 0.268 101 T C 1.838 176.542 174.700 0.007 0.000 1.037 101 T CA 1.275 63.380 62.100 0.008 0.000 1.144 101 T CB -0.157 68.716 68.868 0.008 0.000 0.864 101 T HN 0.262 8.502 8.240 -0.000 0.000 0.444 102 E N 0.573 120.777 120.200 0.008 0.000 2.086 102 E HA 0.086 4.436 4.350 0.000 0.000 0.190 102 E C 2.530 179.135 176.600 0.007 0.000 0.975 102 E CA 0.870 57.274 56.400 0.007 0.000 0.813 102 E CB -0.990 28.715 29.700 0.007 0.000 0.768 102 E HN 0.493 8.853 8.360 -0.000 0.000 0.457 103 G N 2.078 110.883 108.800 0.009 0.000 2.672 103 G HA2 -0.291 3.669 3.960 0.000 0.000 0.218 103 G HA3 -0.291 3.669 3.960 0.000 0.000 0.218 103 G C 1.685 176.590 174.900 0.008 0.000 1.238 103 G CA 1.335 46.440 45.100 0.009 0.000 0.791 103 G HN 0.252 8.542 8.290 -0.000 0.000 0.606 104 L N 0.231 121.459 121.223 0.008 0.000 2.129 104 L HA -0.130 4.210 4.340 0.000 0.000 0.212 104 L C 2.843 179.716 176.870 0.005 0.000 1.087 104 L CA 1.615 56.459 54.840 0.006 0.000 0.757 104 L CB -0.398 41.664 42.059 0.005 0.000 0.896 104 L HN 0.253 8.483 8.230 -0.000 0.000 0.434 105 K N 0.205 120.608 120.400 0.005 0.000 2.148 105 K HA -0.151 4.169 4.320 0.000 0.000 0.204 105 K C 2.146 178.748 176.600 0.004 0.000 1.050 105 K CA 1.183 57.472 56.287 0.003 0.000 0.942 105 K CB 0.007 32.509 32.500 0.003 0.000 0.724 105 K HN 0.312 8.562 8.250 -0.000 0.000 0.446 106 A N 0.397 123.220 122.820 0.005 0.000 1.898 106 A HA -0.058 4.262 4.320 0.000 0.000 0.214 106 A C 2.139 179.726 177.584 0.005 0.000 1.183 106 A CA 0.987 53.026 52.037 0.005 0.000 0.622 106 A CB -0.407 18.596 19.000 0.005 0.000 0.824 106 A HN 0.123 8.273 8.150 -0.000 0.000 0.444 107 V N 0.068 119.986 119.914 0.006 0.000 2.392 107 V HA -0.261 3.859 4.120 0.000 0.000 0.249 107 V C 2.883 178.980 176.094 0.005 0.000 1.059 107 V CA 1.869 64.173 62.300 0.007 0.000 1.051 107 V CB -1.038 30.790 31.823 0.008 0.000 0.658 107 V HN 0.590 8.780 8.190 -0.000 0.000 0.455 108 A N -0.510 122.313 122.820 0.004 0.000 2.168 108 A HA 0.229 4.549 4.320 0.000 0.000 0.215 108 A C 2.120 179.705 177.584 0.002 0.000 1.152 108 A CA 1.218 53.257 52.037 0.003 0.000 0.716 108 A CB -0.345 18.656 19.000 0.001 0.000 0.794 108 A HN 0.554 8.704 8.150 -0.000 0.000 0.465 109 A N -1.894 120.928 122.820 0.003 0.000 2.275 109 A HA 0.444 4.764 4.320 0.000 0.000 0.212 109 A C 1.668 179.253 177.584 0.002 0.000 1.201 109 A CA 1.077 53.115 52.037 0.002 0.000 0.843 109 A CB -0.594 18.407 19.000 0.002 0.000 0.873 109 A HN 1.693 9.843 8.150 -0.000 0.000 0.492 110 G N -1.788 107.013 108.800 0.003 0.000 2.176 110 G HA2 -0.239 3.721 3.960 0.000 0.000 0.232 110 G HA3 -0.239 3.721 3.960 0.000 0.000 0.232 110 G C 0.209 175.111 174.900 0.004 0.000 0.986 110 G CA 0.265 45.366 45.100 0.003 0.000 0.643 110 G HN 0.352 8.642 8.290 -0.000 0.000 0.522 111 M N 0.909 120.512 119.600 0.004 0.000 2.250 111 M HA 0.295 4.775 4.480 0.000 0.000 0.325 111 M C 0.765 177.069 176.300 0.007 0.000 1.084 111 M CA -0.036 55.267 55.300 0.005 0.000 1.161 111 M CB 0.316 32.919 32.600 0.005 0.000 1.481 111 M HN 0.281 8.571 8.290 -0.000 0.000 0.449 112 N N 3.175 121.880 118.700 0.007 0.000 2.415 112 N HA 0.232 4.972 4.740 0.000 0.000 0.246 112 N C -2.287 173.228 175.510 0.010 0.000 1.078 112 N CA -1.874 51.181 53.050 0.008 0.000 0.942 112 N CB 0.868 39.359 38.487 0.008 0.000 1.140 112 N HN 0.206 8.586 8.380 -0.000 0.000 0.501 113 P HA -0.175 4.245 4.420 -0.000 0.000 0.216 113 P C 1.319 178.627 177.300 0.013 0.000 1.153 113 P CA 1.122 64.230 63.100 0.012 0.000 0.858 113 P CB 0.116 31.825 31.700 0.015 0.000 0.789 114 M N -0.800 118.808 119.600 0.013 0.000 2.358 114 M HA -0.128 4.352 4.480 0.000 0.000 0.264 114 M C 1.111 177.418 176.300 0.011 0.000 1.064 114 M CA 1.660 56.968 55.300 0.013 0.000 1.093 114 M CB -1.072 31.536 32.600 0.013 0.000 1.401 114 M HN -0.197 8.093 8.290 -0.000 0.000 0.440 115 D N -0.806 119.600 120.400 0.010 0.000 2.162 115 D HA 0.003 4.643 4.640 0.000 0.000 0.205 115 D C 2.053 178.358 176.300 0.008 0.000 0.964 115 D CA 0.916 54.921 54.000 0.008 0.000 0.847 115 D CB -0.156 40.648 40.800 0.007 0.000 0.988 115 D HN 0.329 8.699 8.370 -0.000 0.000 0.480 116 L N 0.955 122.184 121.223 0.009 0.000 2.043 116 L HA -0.217 4.123 4.340 0.000 0.000 0.212 116 L C 2.510 179.386 176.870 0.010 0.000 1.075 116 L CA 1.274 56.119 54.840 0.009 0.000 0.752 116 L CB -0.371 41.693 42.059 0.009 0.000 0.891 116 L HN 0.026 8.256 8.230 -0.000 0.000 0.432 117 K N 0.297 120.704 120.400 0.011 0.000 2.009 117 K HA -0.211 4.109 4.320 0.000 0.000 0.210 117 K C 2.300 178.907 176.600 0.011 0.000 1.049 117 K CA 1.473 57.767 56.287 0.012 0.000 0.929 117 K CB -0.045 32.463 32.500 0.014 0.000 0.714 117 K HN 0.188 8.438 8.250 -0.000 0.000 0.440 118 R N -0.302 120.203 120.500 0.010 0.000 2.105 118 R HA -0.125 4.215 4.340 0.000 0.000 0.239 118 R C 2.411 178.715 176.300 0.007 0.000 1.135 118 R CA 1.380 57.485 56.100 0.008 0.000 0.967 118 R CB -0.562 29.742 30.300 0.008 0.000 0.861 118 R HN 0.432 8.702 8.270 -0.000 0.000 0.442 119 G N 1.553 110.357 108.800 0.007 0.000 2.484 119 G HA2 -0.237 3.723 3.960 0.000 0.000 0.215 119 G HA3 -0.237 3.723 3.960 0.000 0.000 0.215 119 G C 1.475 176.379 174.900 0.006 0.000 1.219 119 G CA 0.607 45.710 45.100 0.006 0.000 0.791 119 G HN 0.136 8.426 8.290 -0.000 0.000 0.550 120 I N 1.306 121.880 120.570 0.007 0.000 2.121 120 I HA -0.283 3.887 4.170 0.000 0.000 0.243 120 I C 2.418 178.538 176.117 0.005 0.000 1.047 120 I CA 1.863 63.167 61.300 0.007 0.000 1.308 120 I CB -0.156 37.850 38.000 0.010 0.000 1.015 120 I HN 0.114 8.324 8.210 -0.000 0.000 0.410 121 D N 0.207 120.611 120.400 0.006 0.000 2.117 121 D HA -0.191 4.449 4.640 0.000 0.000 0.198 121 D C 2.094 178.394 176.300 0.001 0.000 0.982 121 D CA 1.116 55.118 54.000 0.005 0.000 0.828 121 D CB -0.264 40.540 40.800 0.007 0.000 0.967 121 D HN 0.325 8.695 8.370 -0.000 0.000 0.464 122 K N 0.738 121.140 120.400 0.002 0.000 2.026 122 K HA -0.110 4.210 4.320 0.000 0.000 0.208 122 K C 2.060 178.659 176.600 -0.001 0.000 1.048 122 K CA 1.247 57.535 56.287 0.001 0.000 0.929 122 K CB -0.048 32.453 32.500 0.002 0.000 0.713 122 K HN 0.006 8.256 8.250 -0.000 0.000 0.439 123 A N 0.657 123.478 122.820 0.000 0.000 1.908 123 A HA -0.149 4.171 4.320 0.000 0.000 0.218 123 A C 2.246 179.829 177.584 -0.003 0.000 1.181 123 A CA 1.825 53.862 52.037 -0.000 0.000 0.627 123 A CB -0.731 18.270 19.000 0.002 0.000 0.818 123 A HN 0.196 8.346 8.150 -0.000 0.000 0.445 124 V N -0.176 119.735 119.914 -0.005 0.000 2.358 124 V HA -0.216 3.904 4.120 0.000 0.000 0.246 124 V C 2.723 178.808 176.094 -0.015 0.000 1.047 124 V CA 2.412 64.706 62.300 -0.011 0.000 1.035 124 V CB -1.176 30.639 31.823 -0.013 0.000 0.658 124 V HN 0.646 8.836 8.190 -0.000 0.000 0.452 125 T N 0.306 114.853 114.554 -0.012 0.000 2.833 125 T HA -0.146 4.204 4.350 0.000 0.000 0.269 125 T C 1.964 176.658 174.700 -0.011 0.000 1.054 125 T CA 1.514 63.607 62.100 -0.013 0.000 1.135 125 T CB -0.314 68.549 68.868 -0.008 0.000 0.869 125 T HN 0.574 8.814 8.240 -0.000 0.000 0.466 126 A N 1.347 124.162 122.820 -0.007 0.000 1.874 126 A HA 0.412 4.732 4.320 0.000 0.000 0.214 126 A C 2.682 180.262 177.584 -0.006 0.000 1.189 126 A CA 1.323 53.357 52.037 -0.005 0.000 0.615 126 A CB -1.108 17.890 19.000 -0.003 0.000 0.830 126 A HN 0.468 8.618 8.150 -0.000 0.000 0.443 127 A N -0.317 122.499 122.820 -0.007 0.000 1.908 127 A HA -0.068 4.252 4.320 0.000 0.000 0.218 127 A C 2.220 179.797 177.584 -0.012 0.000 1.181 127 A CA 1.964 53.997 52.037 -0.007 0.000 0.627 127 A CB -0.998 17.998 19.000 -0.008 0.000 0.818 127 A HN 0.389 8.539 8.150 -0.000 0.000 0.445 128 V N -0.047 119.856 119.914 -0.018 0.000 2.343 128 V HA -0.214 3.906 4.120 0.000 0.000 0.247 128 V C 2.635 178.719 176.094 -0.016 0.000 1.051 128 V CA 2.193 64.479 62.300 -0.024 0.000 1.036 128 V CB -0.724 31.078 31.823 -0.035 0.000 0.654 128 V HN 0.483 8.673 8.190 -0.000 0.000 0.451 129 E N -0.069 120.124 120.200 -0.012 0.000 2.097 129 E HA -0.202 4.148 4.350 0.000 0.000 0.196 129 E C 2.326 178.923 176.600 -0.005 0.000 1.000 129 E CA 1.166 57.561 56.400 -0.008 0.000 0.804 129 E CB -0.302 29.395 29.700 -0.006 0.000 0.740 129 E HN 0.531 8.891 8.360 -0.000 0.000 0.454 130 E N 0.240 120.438 120.200 -0.004 0.000 2.072 130 E HA -0.100 4.250 4.350 0.000 0.000 0.191 130 E C 2.417 179.017 176.600 0.001 0.000 0.985 130 E CA 0.397 56.797 56.400 -0.000 0.000 0.801 130 E CB -0.288 29.413 29.700 0.001 0.000 0.750 130 E HN 0.286 8.646 8.360 -0.000 0.000 0.452 131 L N 0.573 121.795 121.223 -0.002 0.000 2.042 131 L HA -0.225 4.115 4.340 0.000 0.000 0.210 131 L C 2.435 179.304 176.870 -0.001 0.000 1.076 131 L CA 1.268 56.107 54.840 -0.001 0.000 0.749 131 L CB -0.328 41.727 42.059 -0.006 0.000 0.893 131 L HN 0.026 8.256 8.230 -0.000 0.000 0.432 132 K N -0.088 120.310 120.400 -0.004 0.000 2.160 132 K HA -0.174 4.146 4.320 0.000 0.000 0.206 132 K C 2.082 178.683 176.600 0.000 0.000 1.047 132 K CA 1.448 57.733 56.287 -0.003 0.000 0.930 132 K CB -0.315 32.183 32.500 -0.004 0.000 0.720 132 K HN 0.349 8.599 8.250 -0.000 0.000 0.450 133 A N -0.005 122.815 122.820 0.001 0.000 1.872 133 A HA -0.080 4.241 4.320 0.000 0.000 0.214 133 A C 1.987 179.575 177.584 0.006 0.000 1.187 133 A CA 1.043 53.082 52.037 0.003 0.000 0.614 133 A CB -0.515 18.487 19.000 0.003 0.000 0.826 133 A HN 0.167 8.317 8.150 -0.000 0.000 0.442 134 L N 0.431 121.658 121.223 0.007 0.000 2.131 134 L HA -0.030 4.310 4.340 0.000 0.000 0.210 134 L C 1.735 178.611 176.870 0.010 0.000 1.092 134 L CA 1.349 56.195 54.840 0.010 0.000 0.759 134 L CB -0.517 41.550 42.059 0.012 0.000 0.903 134 L HN 0.375 8.605 8.230 -0.000 0.000 0.435 135 S N -0.165 115.540 115.700 0.008 0.000 2.544 135 S HA 0.228 4.698 4.470 0.000 0.000 0.290 135 S C -0.173 174.432 174.600 0.008 0.000 1.276 135 S CA -0.442 57.762 58.200 0.008 0.000 1.075 135 S CB 0.094 63.297 63.200 0.005 0.000 0.849 135 S HN 0.150 8.460 8.310 -0.000 0.000 0.494 136 V N 3.325 123.244 119.914 0.009 0.000 2.581 136 V HA 0.728 4.848 4.120 0.000 0.000 0.303 136 V C -2.609 173.489 176.094 0.007 0.000 1.041 136 V CA -2.687 59.617 62.300 0.008 0.000 0.907 136 V CB 0.780 32.609 31.823 0.010 0.000 0.994 136 V HN 0.691 8.881 8.190 -0.000 0.000 0.442 137 P HA 0.182 4.602 4.420 -0.000 0.000 0.270 137 P C -0.611 176.693 177.300 0.006 0.000 1.221 137 P CA -0.051 63.053 63.100 0.005 0.000 0.788 137 P CB 0.332 32.034 31.700 0.004 0.000 0.904 138 C N 1.786 121.089 119.300 0.006 0.000 2.660 138 C HA 0.558 5.018 4.460 0.000 0.000 0.336 138 C C 0.955 175.947 174.990 0.005 0.000 1.058 138 C CA 0.571 59.592 59.018 0.006 0.000 1.368 138 C CB -0.695 27.050 27.740 0.007 0.000 1.884 138 C HN 0.696 8.926 8.230 -0.000 0.000 0.454 139 S N 2.268 117.971 115.700 0.004 0.000 2.882 139 S HA 0.201 4.671 4.470 0.000 0.000 0.258 139 S C -0.005 174.596 174.600 0.003 0.000 1.081 139 S CA 0.251 58.453 58.200 0.003 0.000 0.886 139 S CB -0.358 62.844 63.200 0.002 0.000 0.855 139 S HN 0.863 9.173 8.310 -0.000 0.000 0.467 140 D N 2.383 122.785 120.400 0.003 0.000 2.414 140 D HA 0.265 4.905 4.640 0.000 0.000 0.242 140 D C 0.691 176.992 176.300 0.003 0.000 1.129 140 D CA 0.038 54.039 54.000 0.003 0.000 0.885 140 D CB 1.220 42.022 40.800 0.003 0.000 1.198 140 D HN 0.101 8.471 8.370 -0.000 0.000 0.437 141 S N 1.545 117.246 115.700 0.002 0.000 2.392 141 S HA -0.272 4.198 4.470 0.000 0.000 0.232 141 S C 1.608 176.209 174.600 0.003 0.000 1.041 141 S CA 1.773 59.974 58.200 0.002 0.000 1.026 141 S CB -0.262 62.939 63.200 0.002 0.000 0.845 141 S HN 0.701 9.011 8.310 -0.000 0.000 0.465 142 K N 1.058 121.459 120.400 0.003 0.000 2.026 142 K HA -0.073 4.247 4.320 0.000 0.000 0.208 142 K C 2.224 178.826 176.600 0.003 0.000 1.048 142 K CA 1.255 57.544 56.287 0.003 0.000 0.929 142 K CB -0.375 32.127 32.500 0.002 0.000 0.713 142 K HN 0.301 8.551 8.250 -0.000 0.000 0.439 143 A N 1.193 124.016 122.820 0.004 0.000 1.902 143 A HA -0.128 4.192 4.320 0.000 0.000 0.217 143 A C 2.117 179.705 177.584 0.006 0.000 1.181 143 A CA 1.474 53.514 52.037 0.005 0.000 0.623 143 A CB -0.567 18.436 19.000 0.006 0.000 0.818 143 A HN 0.367 8.517 8.150 -0.000 0.000 0.443 144 I N -0.257 120.317 120.570 0.006 0.000 2.179 144 I HA -0.297 3.873 4.170 0.000 0.000 0.242 144 I C 2.967 179.089 176.117 0.008 0.000 1.088 144 I CA 1.105 62.409 61.300 0.007 0.000 1.357 144 I CB -0.270 37.733 38.000 0.006 0.000 1.051 144 I HN 0.361 8.571 8.210 -0.000 0.000 0.409 145 A N -0.189 122.635 122.820 0.006 0.000 1.978 145 A HA -0.290 4.030 4.320 0.000 0.000 0.220 145 A C 2.212 179.799 177.584 0.005 0.000 1.170 145 A CA 1.748 53.789 52.037 0.005 0.000 0.636 145 A CB -0.584 18.418 19.000 0.003 0.000 0.810 145 A HN 0.500 8.650 8.150 -0.000 0.000 0.448 146 Q N -0.691 119.111 119.800 0.004 0.000 2.046 146 Q HA -0.099 4.241 4.340 0.000 0.000 0.200 146 Q C 2.312 178.315 176.000 0.005 0.000 0.975 146 Q CA 1.833 57.637 55.803 0.003 0.000 0.836 146 Q CB -0.451 28.288 28.738 0.002 0.000 0.896 146 Q HN 0.749 9.019 8.270 -0.000 0.000 0.428 147 V N -1.260 118.660 119.914 0.009 0.000 2.295 147 V HA -0.130 3.990 4.120 0.000 0.000 0.246 147 V C 1.972 178.074 176.094 0.015 0.000 1.049 147 V CA 2.285 64.593 62.300 0.012 0.000 1.024 147 V CB -1.501 30.332 31.823 0.016 0.000 0.648 147 V HN 0.376 8.566 8.190 -0.000 0.000 0.447 148 G N -0.143 108.666 108.800 0.015 0.000 2.513 148 G HA2 -0.309 3.651 3.960 0.000 0.000 0.219 148 G HA3 -0.309 3.651 3.960 0.000 0.000 0.219 148 G C 1.614 176.521 174.900 0.012 0.000 1.160 148 G CA 1.892 47.002 45.100 0.017 0.000 0.767 148 G HN 0.529 8.819 8.290 -0.000 0.000 0.571 149 T N 0.887 115.445 114.554 0.007 0.000 2.746 149 T HA -0.062 4.288 4.350 0.000 0.000 0.267 149 T C 2.389 177.089 174.700 0.001 0.000 1.039 149 T CA 1.106 63.207 62.100 0.003 0.000 1.142 149 T CB -0.129 68.739 68.868 -0.001 0.000 0.866 149 T HN 0.156 8.396 8.240 -0.000 0.000 0.444 150 I N 0.659 121.230 120.570 0.001 0.000 2.353 150 I HA -0.068 4.102 4.170 0.000 0.000 0.248 150 I C 2.624 178.743 176.117 0.003 0.000 1.119 150 I CA 0.764 62.063 61.300 -0.001 0.000 1.417 150 I CB -0.388 37.611 38.000 -0.001 0.000 1.078 150 I HN 0.132 8.342 8.210 -0.000 0.000 0.421 151 S N 0.254 115.959 115.700 0.009 0.000 2.370 151 S HA -0.098 4.372 4.470 0.000 0.000 0.226 151 S C 1.819 176.424 174.600 0.009 0.000 1.033 151 S CA 1.274 59.482 58.200 0.013 0.000 1.011 151 S CB -0.268 62.945 63.200 0.022 0.000 0.852 151 S HN 0.438 8.748 8.310 -0.000 0.000 0.457 152 A N 1.075 123.900 122.820 0.008 0.000 2.648 152 A HA 0.345 4.665 4.320 0.000 0.000 0.269 152 A C 0.536 178.121 177.584 0.001 0.000 1.392 152 A CA -0.061 51.979 52.037 0.005 0.000 1.019 152 A CB -1.283 17.721 19.000 0.007 0.000 1.009 152 A HN 0.755 8.905 8.150 -0.000 0.000 0.565 153 N N 0.275 118.974 118.700 -0.001 0.000 2.705 153 N HA -0.221 4.519 4.740 0.000 0.000 0.255 153 N C -0.101 175.405 175.510 -0.007 0.000 1.008 153 N CA 0.448 53.495 53.050 -0.004 0.000 0.742 153 N CB -0.834 37.650 38.487 -0.004 0.000 0.906 153 N HN 0.460 8.840 8.380 -0.000 0.000 0.541 154 S N -0.464 115.231 115.700 -0.008 0.000 3.812 154 S HA -0.194 4.276 4.470 0.000 0.000 0.341 154 S C -0.629 173.965 174.600 -0.010 0.000 1.057 154 S CA 0.911 59.103 58.200 -0.012 0.000 1.015 154 S CB -0.668 62.521 63.200 -0.019 0.000 0.893 154 S HN 0.670 8.980 8.310 -0.000 0.000 0.476 155 D N 0.983 121.380 120.400 -0.005 0.000 2.473 155 D HA 0.282 4.922 4.640 0.000 0.000 0.226 155 D C 1.093 177.392 176.300 -0.002 0.000 1.089 155 D CA -0.443 53.555 54.000 -0.004 0.000 0.883 155 D CB 0.587 41.386 40.800 -0.001 0.000 1.029 155 D HN 0.398 8.768 8.370 -0.000 0.000 0.517 156 E N 0.988 121.186 120.200 -0.004 0.000 2.160 156 E HA -0.143 4.207 4.350 0.000 0.000 0.195 156 E C 1.190 177.790 176.600 -0.001 0.000 0.991 156 E CA 1.253 57.651 56.400 -0.003 0.000 0.810 156 E CB 0.404 30.101 29.700 -0.005 0.000 0.742 156 E HN 0.496 8.856 8.360 -0.000 0.000 0.466 157 T N 0.332 114.885 114.554 -0.000 0.000 2.821 157 T HA -0.088 4.262 4.350 0.000 0.000 0.267 157 T C 2.118 176.820 174.700 0.003 0.000 1.046 157 T CA 0.895 62.995 62.100 0.001 0.000 1.139 157 T CB -0.124 68.745 68.868 0.001 0.000 0.871 157 T HN -0.005 8.235 8.240 -0.000 0.000 0.454 158 V N 1.670 121.586 119.914 0.004 0.000 2.358 158 V HA -0.029 4.091 4.120 0.000 0.000 0.246 158 V C 2.897 178.997 176.094 0.009 0.000 1.047 158 V CA 1.776 64.081 62.300 0.008 0.000 1.035 158 V CB -1.534 30.295 31.823 0.009 0.000 0.658 158 V HN 0.563 8.753 8.190 -0.000 0.000 0.452 159 G N 0.378 109.183 108.800 0.007 0.000 2.545 159 G HA2 -0.381 3.579 3.960 0.000 0.000 0.217 159 G HA3 -0.381 3.579 3.960 0.000 0.000 0.217 159 G C 1.559 176.463 174.900 0.006 0.000 1.218 159 G CA 1.423 46.527 45.100 0.007 0.000 0.787 159 G HN 0.457 8.747 8.290 -0.000 0.000 0.571 160 K N -0.176 120.227 120.400 0.004 0.000 2.089 160 K HA -0.115 4.205 4.320 0.000 0.000 0.210 160 K C 2.332 178.934 176.600 0.004 0.000 1.048 160 K CA 1.183 57.472 56.287 0.003 0.000 0.926 160 K CB -0.682 31.819 32.500 0.001 0.000 0.714 160 K HN 0.250 8.500 8.250 -0.000 0.000 0.448 161 L N 0.393 121.619 121.223 0.005 0.000 2.056 161 L HA 0.037 4.377 4.340 0.000 0.000 0.207 161 L C 2.083 178.957 176.870 0.007 0.000 1.078 161 L CA 1.532 56.376 54.840 0.006 0.000 0.749 161 L CB -0.451 41.612 42.059 0.007 0.000 0.901 161 L HN 0.274 8.504 8.230 -0.000 0.000 0.433 162 I N -1.063 119.513 120.570 0.009 0.000 2.286 162 I HA -0.224 3.946 4.170 0.000 0.000 0.245 162 I C 2.525 178.646 176.117 0.007 0.000 1.104 162 I CA 1.025 62.331 61.300 0.010 0.000 1.397 162 I CB -0.453 37.556 38.000 0.015 0.000 1.072 162 I HN 0.244 8.454 8.210 -0.000 0.000 0.417 163 A N 0.271 123.095 122.820 0.006 0.000 1.883 163 A HA -0.277 4.043 4.320 0.000 0.000 0.217 163 A C 2.239 179.825 177.584 0.003 0.000 1.186 163 A CA 1.942 53.982 52.037 0.005 0.000 0.624 163 A CB -0.682 18.321 19.000 0.004 0.000 0.822 163 A HN 0.436 8.586 8.150 -0.000 0.000 0.444 164 E N -0.583 119.619 120.200 0.003 0.000 2.110 164 E HA -0.118 4.232 4.350 0.000 0.000 0.193 164 E C 2.314 178.915 176.600 0.002 0.000 0.988 164 E CA 0.820 57.221 56.400 0.002 0.000 0.804 164 E CB -0.244 29.457 29.700 0.002 0.000 0.745 164 E HN 0.639 8.999 8.360 -0.000 0.000 0.458 165 A N 1.099 123.920 122.820 0.003 0.000 1.845 165 A HA -0.212 4.108 4.320 0.000 0.000 0.215 165 A C 2.164 179.749 177.584 0.001 0.000 1.195 165 A CA 1.542 53.581 52.037 0.002 0.000 0.616 165 A CB -0.548 18.455 19.000 0.004 0.000 0.832 165 A HN 0.145 8.295 8.150 -0.000 0.000 0.443 166 M N -0.843 118.757 119.600 0.001 0.000 2.149 166 M HA -0.203 4.277 4.480 0.000 0.000 0.261 166 M C 1.844 178.143 176.300 -0.001 0.000 1.064 166 M CA 2.036 57.335 55.300 -0.001 0.000 1.102 166 M CB -0.664 31.936 32.600 -0.001 0.000 1.369 166 M HN 0.543 8.833 8.290 -0.000 0.000 0.408 167 D N 0.344 120.744 120.400 -0.000 0.000 2.149 167 D HA -0.159 4.481 4.640 0.000 0.000 0.198 167 D C 1.906 178.205 176.300 -0.001 0.000 0.990 167 D CA 1.405 55.405 54.000 -0.000 0.000 0.839 167 D CB 0.226 41.026 40.800 0.000 0.000 0.948 167 D HN 0.167 8.537 8.370 -0.000 0.000 0.460 168 K N -0.942 119.458 120.400 -0.001 0.000 2.202 168 K HA 0.052 4.372 4.320 0.000 0.000 0.201 168 K C 1.926 178.525 176.600 -0.001 0.000 1.051 168 K CA 0.688 56.974 56.287 -0.001 0.000 0.977 168 K CB 0.425 32.925 32.500 -0.001 0.000 0.792 168 K HN 0.126 8.376 8.250 -0.000 0.000 0.469 169 V N -2.727 117.186 119.914 -0.001 0.000 2.788 169 V HA 0.319 4.439 4.120 0.000 0.000 0.251 169 V C 1.020 177.112 176.094 -0.003 0.000 1.068 169 V CA 0.656 62.955 62.300 -0.002 0.000 1.090 169 V CB -0.789 31.032 31.823 -0.002 0.000 0.710 169 V HN 0.354 8.544 8.190 -0.000 0.000 0.467 170 G N 0.380 109.178 108.800 -0.003 0.000 2.500 170 G HA2 -0.180 3.780 3.960 0.000 0.000 0.209 170 G HA3 -0.180 3.780 3.960 0.000 0.000 0.209 170 G C 0.154 175.051 174.900 -0.006 0.000 1.283 170 G CA 0.180 45.278 45.100 -0.004 0.000 0.960 170 G HN 0.283 8.573 8.290 -0.000 0.000 0.528 171 K N 0.085 120.481 120.400 -0.006 0.000 2.202 171 K HA 0.154 4.474 4.320 0.000 0.000 0.201 171 K C 1.570 178.164 176.600 -0.010 0.000 1.051 171 K CA 0.951 57.233 56.287 -0.008 0.000 0.977 171 K CB 0.098 32.594 32.500 -0.007 0.000 0.792 171 K HN 0.446 8.696 8.250 -0.000 0.000 0.469 172 E N 1.006 121.200 120.200 -0.010 0.000 2.320 172 E HA 0.062 4.412 4.350 0.000 0.000 0.189 172 E C 0.017 176.610 176.600 -0.012 0.000 1.100 172 E CA -0.139 56.254 56.400 -0.012 0.000 1.009 172 E CB 0.645 30.338 29.700 -0.011 0.000 1.145 172 E HN 0.199 8.559 8.360 -0.000 0.000 0.454 173 G N 0.262 109.056 108.800 -0.011 0.000 2.453 173 G HA2 0.449 4.409 3.960 0.000 0.000 0.323 173 G HA3 0.449 4.409 3.960 0.000 0.000 0.323 173 G C -0.409 174.485 174.900 -0.011 0.000 1.198 173 G CA -0.455 44.640 45.100 -0.009 0.000 0.959 173 G HN -0.024 8.266 8.290 -0.000 0.000 0.482 174 V N 1.018 120.928 119.914 -0.008 0.000 2.532 174 V HA 0.544 4.664 4.120 0.000 0.000 0.295 174 V C -0.153 175.939 176.094 -0.004 0.000 1.041 174 V CA -0.553 61.742 62.300 -0.009 0.000 0.926 174 V CB 1.441 33.261 31.823 -0.005 0.000 0.992 174 V HN 0.575 8.765 8.190 -0.000 0.000 0.457 175 I N 3.439 124.005 120.570 -0.006 0.000 2.447 175 I HA 0.487 4.657 4.170 0.000 0.000 0.287 175 I C 0.151 176.273 176.117 0.008 0.000 1.023 175 I CA -0.113 61.188 61.300 0.002 0.000 1.083 175 I CB 2.227 40.228 38.000 0.000 0.000 1.245 175 I HN 0.785 8.995 8.210 -0.000 0.000 0.434 176 T N 2.843 117.407 114.554 0.016 0.000 2.950 176 T HA 0.731 5.081 4.350 0.000 0.000 0.288 176 T C -0.599 174.118 174.700 0.027 0.000 1.035 176 T CA -0.943 61.172 62.100 0.025 0.000 1.028 176 T CB 2.433 71.318 68.868 0.027 0.000 1.109 176 T HN 0.321 8.561 8.240 -0.000 0.000 0.514 177 V N 1.131 121.065 119.914 0.034 0.000 2.577 177 V HA 0.703 4.823 4.120 0.000 0.000 0.303 177 V C -1.449 174.662 176.094 0.028 0.000 1.042 177 V CA -0.527 61.791 62.300 0.031 0.000 0.872 177 V CB 1.348 33.194 31.823 0.038 0.000 0.998 177 V HN 1.113 9.303 8.190 -0.000 0.000 0.423 178 E N 3.645 123.857 120.200 0.021 0.000 2.445 178 E HA 0.542 4.892 4.350 0.000 0.000 0.273 178 E C -1.695 174.913 176.600 0.014 0.000 0.961 178 E CA -1.135 55.276 56.400 0.018 0.000 0.807 178 E CB 1.200 30.910 29.700 0.016 0.000 1.362 178 E HN 0.588 8.948 8.360 -0.000 0.000 0.453 179 D N 0.881 121.288 120.400 0.012 0.000 2.425 179 D HA 0.248 4.889 4.640 0.000 0.000 0.247 179 D C 0.128 176.432 176.300 0.007 0.000 1.147 179 D CA 0.274 54.279 54.000 0.009 0.000 0.879 179 D CB 1.047 41.852 40.800 0.008 0.000 1.179 179 D HN 0.526 8.896 8.370 -0.000 0.000 0.456 180 G N 0.082 108.886 108.800 0.006 0.000 2.502 180 G HA2 0.357 4.317 3.960 0.000 0.000 0.305 180 G HA3 0.357 4.317 3.960 0.000 0.000 0.305 180 G C 1.075 175.977 174.900 0.003 0.000 1.190 180 G CA -0.265 44.837 45.100 0.004 0.000 0.933 180 G HN 0.418 8.708 8.290 -0.000 0.000 0.503 181 T N -1.544 113.011 114.554 0.001 0.000 2.901 181 T HA 0.215 4.565 4.350 0.000 0.000 0.252 181 T C 1.607 176.308 174.700 0.001 0.000 1.035 181 T CA 0.915 63.015 62.100 0.001 0.000 1.142 181 T CB -0.512 68.356 68.868 -0.001 0.000 0.869 181 T HN 0.725 8.965 8.240 -0.000 0.000 0.442 182 G N 0.644 109.444 108.800 0.000 0.000 2.489 182 G HA2 0.473 4.433 3.960 0.000 0.000 0.271 182 G HA3 0.473 4.433 3.960 0.000 0.000 0.271 182 G C 0.564 175.465 174.900 0.001 0.000 1.427 182 G CA -0.566 44.534 45.100 0.000 0.000 1.057 182 G HN 0.324 8.614 8.290 -0.000 0.000 0.532 183 L N -0.745 120.478 121.223 0.000 0.000 2.416 183 L HA 0.134 4.474 4.340 0.000 0.000 0.216 183 L C 0.561 177.431 176.870 0.000 0.000 1.098 183 L CA 0.669 55.509 54.840 0.000 0.000 0.840 183 L CB -0.177 41.882 42.059 -0.000 0.000 0.981 183 L HN 0.516 8.746 8.230 -0.000 0.000 0.462 184 Q N -0.580 119.220 119.800 0.000 0.000 2.257 184 Q HA 0.316 4.656 4.340 0.000 0.000 0.262 184 Q C -0.694 175.306 176.000 0.001 0.000 0.997 184 Q CA -0.724 55.080 55.803 0.001 0.000 0.873 184 Q CB 0.854 29.592 28.738 0.000 0.000 1.312 184 Q HN -0.016 8.254 8.270 -0.000 0.000 0.450 185 D N 1.040 121.442 120.400 0.002 0.000 2.382 185 D HA 0.114 4.754 4.640 0.000 0.000 0.240 185 D C -0.524 175.778 176.300 0.003 0.000 1.146 185 D CA 0.178 54.180 54.000 0.003 0.000 0.897 185 D CB 0.963 41.766 40.800 0.004 0.000 1.197 185 D HN 0.580 8.950 8.370 -0.000 0.000 0.432 186 E N 0.642 120.844 120.200 0.003 0.000 2.304 186 E HA 0.315 4.665 4.350 0.000 0.000 0.277 186 E C -1.876 174.726 176.600 0.003 0.000 0.898 186 E CA -0.758 55.643 56.400 0.002 0.000 0.764 186 E CB 1.805 31.506 29.700 0.001 0.000 1.216 186 E HN 0.166 8.526 8.360 -0.000 0.000 0.419 187 L N 4.104 125.328 121.223 0.002 0.000 2.296 187 L HA 0.510 4.850 4.340 0.000 0.000 0.286 187 L C -1.353 175.518 176.870 0.000 0.000 1.023 187 L CA -0.120 54.722 54.840 0.002 0.000 0.812 187 L CB 1.338 43.398 42.059 0.002 0.000 1.223 187 L HN 0.427 8.657 8.230 -0.000 0.000 0.421 188 D N 4.416 124.816 120.400 0.001 0.000 2.391 188 D HA 0.445 5.085 4.640 0.000 0.000 0.245 188 D C -1.028 175.271 176.300 -0.001 0.000 1.069 188 D CA -0.055 53.944 54.000 -0.002 0.000 0.831 188 D CB 2.524 43.322 40.800 -0.003 0.000 1.204 188 D HN 0.272 8.642 8.370 -0.000 0.000 0.503 189 V N 2.533 122.446 119.914 -0.002 0.000 2.448 189 V HA 0.299 4.419 4.120 0.000 0.000 0.295 189 V C 0.064 176.155 176.094 -0.004 0.000 1.025 189 V CA -0.821 61.478 62.300 -0.002 0.000 0.859 189 V CB 2.028 33.850 31.823 -0.001 0.000 0.988 189 V HN 0.267 8.457 8.190 -0.000 0.000 0.431 190 V N 4.452 124.364 119.914 -0.002 0.000 2.370 190 V HA 0.430 4.550 4.120 0.000 0.000 0.279 190 V C 0.169 176.263 176.094 -0.000 0.000 1.029 190 V CA -0.699 61.598 62.300 -0.004 0.000 0.870 190 V CB 1.310 33.130 31.823 -0.005 0.000 0.984 190 V HN 0.786 8.976 8.190 -0.000 0.000 0.451 191 E N 2.819 123.018 120.200 -0.001 0.000 2.313 191 E HA 0.563 4.913 4.350 0.000 0.000 0.272 191 E C 0.842 177.445 176.600 0.006 0.000 1.038 191 E CA 0.784 57.185 56.400 0.001 0.000 0.863 191 E CB 1.797 31.496 29.700 -0.001 0.000 1.060 191 E HN 0.956 9.316 8.360 -0.000 0.000 0.402 192 G N 2.477 111.283 108.800 0.009 0.000 2.547 192 G HA2 -0.317 3.643 3.960 0.000 0.000 0.271 192 G HA3 -0.317 3.643 3.960 0.000 0.000 0.271 192 G C -0.134 174.782 174.900 0.026 0.000 1.209 192 G CA 0.308 45.417 45.100 0.016 0.000 0.959 192 G HN 0.530 8.820 8.290 -0.000 0.000 0.563 193 M N 1.010 120.636 119.600 0.043 0.000 2.364 193 M HA 0.673 5.153 4.480 0.000 0.000 0.334 193 M C -0.396 175.965 176.300 0.101 0.000 1.107 193 M CA -0.561 54.783 55.300 0.073 0.000 0.988 193 M CB 1.552 34.203 32.600 0.084 0.000 1.673 193 M HN 0.899 9.189 8.290 -0.000 0.000 0.441 194 Q N 4.594 124.463 119.800 0.115 0.000 2.377 194 Q HA 0.616 4.956 4.340 0.000 0.000 0.279 194 Q C -2.218 173.885 176.000 0.171 0.000 1.049 194 Q CA -0.695 55.155 55.803 0.078 0.000 0.825 194 Q CB 2.399 31.125 28.738 -0.020 0.000 1.401 194 Q HN 0.734 9.004 8.270 -0.000 0.000 0.404 195 F N -0.664 119.277 119.950 -0.016 0.000 2.613 195 F HA 0.502 5.029 4.527 0.000 0.000 0.314 195 F C -0.797 174.991 175.800 -0.020 0.000 1.075 195 F CA -1.224 56.763 58.000 -0.021 0.000 0.945 195 F CB 1.094 40.076 39.000 -0.029 0.000 1.310 195 F HN 0.322 8.622 8.300 -0.000 0.000 0.467 196 D N 2.481 122.952 120.400 0.118 0.000 2.441 196 D HA 0.224 4.864 4.640 0.000 0.000 0.243 196 D C -0.513 175.810 176.300 0.038 0.000 1.257 196 D CA 0.515 54.531 54.000 0.026 0.000 1.027 196 D CB 0.258 41.097 40.800 0.066 0.000 1.084 196 D HN 0.464 8.834 8.370 -0.000 0.000 0.514 197 R N 0.448 120.876 120.500 -0.120 0.000 2.523 197 R HA 0.429 4.769 4.340 0.000 0.000 0.278 197 R C -0.516 175.677 176.300 -0.179 0.000 1.150 197 R CA -0.532 55.525 56.100 -0.071 0.000 0.987 197 R CB 1.458 31.832 30.300 0.124 0.000 1.232 197 R HN 0.290 8.560 8.270 -0.000 0.000 0.424 198 G N 1.980 110.683 108.800 -0.161 0.000 2.462 198 G HA2 0.371 4.331 3.960 0.000 0.000 0.319 198 G HA3 0.371 4.331 3.960 0.000 0.000 0.319 198 G C -0.865 173.930 174.900 -0.176 0.000 1.171 198 G CA -0.595 44.324 45.100 -0.301 0.000 0.920 198 G HN 0.530 8.820 8.290 -0.000 0.000 0.499 199 Y N -0.609 119.699 120.300 0.013 0.000 2.702 199 Y HA 0.257 4.807 4.550 0.000 0.000 0.336 199 Y C 1.107 177.030 175.900 0.038 0.000 1.235 199 Y CA -0.959 57.171 58.100 0.051 0.000 1.492 199 Y CB 0.315 38.825 38.460 0.084 0.000 1.308 199 Y HN 0.212 8.492 8.280 -0.000 0.000 0.589 200 L N 1.661 123.039 121.223 0.260 0.000 2.375 200 L HA 0.054 4.394 4.340 0.000 0.000 0.215 200 L C 1.093 178.063 176.870 0.167 0.000 1.108 200 L CA 0.895 55.838 54.840 0.171 0.000 0.830 200 L CB 0.012 42.138 42.059 0.110 0.000 0.959 200 L HN 0.752 8.982 8.230 -0.000 0.000 0.457 201 S N 0.831 116.636 115.700 0.175 0.000 2.528 201 S HA 0.303 4.773 4.470 0.000 0.000 0.303 201 S C -1.549 173.011 174.600 -0.067 0.000 1.123 201 S CA -1.555 56.695 58.200 0.083 0.000 1.138 201 S CB 0.812 64.050 63.200 0.064 0.000 0.984 201 S HN -0.067 8.243 8.310 -0.000 0.000 0.474 202 P HA -0.054 4.366 4.420 -0.000 0.000 0.223 202 P C 0.146 177.165 177.300 -0.468 0.000 1.151 202 P CA 0.760 63.563 63.100 -0.494 0.000 0.787 202 P CB -0.178 31.300 31.700 -0.370 0.000 0.788 203 Y N -1.462 118.793 120.300 -0.076 0.000 2.581 203 Y HA 0.199 4.749 4.550 0.000 0.000 0.346 203 Y C 1.735 177.669 175.900 0.058 0.000 1.147 203 Y CA -0.029 58.057 58.100 -0.023 0.000 1.353 203 Y CB -1.268 37.194 38.460 0.002 0.000 1.187 203 Y HN -0.011 8.269 8.280 -0.000 0.000 0.505 204 F N -1.005 118.866 119.950 -0.131 0.000 2.740 204 F HA 0.299 4.826 4.527 0.000 0.000 0.304 204 F C 0.649 176.371 175.800 -0.130 0.000 1.098 204 F CA -0.291 57.645 58.000 -0.107 0.000 1.258 204 F CB 0.563 39.498 39.000 -0.108 0.000 1.061 204 F HN -0.188 8.112 8.300 -0.000 0.000 0.598 205 I N 4.421 124.798 120.570 -0.321 0.000 3.247 205 I HA -0.261 3.909 4.170 0.000 0.000 0.309 205 I C 0.893 176.843 176.117 -0.279 0.000 1.246 205 I CA 0.557 61.652 61.300 -0.340 0.000 1.384 205 I CB 0.013 37.872 38.000 -0.234 0.000 1.401 205 I HN 0.400 8.610 8.210 -0.000 0.000 0.520 206 N N 6.628 125.112 118.700 -0.361 0.000 2.322 206 N HA -0.006 4.734 4.740 0.000 0.000 0.194 206 N C -0.133 175.293 175.510 -0.140 0.000 1.126 206 N CA 0.066 52.973 53.050 -0.238 0.000 0.845 206 N CB 0.531 38.849 38.487 -0.283 0.000 0.976 206 N HN 0.477 8.857 8.380 -0.000 0.000 0.475 207 K N 0.999 121.325 120.400 -0.123 0.000 2.803 207 K HA 0.263 4.583 4.320 0.000 0.000 0.229 207 K C -2.351 174.216 176.600 -0.056 0.000 1.084 207 K CA -1.181 55.061 56.287 -0.074 0.000 1.063 207 K CB 2.332 34.793 32.500 -0.065 0.000 1.254 207 K HN -0.136 8.114 8.250 -0.000 0.000 0.551 208 P HA -0.094 4.326 4.420 -0.000 0.000 0.231 208 P C 0.587 177.877 177.300 -0.018 0.000 1.158 208 P CA 0.933 64.016 63.100 -0.029 0.000 0.763 208 P CB 0.556 32.244 31.700 -0.020 0.000 0.805 209 E N -0.721 119.467 120.200 -0.019 0.000 2.028 209 E HA -0.117 4.233 4.350 0.000 0.000 0.191 209 E C 1.931 178.525 176.600 -0.010 0.000 0.988 209 E CA 1.993 58.385 56.400 -0.013 0.000 0.799 209 E CB -1.173 28.518 29.700 -0.015 0.000 0.755 209 E HN 0.337 8.697 8.360 -0.000 0.000 0.447 210 T N -3.388 111.159 114.554 -0.012 0.000 3.057 210 T HA 0.248 4.598 4.350 0.000 0.000 0.254 210 T C 1.460 176.163 174.700 0.006 0.000 1.094 210 T CA 0.259 62.355 62.100 -0.006 0.000 1.088 210 T CB 0.238 69.099 68.868 -0.011 0.000 0.934 210 T HN 0.281 8.521 8.240 -0.000 0.000 0.497 211 G N 1.176 109.979 108.800 0.006 0.000 2.256 211 G HA2 0.196 4.156 3.960 0.000 0.000 0.272 211 G HA3 0.196 4.156 3.960 0.000 0.000 0.272 211 G C 0.019 174.968 174.900 0.081 0.000 1.076 211 G CA -0.124 44.995 45.100 0.031 0.000 0.882 211 G HN 1.240 9.530 8.290 -0.000 0.000 0.497 212 A N -1.294 121.547 122.820 0.035 0.000 2.556 212 A HA 0.885 5.205 4.320 0.000 0.000 0.294 212 A C -0.362 177.199 177.584 -0.039 0.000 1.091 212 A CA -0.317 51.758 52.037 0.062 0.000 0.704 212 A CB 1.961 20.979 19.000 0.030 0.000 1.300 212 A HN 1.294 9.444 8.150 -0.000 0.000 0.406 213 V N 1.332 121.223 119.914 -0.039 0.000 2.407 213 V HA 0.344 4.464 4.120 0.000 0.000 0.278 213 V C -0.096 175.931 176.094 -0.112 0.000 1.037 213 V CA -0.043 62.147 62.300 -0.183 0.000 0.900 213 V CB 1.035 32.722 31.823 -0.226 0.000 0.983 213 V HN 0.870 9.060 8.190 -0.000 0.000 0.459 214 E N 5.356 125.474 120.200 -0.136 0.000 2.376 214 E HA 0.375 4.725 4.350 0.000 0.000 0.236 214 E C -0.993 175.572 176.600 -0.060 0.000 0.962 214 E CA -0.310 56.046 56.400 -0.074 0.000 0.768 214 E CB 1.156 30.819 29.700 -0.062 0.000 1.236 214 E HN 0.578 8.938 8.360 -0.000 0.000 0.431 215 L N 2.794 124.002 121.223 -0.024 0.000 2.325 215 L HA 0.204 4.544 4.340 0.000 0.000 0.284 215 L C 0.407 177.281 176.870 0.006 0.000 1.089 215 L CA -0.386 54.462 54.840 0.013 0.000 0.836 215 L CB 0.323 42.425 42.059 0.072 0.000 1.184 215 L HN 0.374 8.604 8.230 -0.000 0.000 0.444 216 E N 3.248 123.447 120.200 -0.001 0.000 2.180 216 E HA 0.043 4.393 4.350 0.000 0.000 0.283 216 E C 0.419 177.005 176.600 -0.024 0.000 1.061 216 E CA 0.008 56.400 56.400 -0.012 0.000 0.861 216 E CB 0.770 30.462 29.700 -0.013 0.000 1.056 216 E HN 0.491 8.851 8.360 -0.000 0.000 0.407 217 S N 4.610 120.286 115.700 -0.040 0.000 3.405 217 S HA -0.116 4.354 4.470 0.000 0.000 0.373 217 S C -2.448 172.075 174.600 -0.128 0.000 0.939 217 S CA 0.359 58.511 58.200 -0.080 0.000 1.295 217 S CB -0.874 62.275 63.200 -0.084 0.000 0.919 217 S HN 0.523 8.833 8.310 -0.000 0.000 0.535 218 P HA 0.612 5.032 4.420 -0.000 0.000 0.286 218 P C -0.071 177.137 177.300 -0.155 0.000 1.292 218 P CA -0.878 62.177 63.100 -0.075 0.000 0.842 218 P CB 0.455 32.181 31.700 0.044 0.000 1.207 219 F N -0.443 119.530 119.950 0.039 0.000 2.370 219 F HA 0.437 4.964 4.527 0.000 0.000 0.324 219 F C 0.737 176.561 175.800 0.040 0.000 1.116 219 F CA 0.075 58.095 58.000 0.033 0.000 1.123 219 F CB 0.427 39.443 39.000 0.027 0.000 1.238 219 F HN 0.005 8.305 8.300 -0.000 0.000 0.536 220 I N 2.956 123.684 120.570 0.263 0.000 2.478 220 I HA 0.272 4.442 4.170 0.000 0.000 0.287 220 I C -1.380 174.810 176.117 0.121 0.000 1.042 220 I CA -0.690 60.705 61.300 0.158 0.000 1.067 220 I CB 1.867 39.935 38.000 0.114 0.000 1.233 220 I HN 0.262 8.472 8.210 -0.000 0.000 0.431 221 L N 7.781 129.058 121.223 0.089 0.000 2.282 221 L HA 0.546 4.886 4.340 0.000 0.000 0.288 221 L C -1.106 175.787 176.870 0.038 0.000 1.033 221 L CA -0.061 54.809 54.840 0.050 0.000 0.807 221 L CB 0.902 42.980 42.059 0.032 0.000 1.209 221 L HN 0.473 8.703 8.230 -0.000 0.000 0.423 222 L N 6.488 127.723 121.223 0.021 0.000 2.297 222 L HA 0.592 4.932 4.340 0.000 0.000 0.277 222 L C -0.005 176.864 176.870 -0.002 0.000 1.040 222 L CA -0.565 54.278 54.840 0.005 0.000 0.867 222 L CB 1.129 43.184 42.059 -0.007 0.000 1.244 222 L HN 0.808 9.038 8.230 -0.000 0.000 0.433 223 A N 1.493 124.313 122.820 0.000 0.000 2.260 223 A HA 0.207 4.527 4.320 0.000 0.000 0.312 223 A C 0.625 178.205 177.584 -0.006 0.000 1.321 223 A CA -0.520 51.516 52.037 -0.002 0.000 0.928 223 A CB 0.697 19.699 19.000 0.004 0.000 1.158 223 A HN 0.777 8.927 8.150 -0.000 0.000 0.542 224 D N 2.414 122.808 120.400 -0.010 0.000 2.097 224 D HA -0.111 4.529 4.640 0.000 0.000 0.197 224 D C 0.945 177.243 176.300 -0.005 0.000 0.984 224 D CA 1.732 55.725 54.000 -0.012 0.000 0.826 224 D CB 0.012 40.804 40.800 -0.013 0.000 0.973 224 D HN 0.665 9.035 8.370 -0.000 0.000 0.460 225 K N 0.497 120.896 120.400 -0.001 0.000 2.149 225 K HA 0.137 4.457 4.320 0.000 0.000 0.245 225 K C -0.095 176.510 176.600 0.007 0.000 1.024 225 K CA -0.509 55.780 56.287 0.003 0.000 0.899 225 K CB 0.178 32.679 32.500 0.002 0.000 1.038 225 K HN -0.028 8.222 8.250 -0.000 0.000 0.496 226 K N 0.976 121.383 120.400 0.010 0.000 2.172 226 K HA 0.342 4.662 4.320 0.000 0.000 0.276 226 K C -0.672 175.935 176.600 0.012 0.000 1.013 226 K CA -0.528 55.767 56.287 0.014 0.000 0.913 226 K CB 0.693 33.204 32.500 0.018 0.000 1.055 226 K HN 0.506 8.756 8.250 -0.000 0.000 0.461 227 I N 1.781 122.358 120.570 0.013 0.000 2.440 227 I HA 0.036 4.206 4.170 0.000 0.000 0.294 227 I C 0.873 176.996 176.117 0.010 0.000 0.995 227 I CA -0.086 61.219 61.300 0.009 0.000 1.306 227 I CB 1.790 39.795 38.000 0.008 0.000 1.407 227 I HN 0.914 9.124 8.210 -0.000 0.000 0.501 228 S N 2.932 118.636 115.700 0.007 0.000 2.560 228 S HA 0.241 4.711 4.470 0.000 0.000 0.281 228 S C -0.326 174.276 174.600 0.003 0.000 1.075 228 S CA -0.276 57.928 58.200 0.007 0.000 1.295 228 S CB 0.134 63.339 63.200 0.008 0.000 1.156 228 S HN 0.748 9.058 8.310 -0.000 0.000 0.627 229 N N 1.303 120.003 118.700 0.000 0.000 2.321 229 N HA 0.421 5.161 4.740 0.000 0.000 0.299 229 N C 0.068 175.575 175.510 -0.006 0.000 1.048 229 N CA -0.623 52.426 53.050 -0.003 0.000 0.836 229 N CB 1.275 39.760 38.487 -0.003 0.000 1.269 229 N HN 0.018 8.398 8.380 -0.000 0.000 0.486 230 I N 1.268 121.833 120.570 -0.008 0.000 2.756 230 I HA -0.038 4.132 4.170 0.000 0.000 0.262 230 I C 2.130 178.239 176.117 -0.013 0.000 1.225 230 I CA 1.095 62.387 61.300 -0.012 0.000 1.472 230 I CB -0.192 37.800 38.000 -0.014 0.000 1.094 230 I HN 0.576 8.786 8.210 -0.000 0.000 0.454 231 R N 0.549 121.042 120.500 -0.011 0.000 2.097 231 R HA -0.257 4.084 4.340 0.000 0.000 0.236 231 R C 2.065 178.358 176.300 -0.013 0.000 1.135 231 R CA 2.286 58.379 56.100 -0.011 0.000 0.934 231 R CB -0.261 30.034 30.300 -0.008 0.000 0.846 231 R HN 0.354 8.624 8.270 -0.000 0.000 0.431 232 E N -0.537 119.656 120.200 -0.012 0.000 2.267 232 E HA -0.188 4.162 4.350 0.000 0.000 0.197 232 E C 1.845 178.435 176.600 -0.017 0.000 0.998 232 E CA 1.238 57.630 56.400 -0.013 0.000 0.830 232 E CB 0.057 29.751 29.700 -0.010 0.000 0.751 232 E HN 0.299 8.659 8.360 -0.000 0.000 0.491 233 M N -0.389 119.200 119.600 -0.018 0.000 2.193 233 M HA -0.011 4.469 4.480 0.000 0.000 0.265 233 M C 2.153 178.437 176.300 -0.027 0.000 1.071 233 M CA 1.060 56.346 55.300 -0.023 0.000 1.140 233 M CB -0.876 31.710 32.600 -0.022 0.000 1.369 233 M HN 0.155 8.445 8.290 -0.000 0.000 0.423 234 L N 0.009 121.218 121.223 -0.023 0.000 2.030 234 L HA -0.286 4.054 4.340 0.000 0.000 0.222 234 L C -0.328 176.525 176.870 -0.029 0.000 1.082 234 L CA 2.096 56.921 54.840 -0.024 0.000 0.785 234 L CB -2.412 39.635 42.059 -0.019 0.000 0.895 234 L HN 0.181 8.411 8.230 -0.000 0.000 0.439 235 P HA -0.156 4.264 4.420 -0.000 0.000 0.214 235 P C 1.818 179.090 177.300 -0.047 0.000 1.163 235 P CA 1.492 64.572 63.100 -0.034 0.000 0.889 235 P CB 0.008 31.689 31.700 -0.031 0.000 0.790 236 V N -1.018 118.864 119.914 -0.053 0.000 2.407 236 V HA -0.127 3.994 4.120 0.000 0.000 0.245 236 V C 2.483 178.528 176.094 -0.081 0.000 1.041 236 V CA 1.055 63.308 62.300 -0.078 0.000 1.040 236 V CB -1.405 30.372 31.823 -0.075 0.000 0.671 236 V HN 0.011 8.201 8.190 -0.000 0.000 0.455 237 L N 0.271 121.460 121.223 -0.056 0.000 2.129 237 L HA -0.249 4.091 4.340 0.000 0.000 0.212 237 L C 2.635 179.479 176.870 -0.043 0.000 1.087 237 L CA 1.917 56.730 54.840 -0.045 0.000 0.757 237 L CB -0.161 41.878 42.059 -0.033 0.000 0.896 237 L HN 0.415 8.645 8.230 -0.000 0.000 0.434 238 E N -0.088 120.086 120.200 -0.044 0.000 2.028 238 E HA -0.195 4.155 4.350 0.000 0.000 0.191 238 E C 2.069 178.641 176.600 -0.046 0.000 0.988 238 E CA 1.598 57.976 56.400 -0.037 0.000 0.799 238 E CB -0.282 29.399 29.700 -0.032 0.000 0.755 238 E HN 0.444 8.804 8.360 -0.000 0.000 0.447 239 A N 0.102 122.880 122.820 -0.071 0.000 2.019 239 A HA -0.123 4.197 4.320 0.000 0.000 0.219 239 A C 2.405 179.921 177.584 -0.114 0.000 1.164 239 A CA 1.644 53.626 52.037 -0.093 0.000 0.644 239 A CB -0.560 18.365 19.000 -0.125 0.000 0.805 239 A HN 0.206 8.356 8.150 -0.000 0.000 0.449 240 V N -0.553 119.285 119.914 -0.126 0.000 2.591 240 V HA -0.130 3.990 4.120 0.000 0.000 0.249 240 V C 2.913 179.015 176.094 0.013 0.000 1.053 240 V CA 1.526 63.776 62.300 -0.084 0.000 1.068 240 V CB -1.107 30.675 31.823 -0.068 0.000 0.689 240 V HN 0.572 8.762 8.190 -0.000 0.000 0.462 241 A N -0.087 122.732 122.820 -0.001 0.000 2.015 241 A HA -0.139 4.181 4.320 0.000 0.000 0.219 241 A C 2.071 179.667 177.584 0.021 0.000 1.163 241 A CA 1.370 53.416 52.037 0.015 0.000 0.646 241 A CB -0.272 18.730 19.000 0.002 0.000 0.806 241 A HN 0.549 8.699 8.150 -0.000 0.000 0.448 242 K N -0.904 119.503 120.400 0.011 0.000 2.397 242 K HA 0.406 4.726 4.320 0.000 0.000 0.202 242 K C 1.015 177.635 176.600 0.034 0.000 1.022 242 K CA 0.418 56.715 56.287 0.017 0.000 1.141 242 K CB 0.405 32.907 32.500 0.003 0.000 0.857 242 K HN 0.385 8.635 8.250 -0.000 0.000 0.514 243 A N -0.135 122.720 122.820 0.058 0.000 2.211 243 A HA 0.395 4.715 4.320 0.000 0.000 0.208 243 A C 1.458 179.118 177.584 0.127 0.000 1.250 243 A CA 0.702 52.804 52.037 0.109 0.000 0.935 243 A CB 0.239 19.341 19.000 0.170 0.000 0.982 243 A HN 0.323 8.473 8.150 -0.000 0.000 0.490 244 G N 0.097 108.962 108.800 0.108 0.000 2.579 244 G HA2 -0.290 3.670 3.960 0.000 0.000 0.222 244 G HA3 -0.290 3.670 3.960 0.000 0.000 0.222 244 G C 0.436 175.401 174.900 0.109 0.000 1.201 244 G CA 0.380 45.535 45.100 0.090 0.000 0.710 244 G HN 0.567 8.857 8.290 -0.000 0.000 0.516 245 K N 2.419 122.909 120.400 0.150 0.000 2.485 245 K HA 0.384 4.705 4.320 0.000 0.000 0.277 245 K C -1.961 174.748 176.600 0.182 0.000 0.990 245 K CA -0.695 55.666 56.287 0.123 0.000 0.994 245 K CB 0.524 33.038 32.500 0.024 0.000 0.906 245 K HN 0.241 8.491 8.250 -0.000 0.000 0.488 246 P HA 0.076 4.496 4.420 -0.000 0.000 0.275 246 P C -1.280 176.144 177.300 0.206 0.000 1.270 246 P CA -0.456 62.738 63.100 0.157 0.000 0.791 246 P CB 0.457 32.237 31.700 0.133 0.000 1.089 247 L N 0.226 121.561 121.223 0.188 0.000 2.470 247 L HA 0.556 4.896 4.340 0.000 0.000 0.268 247 L C -1.746 175.216 176.870 0.154 0.000 0.964 247 L CA -0.847 54.106 54.840 0.188 0.000 0.839 247 L CB 1.660 43.809 42.059 0.151 0.000 1.276 247 L HN 0.098 8.328 8.230 -0.000 0.000 0.403 248 L N 5.902 127.219 121.223 0.155 0.000 2.309 248 L HA 0.681 5.021 4.340 0.000 0.000 0.282 248 L C -1.119 175.820 176.870 0.116 0.000 1.036 248 L CA 0.101 55.028 54.840 0.145 0.000 0.806 248 L CB 1.277 43.427 42.059 0.152 0.000 1.220 248 L HN 0.612 8.842 8.230 -0.000 0.000 0.429 249 I N 6.544 127.173 120.570 0.099 0.000 2.390 249 I HA 0.350 4.520 4.170 0.000 0.000 0.283 249 I C -0.631 175.538 176.117 0.086 0.000 1.016 249 I CA -0.081 61.263 61.300 0.073 0.000 1.151 249 I CB 1.129 39.153 38.000 0.041 0.000 1.293 249 I HN 0.468 8.678 8.210 -0.000 0.000 0.458 250 I N 6.344 126.963 120.570 0.081 0.000 2.310 250 I HA 0.558 4.728 4.170 0.000 0.000 0.287 250 I C 0.533 176.672 176.117 0.036 0.000 1.073 250 I CA 0.010 61.357 61.300 0.077 0.000 1.216 250 I CB 0.688 38.728 38.000 0.066 0.000 1.415 250 I HN 0.606 8.816 8.210 -0.000 0.000 0.480 251 A N 4.530 127.375 122.820 0.041 0.000 2.309 251 A HA 0.427 4.747 4.320 0.000 0.000 0.317 251 A C 1.108 178.706 177.584 0.023 0.000 1.134 251 A CA -0.518 51.533 52.037 0.024 0.000 0.866 251 A CB 0.987 20.002 19.000 0.025 0.000 1.329 251 A HN 0.721 8.871 8.150 -0.000 0.000 0.477 252 E N -0.607 119.603 120.200 0.016 0.000 2.085 252 E HA -0.150 4.200 4.350 0.000 0.000 0.194 252 E C -0.320 176.300 176.600 0.033 0.000 0.994 252 E CA 1.473 57.885 56.400 0.020 0.000 0.801 252 E CB 0.160 29.870 29.700 0.016 0.000 0.743 252 E HN 0.615 8.975 8.360 -0.000 0.000 0.453 253 D N -1.565 118.855 120.400 0.033 0.000 2.685 253 D HA 0.197 4.837 4.640 0.000 0.000 0.236 253 D C -1.795 174.525 176.300 0.033 0.000 1.233 253 D CA -0.456 53.567 54.000 0.039 0.000 0.760 253 D CB 2.267 43.089 40.800 0.037 0.000 1.410 253 D HN -0.102 8.268 8.370 -0.000 0.000 0.439 254 V N 2.574 122.511 119.914 0.037 0.000 2.577 254 V HA 0.507 4.627 4.120 0.000 0.000 0.303 254 V C 0.163 176.276 176.094 0.031 0.000 1.042 254 V CA -0.503 61.814 62.300 0.030 0.000 0.872 254 V CB 1.686 33.526 31.823 0.028 0.000 0.998 254 V HN 0.650 8.840 8.190 -0.000 0.000 0.423 255 E N 3.183 123.397 120.200 0.024 0.000 2.296 255 E HA 0.784 5.134 4.350 0.000 0.000 0.224 255 E C 0.513 177.125 176.600 0.019 0.000 0.949 255 E CA -0.393 56.023 56.400 0.025 0.000 0.879 255 E CB 1.053 30.768 29.700 0.026 0.000 1.922 255 E HN 1.136 9.496 8.360 -0.000 0.000 0.437 256 G N 0.979 109.790 108.800 0.019 0.000 2.574 256 G HA2 -0.410 3.550 3.960 0.000 0.000 0.282 256 G HA3 -0.410 3.550 3.960 0.000 0.000 0.282 256 G C 0.618 175.526 174.900 0.012 0.000 1.257 256 G CA 1.079 46.188 45.100 0.014 0.000 0.956 256 G HN 0.791 9.081 8.290 -0.000 0.000 0.560 257 E N 0.202 120.406 120.200 0.007 0.000 2.208 257 E HA 0.366 4.716 4.350 0.000 0.000 0.193 257 E C 2.704 179.303 176.600 -0.002 0.000 0.988 257 E CA 2.096 58.498 56.400 0.002 0.000 0.828 257 E CB -0.732 28.967 29.700 -0.001 0.000 0.763 257 E HN 1.300 9.660 8.360 -0.000 0.000 0.478 258 A N 1.689 124.508 122.820 -0.002 0.000 1.869 258 A HA -0.228 4.092 4.320 0.000 0.000 0.218 258 A C 2.224 179.801 177.584 -0.011 0.000 1.203 258 A CA 1.929 53.962 52.037 -0.007 0.000 0.638 258 A CB -1.060 17.938 19.000 -0.004 0.000 0.831 258 A HN 0.325 8.475 8.150 -0.000 0.000 0.450 259 L N -0.399 120.823 121.223 -0.001 0.000 2.012 259 L HA -0.126 4.214 4.340 0.000 0.000 0.210 259 L C 2.779 179.649 176.870 0.000 0.000 1.073 259 L CA 2.480 57.321 54.840 0.001 0.000 0.748 259 L CB -0.888 41.185 42.059 0.022 0.000 0.891 259 L HN 0.404 8.634 8.230 -0.000 0.000 0.431 260 A N -1.234 121.592 122.820 0.010 0.000 1.908 260 A HA -0.271 4.049 4.320 0.000 0.000 0.218 260 A C 2.342 179.920 177.584 -0.010 0.000 1.181 260 A CA 2.791 54.834 52.037 0.010 0.000 0.627 260 A CB -1.425 17.581 19.000 0.010 0.000 0.818 260 A HN 0.649 8.799 8.150 -0.000 0.000 0.445 261 T N -1.265 113.279 114.554 -0.017 0.000 2.737 261 T HA -0.069 4.281 4.350 0.000 0.000 0.265 261 T C 1.842 176.517 174.700 -0.041 0.000 1.038 261 T CA 1.305 63.389 62.100 -0.026 0.000 1.144 261 T CB -0.725 68.129 68.868 -0.023 0.000 0.866 261 T HN 0.264 8.504 8.240 -0.000 0.000 0.434 262 L N 1.104 122.294 121.223 -0.054 0.000 2.089 262 L HA -0.163 4.177 4.340 0.000 0.000 0.213 262 L C 2.897 179.690 176.870 -0.128 0.000 1.079 262 L CA 1.164 55.946 54.840 -0.097 0.000 0.758 262 L CB -0.898 41.092 42.059 -0.115 0.000 0.891 262 L HN 0.206 8.436 8.230 -0.000 0.000 0.433 263 V N -0.817 119.046 119.914 -0.085 0.000 2.233 263 V HA -0.267 3.853 4.120 0.000 0.000 0.247 263 V C 2.367 178.439 176.094 -0.037 0.000 1.050 263 V CA 1.913 64.181 62.300 -0.053 0.000 1.010 263 V CB -0.701 31.131 31.823 0.015 0.000 0.637 263 V HN 0.285 8.475 8.190 -0.000 0.000 0.444 264 V N 0.719 120.613 119.914 -0.035 0.000 2.688 264 V HA -0.231 3.889 4.120 0.000 0.000 0.256 264 V C 2.168 178.248 176.094 -0.023 0.000 1.084 264 V CA 1.949 64.231 62.300 -0.029 0.000 1.103 264 V CB -1.153 30.651 31.823 -0.031 0.000 0.688 264 V HN 0.579 8.769 8.190 -0.000 0.000 0.480 265 N N 0.414 119.094 118.700 -0.034 0.000 2.207 265 N HA -0.085 4.655 4.740 0.000 0.000 0.182 265 N C 1.909 177.411 175.510 -0.013 0.000 1.020 265 N CA 1.857 54.890 53.050 -0.028 0.000 0.858 265 N CB -0.103 38.359 38.487 -0.042 0.000 0.991 265 N HN 0.488 8.868 8.380 -0.000 0.000 0.427 266 T N 1.455 115.994 114.554 -0.025 0.000 2.978 266 T HA 0.097 4.447 4.350 0.000 0.000 0.262 266 T C 1.938 176.693 174.700 0.091 0.000 1.063 266 T CA 0.205 62.333 62.100 0.046 0.000 1.140 266 T CB 0.131 69.024 68.868 0.041 0.000 0.886 266 T HN 0.125 8.365 8.240 -0.000 0.000 0.470 267 M N 0.732 120.370 119.600 0.064 0.000 2.195 267 M HA -0.129 4.351 4.480 0.000 0.000 0.260 267 M C 2.380 178.701 176.300 0.035 0.000 1.066 267 M CA 1.548 56.881 55.300 0.056 0.000 1.089 267 M CB -0.060 32.554 32.600 0.023 0.000 1.377 267 M HN 0.060 8.350 8.290 -0.000 0.000 0.411 268 R N -0.861 119.654 120.500 0.024 0.000 2.140 268 R HA 0.038 4.378 4.340 0.000 0.000 0.213 268 R C 0.991 177.306 176.300 0.025 0.000 1.059 268 R CA 1.214 57.324 56.100 0.017 0.000 1.000 268 R CB 0.289 30.593 30.300 0.006 0.000 0.910 268 R HN 0.526 8.796 8.270 -0.000 0.000 0.455 269 G N -0.055 108.766 108.800 0.036 0.000 2.135 269 G HA2 -0.150 3.811 3.960 0.000 0.000 0.183 269 G HA3 -0.150 3.811 3.960 0.000 0.000 0.183 269 G C 0.493 175.413 174.900 0.034 0.000 1.004 269 G CA 0.147 45.273 45.100 0.042 0.000 0.677 269 G HN 0.150 8.440 8.290 -0.000 0.000 0.512 270 I N -0.118 120.467 120.570 0.025 0.000 2.193 270 I HA 0.087 4.257 4.170 0.000 0.000 0.240 270 I C 1.551 177.683 176.117 0.025 0.000 1.084 270 I CA 2.260 63.571 61.300 0.018 0.000 1.365 270 I CB -1.331 36.672 38.000 0.006 0.000 1.064 270 I HN 0.559 8.769 8.210 -0.000 0.000 0.410 271 V N -1.929 118.001 119.914 0.027 0.000 3.114 271 V HA 0.497 4.617 4.120 0.000 0.000 0.308 271 V C -0.482 175.648 176.094 0.061 0.000 1.168 271 V CA -1.253 61.071 62.300 0.039 0.000 1.015 271 V CB 2.518 34.352 31.823 0.018 0.000 1.050 271 V HN 0.041 8.231 8.190 -0.000 0.000 0.433 272 K N 1.863 122.325 120.400 0.103 0.000 2.334 272 K HA 0.719 5.039 4.320 0.000 0.000 0.265 272 K C -0.991 175.708 176.600 0.163 0.000 1.039 272 K CA -0.440 55.962 56.287 0.192 0.000 0.920 272 K CB 1.500 34.136 32.500 0.227 0.000 1.160 272 K HN 0.938 9.188 8.250 -0.000 0.000 0.451 273 V N 0.282 120.169 119.914 -0.046 0.000 2.577 273 V HA 0.825 4.945 4.120 0.000 0.000 0.303 273 V C -0.605 175.189 176.094 -0.500 0.000 1.042 273 V CA -1.069 61.137 62.300 -0.157 0.000 0.872 273 V CB 1.527 33.264 31.823 -0.144 0.000 0.998 273 V HN 0.656 8.846 8.190 -0.000 0.000 0.423 274 A N 3.496 126.289 122.820 -0.044 0.000 2.325 274 A HA 1.033 5.353 4.320 0.000 0.000 0.333 274 A C 0.093 177.714 177.584 0.061 0.000 1.155 274 A CA -0.287 51.811 52.037 0.102 0.000 0.814 274 A CB 1.703 20.971 19.000 0.446 0.000 1.206 274 A HN 2.344 10.494 8.150 -0.000 0.000 0.482 275 A N 1.197 124.071 122.820 0.089 0.000 2.357 275 A HA 0.666 4.986 4.320 0.000 0.000 0.295 275 A C -0.592 177.075 177.584 0.139 0.000 1.121 275 A CA -0.248 51.841 52.037 0.086 0.000 0.742 275 A CB 0.793 19.815 19.000 0.036 0.000 1.181 275 A HN 2.115 10.265 8.150 -0.000 0.000 0.454 276 V N 0.119 120.117 119.914 0.139 0.000 2.841 276 V HA 0.593 4.713 4.120 0.000 0.000 0.310 276 V C -0.184 175.996 176.094 0.143 0.000 1.090 276 V CA -1.241 61.148 62.300 0.150 0.000 0.930 276 V CB 1.325 33.253 31.823 0.175 0.000 1.014 276 V HN 0.845 9.035 8.190 -0.000 0.000 0.425 277 K N 1.762 122.239 120.400 0.129 0.000 2.188 277 K HA 0.590 4.910 4.320 0.000 0.000 0.246 277 K C 0.445 177.121 176.600 0.128 0.000 1.026 277 K CA 0.354 56.706 56.287 0.109 0.000 0.871 277 K CB 0.482 33.038 32.500 0.095 0.000 1.042 277 K HN 1.103 9.353 8.250 -0.000 0.000 0.509 278 A N 2.353 125.209 122.820 0.060 0.000 2.327 278 A HA 0.295 4.615 4.320 0.000 0.000 0.283 278 A C -2.204 175.362 177.584 -0.031 0.000 1.127 278 A CA -1.494 50.532 52.037 -0.018 0.000 0.810 278 A CB -0.042 18.928 19.000 -0.051 0.000 1.066 278 A HN 0.405 8.555 8.150 -0.000 0.000 0.492 279 P HA 0.415 4.835 4.420 -0.000 0.000 0.275 279 P C 0.517 177.676 177.300 -0.236 0.000 1.276 279 P CA 1.348 64.370 63.100 -0.131 0.000 0.782 279 P CB 0.419 31.909 31.700 -0.351 0.000 0.851 280 G N 2.954 111.574 108.800 -0.300 0.000 2.396 280 G HA2 0.200 4.160 3.960 0.000 0.000 0.254 280 G HA3 0.200 4.160 3.960 0.000 0.000 0.254 280 G C -1.508 173.085 174.900 -0.511 0.000 1.248 280 G CA -0.674 43.978 45.100 -0.747 0.000 1.033 280 G HN 0.480 8.770 8.290 -0.000 0.000 0.502 281 F N -2.038 117.926 119.950 0.023 0.000 2.672 281 F HA 0.727 5.254 4.527 0.000 0.000 0.311 281 F C 0.868 176.682 175.800 0.024 0.000 1.113 281 F CA 0.030 58.044 58.000 0.024 0.000 0.996 281 F CB 0.859 39.876 39.000 0.029 0.000 1.286 281 F HN 2.397 10.697 8.300 -0.000 0.000 0.441 282 G N 1.749 110.679 108.800 0.216 0.000 2.566 282 G HA2 -0.308 3.652 3.960 0.000 0.000 0.280 282 G HA3 -0.308 3.652 3.960 0.000 0.000 0.280 282 G C 0.250 175.195 174.900 0.075 0.000 1.225 282 G CA 0.721 45.906 45.100 0.141 0.000 0.966 282 G HN 0.805 9.095 8.290 -0.000 0.000 0.560 283 D N 0.042 120.484 120.400 0.069 0.000 2.264 283 D HA 0.015 4.655 4.640 0.000 0.000 0.208 283 D C 2.412 178.712 176.300 0.000 0.000 0.966 283 D CA 0.850 54.868 54.000 0.030 0.000 0.864 283 D CB -0.121 40.700 40.800 0.035 0.000 0.933 283 D HN 0.421 8.791 8.370 -0.000 0.000 0.499 284 R N 0.382 120.883 120.500 0.002 0.000 2.115 284 R HA -0.053 4.287 4.340 0.000 0.000 0.230 284 R C 2.214 178.433 176.300 -0.134 0.000 1.111 284 R CA 0.758 56.816 56.100 -0.070 0.000 0.976 284 R CB 0.108 30.356 30.300 -0.087 0.000 0.870 284 R HN 0.079 8.349 8.270 -0.000 0.000 0.445 285 R N 1.225 121.646 120.500 -0.131 0.000 2.082 285 R HA -0.184 4.157 4.340 0.000 0.000 0.234 285 R C 1.732 177.965 176.300 -0.112 0.000 1.136 285 R CA 2.153 58.167 56.100 -0.145 0.000 0.935 285 R CB -0.085 30.160 30.300 -0.090 0.000 0.842 285 R HN 0.114 8.384 8.270 -0.000 0.000 0.430 286 K N 0.230 120.588 120.400 -0.071 0.000 2.147 286 K HA -0.072 4.248 4.320 0.000 0.000 0.205 286 K C 2.158 178.717 176.600 -0.067 0.000 1.049 286 K CA 1.332 57.583 56.287 -0.059 0.000 0.936 286 K CB -0.204 32.275 32.500 -0.035 0.000 0.722 286 K HN 0.278 8.528 8.250 -0.000 0.000 0.446 287 A N 1.709 124.486 122.820 -0.070 0.000 1.851 287 A HA -0.165 4.155 4.320 0.000 0.000 0.216 287 A C 2.225 179.752 177.584 -0.094 0.000 1.195 287 A CA 1.590 53.583 52.037 -0.073 0.000 0.622 287 A CB -0.480 18.478 19.000 -0.070 0.000 0.831 287 A HN 0.164 8.314 8.150 -0.000 0.000 0.444 288 M N -1.421 118.103 119.600 -0.126 0.000 2.175 288 M HA -0.101 4.380 4.480 0.000 0.000 0.264 288 M C 2.203 178.398 176.300 -0.175 0.000 1.063 288 M CA 1.157 56.362 55.300 -0.158 0.000 1.119 288 M CB -0.509 31.969 32.600 -0.203 0.000 1.377 288 M HN 0.453 8.743 8.290 -0.000 0.000 0.415 289 L N 0.729 121.854 121.223 -0.163 0.000 2.083 289 L HA -0.219 4.121 4.340 0.000 0.000 0.209 289 L C 2.457 179.262 176.870 -0.108 0.000 1.083 289 L CA 1.889 56.637 54.840 -0.153 0.000 0.752 289 L CB -0.758 41.231 42.059 -0.117 0.000 0.899 289 L HN 0.260 8.490 8.230 -0.000 0.000 0.433 290 Q N -0.190 119.559 119.800 -0.085 0.000 2.084 290 Q HA -0.223 4.117 4.340 0.000 0.000 0.202 290 Q C 1.745 177.709 176.000 -0.060 0.000 0.978 290 Q CA 2.155 57.922 55.803 -0.060 0.000 0.844 290 Q CB -0.427 28.281 28.738 -0.050 0.000 0.898 290 Q HN 0.542 8.812 8.270 -0.000 0.000 0.426 291 D N -0.192 120.163 120.400 -0.074 0.000 2.133 291 D HA -0.177 4.463 4.640 0.000 0.000 0.195 291 D C 1.764 178.028 176.300 -0.060 0.000 0.997 291 D CA 1.613 55.573 54.000 -0.066 0.000 0.840 291 D CB -0.227 40.525 40.800 -0.079 0.000 0.947 291 D HN 0.406 8.776 8.370 -0.000 0.000 0.452 292 I N 0.712 121.232 120.570 -0.084 0.000 2.315 292 I HA -0.226 3.945 4.170 0.000 0.000 0.248 292 I C 2.412 178.510 176.117 -0.032 0.000 1.117 292 I CA 0.965 62.224 61.300 -0.068 0.000 1.404 292 I CB -0.238 37.690 38.000 -0.119 0.000 1.071 292 I HN -0.055 8.155 8.210 -0.000 0.000 0.419 293 A N 0.563 123.363 122.820 -0.033 0.000 1.908 293 A HA -0.217 4.103 4.320 0.000 0.000 0.218 293 A C 2.413 179.993 177.584 -0.006 0.000 1.181 293 A CA 2.537 54.566 52.037 -0.013 0.000 0.627 293 A CB -1.189 17.801 19.000 -0.016 0.000 0.818 293 A HN 0.412 8.562 8.150 -0.000 0.000 0.445 294 T N 0.045 114.590 114.554 -0.014 0.000 2.708 294 T HA -0.149 4.201 4.350 0.000 0.000 0.266 294 T C 1.764 176.461 174.700 -0.004 0.000 1.037 294 T CA 1.525 63.619 62.100 -0.010 0.000 1.146 294 T CB -0.372 68.487 68.868 -0.016 0.000 0.865 294 T HN 0.310 8.550 8.240 -0.000 0.000 0.435 295 L N 1.842 123.062 121.223 -0.005 0.000 2.362 295 L HA 0.021 4.361 4.340 0.000 0.000 0.219 295 L C 2.172 179.046 176.870 0.008 0.000 1.134 295 L CA 1.628 56.469 54.840 0.002 0.000 0.807 295 L CB -0.645 41.416 42.059 0.004 0.000 0.927 295 L HN 0.443 8.673 8.230 -0.000 0.000 0.447 296 T N -5.324 109.237 114.554 0.012 0.000 3.003 296 T HA 0.379 4.729 4.350 0.000 0.000 0.261 296 T C 1.256 175.971 174.700 0.025 0.000 1.003 296 T CA 0.186 62.298 62.100 0.020 0.000 0.917 296 T CB 0.141 69.028 68.868 0.031 0.000 1.084 296 T HN 0.438 8.678 8.240 -0.000 0.000 0.522 297 G N 0.727 109.539 108.800 0.020 0.000 2.225 297 G HA2 0.119 4.079 3.960 0.000 0.000 0.264 297 G HA3 0.119 4.079 3.960 0.000 0.000 0.264 297 G C 0.265 175.187 174.900 0.036 0.000 1.060 297 G CA -0.185 44.929 45.100 0.024 0.000 0.833 297 G HN 1.050 9.340 8.290 -0.000 0.000 0.498 298 G N -1.612 107.208 108.800 0.033 0.000 2.644 298 G HA2 0.805 4.765 3.960 0.000 0.000 0.307 298 G HA3 0.805 4.765 3.960 0.000 0.000 0.307 298 G C -0.439 174.472 174.900 0.018 0.000 1.250 298 G CA 0.093 45.215 45.100 0.037 0.000 0.996 298 G HN 0.598 8.888 8.290 -0.000 0.000 0.489 299 T N 0.367 114.930 114.554 0.015 0.000 2.823 299 T HA 0.419 4.769 4.350 0.000 0.000 0.279 299 T C 0.161 174.861 174.700 -0.001 0.000 0.998 299 T CA -0.288 61.814 62.100 0.004 0.000 0.994 299 T CB 1.678 70.547 68.868 0.002 0.000 0.960 299 T HN 0.356 8.596 8.240 -0.000 0.000 0.448 300 V N 4.261 124.170 119.914 -0.008 0.000 2.479 300 V HA 0.121 4.241 4.120 0.000 0.000 0.281 300 V C 0.397 176.485 176.094 -0.010 0.000 1.031 300 V CA -0.257 62.035 62.300 -0.013 0.000 1.038 300 V CB -0.273 31.538 31.823 -0.021 0.000 0.981 300 V HN 0.732 8.922 8.190 -0.000 0.000 0.478 301 I N 4.877 125.442 120.570 -0.009 0.000 2.243 301 I HA 0.093 4.263 4.170 0.000 0.000 0.297 301 I C 0.849 176.961 176.117 -0.009 0.000 1.161 301 I CA 0.967 62.262 61.300 -0.009 0.000 1.298 301 I CB 0.686 38.681 38.000 -0.008 0.000 1.475 301 I HN 0.619 8.829 8.210 -0.000 0.000 0.561 302 S N 4.361 120.055 115.700 -0.009 0.000 2.430 302 S HA 0.171 4.641 4.470 0.000 0.000 0.289 302 S C 1.276 175.872 174.600 -0.007 0.000 1.143 302 S CA -0.504 57.691 58.200 -0.009 0.000 1.067 302 S CB 0.529 63.723 63.200 -0.010 0.000 0.964 302 S HN 0.690 9.000 8.310 -0.000 0.000 0.485 303 E N 3.320 123.517 120.200 -0.005 0.000 2.153 303 E HA -0.166 4.185 4.350 0.000 0.000 0.194 303 E C 1.307 177.905 176.600 -0.003 0.000 0.988 303 E CA 1.262 57.660 56.400 -0.004 0.000 0.811 303 E CB 0.129 29.828 29.700 -0.002 0.000 0.746 303 E HN 0.839 9.199 8.360 -0.000 0.000 0.466 304 E N 0.414 120.613 120.200 -0.003 0.000 2.077 304 E HA -0.165 4.185 4.350 0.000 0.000 0.193 304 E C 1.622 178.221 176.600 -0.003 0.000 0.989 304 E CA 1.217 57.616 56.400 -0.002 0.000 0.800 304 E CB -0.289 29.411 29.700 -0.001 0.000 0.746 304 E HN 0.438 8.798 8.360 -0.000 0.000 0.452 305 I N -2.034 118.533 120.570 -0.004 0.000 3.585 305 I HA 0.413 4.584 4.170 0.000 0.000 0.325 305 I C 0.452 176.566 176.117 -0.004 0.000 1.370 305 I CA -0.239 61.058 61.300 -0.004 0.000 1.298 305 I CB -0.315 37.682 38.000 -0.005 0.000 1.387 305 I HN 0.049 8.259 8.210 -0.000 0.000 0.466 306 G N 2.690 111.488 108.800 -0.004 0.000 2.333 306 G HA2 -0.239 3.721 3.960 0.000 0.000 0.296 306 G HA3 -0.239 3.721 3.960 0.000 0.000 0.296 306 G C -0.345 174.552 174.900 -0.005 0.000 1.059 306 G CA 0.083 45.181 45.100 -0.004 0.000 1.050 306 G HN 0.577 8.867 8.290 -0.000 0.000 0.508 307 M N -0.375 119.222 119.600 -0.005 0.000 2.386 307 M HA 0.370 4.850 4.480 0.000 0.000 0.293 307 M C -0.250 176.046 176.300 -0.007 0.000 1.120 307 M CA -0.614 54.682 55.300 -0.007 0.000 0.909 307 M CB 2.330 34.925 32.600 -0.007 0.000 1.661 307 M HN 0.271 8.561 8.290 -0.000 0.000 0.452 308 E N 1.465 121.660 120.200 -0.008 0.000 2.242 308 E HA 0.212 4.562 4.350 0.000 0.000 0.275 308 E C 0.224 176.818 176.600 -0.010 0.000 1.002 308 E CA -0.569 55.826 56.400 -0.008 0.000 0.841 308 E CB 2.150 31.844 29.700 -0.008 0.000 1.109 308 E HN 0.494 8.854 8.360 -0.000 0.000 0.394 309 L N 2.665 123.882 121.223 -0.010 0.000 2.275 309 L HA -0.135 4.205 4.340 0.000 0.000 0.215 309 L C 1.486 178.346 176.870 -0.016 0.000 1.119 309 L CA 1.808 56.641 54.840 -0.012 0.000 0.790 309 L CB -0.211 41.842 42.059 -0.010 0.000 0.919 309 L HN 0.576 8.806 8.230 -0.000 0.000 0.443 310 E N -0.353 119.837 120.200 -0.015 0.000 2.230 310 E HA -0.175 4.175 4.350 0.000 0.000 0.192 310 E C 1.471 178.059 176.600 -0.020 0.000 0.987 310 E CA 0.802 57.192 56.400 -0.018 0.000 0.841 310 E CB -0.130 29.561 29.700 -0.015 0.000 0.783 310 E HN 0.584 8.944 8.360 -0.000 0.000 0.481 311 K N 1.267 121.656 120.400 -0.018 0.000 2.505 311 K HA 0.273 4.593 4.320 0.000 0.000 0.192 311 K C 0.499 177.086 176.600 -0.022 0.000 1.025 311 K CA 0.023 56.299 56.287 -0.018 0.000 1.086 311 K CB 0.349 32.841 32.500 -0.014 0.000 0.840 311 K HN -0.073 8.177 8.250 -0.000 0.000 0.514 312 A N 1.535 124.339 122.820 -0.026 0.000 2.340 312 A HA 0.379 4.699 4.320 0.000 0.000 0.268 312 A C 0.211 177.768 177.584 -0.046 0.000 1.100 312 A CA -0.259 51.758 52.037 -0.032 0.000 0.803 312 A CB 0.491 19.471 19.000 -0.032 0.000 1.043 312 A HN 0.498 8.648 8.150 -0.000 0.000 0.488 313 T N -0.881 113.642 114.554 -0.052 0.000 2.773 313 T HA 0.510 4.860 4.350 0.000 0.000 0.278 313 T C 1.036 175.674 174.700 -0.104 0.000 1.011 313 T CA -0.693 61.364 62.100 -0.072 0.000 1.014 313 T CB 0.427 69.263 68.868 -0.052 0.000 1.293 313 T HN 0.312 8.552 8.240 -0.000 0.000 0.554 314 L N 0.235 121.370 121.223 -0.148 0.000 2.189 314 L HA -0.114 4.226 4.340 0.000 0.000 0.214 314 L C 2.860 179.676 176.870 -0.091 0.000 1.097 314 L CA 1.810 56.513 54.840 -0.228 0.000 0.764 314 L CB -0.632 41.277 42.059 -0.250 0.000 0.900 314 L HN 0.867 9.097 8.230 -0.000 0.000 0.436 315 E N 0.838 121.013 120.200 -0.041 0.000 2.065 315 E HA -0.271 4.079 4.350 0.000 0.000 0.201 315 E C 1.476 178.084 176.600 0.013 0.000 1.016 315 E CA 2.053 58.453 56.400 0.000 0.000 0.818 315 E CB -0.055 29.642 29.700 -0.005 0.000 0.749 315 E HN 0.482 8.842 8.360 -0.000 0.000 0.453 316 D N -0.179 120.218 120.400 -0.005 0.000 2.349 316 D HA -0.006 4.634 4.640 0.000 0.000 0.224 316 D C 0.177 176.491 176.300 0.023 0.000 1.029 316 D CA 0.184 54.188 54.000 0.006 0.000 0.879 316 D CB 0.129 40.924 40.800 -0.007 0.000 0.906 316 D HN 0.265 8.635 8.370 -0.000 0.000 0.528 317 L N 1.298 122.542 121.223 0.035 0.000 2.349 317 L HA 0.306 4.646 4.340 0.000 0.000 0.275 317 L C 1.352 178.325 176.870 0.171 0.000 1.115 317 L CA -0.592 54.306 54.840 0.097 0.000 0.820 317 L CB 1.268 43.373 42.059 0.076 0.000 1.135 317 L HN -0.111 8.119 8.230 -0.000 0.000 0.445 318 G N 2.365 111.251 108.800 0.143 0.000 2.599 318 G HA2 0.406 4.366 3.960 0.000 0.000 0.264 318 G HA3 0.406 4.366 3.960 0.000 0.000 0.264 318 G C -0.768 174.215 174.900 0.138 0.000 1.200 318 G CA -0.268 44.902 45.100 0.116 0.000 0.896 318 G HN 0.630 8.920 8.290 -0.000 0.000 0.536 319 Q N -1.352 118.480 119.800 0.053 0.000 2.340 319 Q HA 0.579 4.920 4.340 0.000 0.000 0.276 319 Q C -0.821 175.159 176.000 -0.034 0.000 1.048 319 Q CA -0.743 55.038 55.803 -0.036 0.000 0.832 319 Q CB 2.536 31.206 28.738 -0.113 0.000 1.373 319 Q HN 0.834 9.104 8.270 -0.000 0.000 0.409 320 A N 1.141 123.929 122.820 -0.053 0.000 2.479 320 A HA 0.448 4.768 4.320 0.000 0.000 0.296 320 A C -0.047 177.509 177.584 -0.047 0.000 1.121 320 A CA -0.573 51.447 52.037 -0.029 0.000 0.743 320 A CB 1.686 20.688 19.000 0.003 0.000 1.323 320 A HN 0.787 8.937 8.150 -0.000 0.000 0.415 321 K N -0.501 119.881 120.400 -0.030 0.000 2.057 321 K HA 0.034 4.354 4.320 0.000 0.000 0.206 321 K C 0.545 177.129 176.600 -0.027 0.000 1.050 321 K CA 1.266 57.534 56.287 -0.031 0.000 0.935 321 K CB 0.050 32.538 32.500 -0.021 0.000 0.715 321 K HN 0.611 8.861 8.250 -0.000 0.000 0.439 322 R N -0.982 119.509 120.500 -0.015 0.000 2.692 322 R HA 0.352 4.692 4.340 0.000 0.000 0.269 322 R C -1.982 174.321 176.300 0.004 0.000 1.030 322 R CA -0.742 55.353 56.100 -0.009 0.000 0.882 322 R CB 2.460 32.753 30.300 -0.011 0.000 1.250 322 R HN -0.112 8.158 8.270 -0.000 0.000 0.465 323 V N 2.165 122.084 119.914 0.008 0.000 2.760 323 V HA 0.535 4.655 4.120 0.000 0.000 0.309 323 V C -1.045 175.052 176.094 0.004 0.000 1.077 323 V CA -0.766 61.546 62.300 0.019 0.000 0.910 323 V CB 2.205 34.057 31.823 0.048 0.000 1.008 323 V HN 0.439 8.629 8.190 -0.000 0.000 0.424 324 V N 6.000 125.909 119.914 -0.008 0.000 2.443 324 V HA 0.589 4.710 4.120 0.000 0.000 0.293 324 V C -0.674 175.400 176.094 -0.034 0.000 1.021 324 V CA -0.310 61.977 62.300 -0.022 0.000 0.848 324 V CB 1.708 33.513 31.823 -0.030 0.000 0.998 324 V HN 0.728 8.918 8.190 -0.000 0.000 0.424 325 I N 5.363 125.930 120.570 -0.005 0.000 2.447 325 I HA 0.525 4.695 4.170 0.000 0.000 0.287 325 I C -0.192 175.960 176.117 0.057 0.000 1.023 325 I CA -0.387 60.917 61.300 0.006 0.000 1.083 325 I CB 1.985 40.043 38.000 0.097 0.000 1.245 325 I HN 0.799 9.009 8.210 -0.000 0.000 0.434 326 N N 4.475 123.135 118.700 -0.066 0.000 2.815 326 N HA 0.350 5.090 4.740 0.000 0.000 0.315 326 N C 0.591 175.765 175.510 -0.559 0.000 1.320 326 N CA -1.045 51.940 53.050 -0.107 0.000 0.846 326 N CB 0.651 39.094 38.487 -0.073 0.000 1.344 326 N HN 0.459 8.839 8.380 -0.000 0.000 0.593 327 K N -1.228 118.795 120.400 -0.630 0.000 2.286 327 K HA -0.187 4.133 4.320 0.000 0.000 0.203 327 K C -0.302 176.024 176.600 -0.456 0.000 1.045 327 K CA 1.794 57.624 56.287 -0.762 0.000 0.935 327 K CB -0.134 32.184 32.500 -0.302 0.000 0.737 327 K HN 0.574 8.824 8.250 -0.000 0.000 0.460 328 D N -0.713 119.502 120.400 -0.307 0.000 2.504 328 D HA 0.014 4.654 4.640 0.000 0.000 0.276 328 D C 0.208 176.391 176.300 -0.195 0.000 1.073 328 D CA 0.656 54.537 54.000 -0.199 0.000 0.905 328 D CB 0.956 41.678 40.800 -0.129 0.000 1.350 328 D HN 0.277 8.647 8.370 -0.000 0.000 0.496 329 T N -0.901 113.519 114.554 -0.223 0.000 2.900 329 T HA 0.606 4.956 4.350 0.000 0.000 0.295 329 T C -0.409 174.088 174.700 -0.339 0.000 1.044 329 T CA -0.626 61.313 62.100 -0.270 0.000 0.995 329 T CB 2.490 71.241 68.868 -0.196 0.000 1.072 329 T HN -0.315 7.925 8.240 -0.000 0.000 0.473 330 T N 2.290 116.489 114.554 -0.591 0.000 2.829 330 T HA 0.682 5.032 4.350 0.000 0.000 0.280 330 T C -0.564 173.834 174.700 -0.504 0.000 0.999 330 T CA -0.560 61.191 62.100 -0.581 0.000 0.983 330 T CB 1.538 69.937 68.868 -0.782 0.000 0.968 330 T HN 0.798 9.038 8.240 -0.000 0.000 0.446 331 T N 3.158 117.590 114.554 -0.203 0.000 2.841 331 T HA 0.554 4.904 4.350 0.000 0.000 0.285 331 T C -0.317 174.388 174.700 0.008 0.000 0.991 331 T CA -0.492 61.562 62.100 -0.076 0.000 0.966 331 T CB 0.790 69.621 68.868 -0.061 0.000 0.962 331 T HN 0.409 8.649 8.240 -0.000 0.000 0.438 332 I N 3.627 124.237 120.570 0.066 0.000 2.330 332 I HA 0.394 4.564 4.170 0.000 0.000 0.289 332 I C -0.303 175.837 176.117 0.040 0.000 1.001 332 I CA -0.599 60.742 61.300 0.068 0.000 1.193 332 I CB 0.963 39.026 38.000 0.105 0.000 1.345 332 I HN 0.524 8.734 8.210 -0.000 0.000 0.461 333 I N 6.362 126.945 120.570 0.021 0.000 2.291 333 I HA 0.177 4.347 4.170 0.000 0.000 0.292 333 I C -0.256 175.866 176.117 0.008 0.000 1.064 333 I CA -0.149 61.157 61.300 0.010 0.000 1.269 333 I CB 0.289 38.289 38.000 0.001 0.000 1.418 333 I HN 0.584 8.794 8.210 -0.000 0.000 0.485 334 D N 5.117 125.522 120.400 0.009 0.000 3.908 334 D HA -0.117 4.523 4.640 0.000 0.000 0.237 334 D C 0.180 176.481 176.300 0.001 0.000 1.091 334 D CA 0.948 54.950 54.000 0.003 0.000 1.147 334 D CB -0.152 40.646 40.800 -0.003 0.000 0.857 334 D HN 0.751 9.121 8.370 -0.000 0.000 0.410 335 G N 0.962 109.765 108.800 0.006 0.000 2.562 335 G HA2 0.423 4.383 3.960 0.000 0.000 0.275 335 G HA3 0.423 4.383 3.960 0.000 0.000 0.275 335 G C 1.472 176.370 174.900 -0.002 0.000 1.196 335 G CA -0.168 44.934 45.100 0.004 0.000 0.908 335 G HN 0.341 8.631 8.290 -0.000 0.000 0.524 336 V N 1.549 121.460 119.914 -0.005 0.000 2.233 336 V HA 0.016 4.136 4.120 0.000 0.000 0.247 336 V C 2.134 178.228 176.094 0.000 0.000 1.050 336 V CA 1.978 64.275 62.300 -0.005 0.000 1.010 336 V CB -1.468 30.353 31.823 -0.004 0.000 0.637 336 V HN 1.507 9.697 8.190 -0.000 0.000 0.444 337 G N 1.698 110.501 108.800 0.004 0.000 2.561 337 G HA2 -0.245 3.715 3.960 0.000 0.000 0.214 337 G HA3 -0.245 3.715 3.960 0.000 0.000 0.214 337 G C -0.386 174.515 174.900 0.002 0.000 0.124 337 G CA 0.131 45.233 45.100 0.003 0.000 1.129 337 G HN 0.650 8.940 8.290 -0.000 0.000 0.532 338 E N 1.984 122.185 120.200 0.003 0.000 2.585 338 E HA 0.180 4.530 4.350 0.000 0.000 0.252 338 E C 1.218 177.818 176.600 -0.000 0.000 0.981 338 E CA 0.255 56.656 56.400 0.002 0.000 0.943 338 E CB 0.742 30.443 29.700 0.002 0.000 0.923 338 E HN 0.639 8.999 8.360 -0.000 0.000 0.486 339 E N 3.765 123.964 120.200 -0.001 0.000 2.065 339 E HA -0.284 4.066 4.350 0.000 0.000 0.201 339 E C 1.778 178.376 176.600 -0.002 0.000 1.016 339 E CA 2.050 58.449 56.400 -0.002 0.000 0.818 339 E CB -0.277 29.422 29.700 -0.002 0.000 0.749 339 E HN 0.604 8.964 8.360 -0.000 0.000 0.453 340 A N 0.399 123.217 122.820 -0.002 0.000 1.933 340 A HA -0.048 4.272 4.320 0.000 0.000 0.218 340 A C 2.397 179.978 177.584 -0.004 0.000 1.175 340 A CA 2.209 54.244 52.037 -0.003 0.000 0.628 340 A CB -0.875 18.124 19.000 -0.002 0.000 0.814 340 A HN 0.362 8.512 8.150 -0.000 0.000 0.444 341 A N -0.169 122.649 122.820 -0.003 0.000 1.969 341 A HA -0.012 4.308 4.320 0.000 0.000 0.218 341 A C 2.073 179.654 177.584 -0.006 0.000 1.169 341 A CA 1.347 53.381 52.037 -0.004 0.000 0.635 341 A CB -0.540 18.458 19.000 -0.003 0.000 0.810 341 A HN 0.504 8.654 8.150 -0.000 0.000 0.445 342 I N -0.646 119.921 120.570 -0.006 0.000 2.090 342 I HA -0.322 3.848 4.170 0.000 0.000 0.236 342 I C 2.688 178.799 176.117 -0.009 0.000 1.064 342 I CA 1.781 63.077 61.300 -0.007 0.000 1.324 342 I CB -0.487 37.510 38.000 -0.005 0.000 1.044 342 I HN 0.358 8.568 8.210 -0.000 0.000 0.399 343 Q N 0.541 120.336 119.800 -0.007 0.000 2.291 343 Q HA -0.073 4.267 4.340 0.000 0.000 0.205 343 Q C 2.238 178.233 176.000 -0.008 0.000 0.970 343 Q CA 1.234 57.032 55.803 -0.008 0.000 0.876 343 Q CB -0.304 28.430 28.738 -0.006 0.000 0.935 343 Q HN 0.645 8.915 8.270 -0.000 0.000 0.455 344 G N 0.789 109.584 108.800 -0.008 0.000 2.404 344 G HA2 -0.239 3.721 3.960 0.000 0.000 0.215 344 G HA3 -0.239 3.721 3.960 0.000 0.000 0.215 344 G C 1.464 176.358 174.900 -0.011 0.000 1.174 344 G CA 0.152 45.247 45.100 -0.009 0.000 0.780 344 G HN 0.101 8.391 8.290 -0.000 0.000 0.537 345 R N 0.208 120.701 120.500 -0.012 0.000 2.152 345 R HA 0.005 4.345 4.340 0.000 0.000 0.232 345 R C 2.552 178.841 176.300 -0.018 0.000 1.117 345 R CA 0.827 56.917 56.100 -0.016 0.000 0.981 345 R CB -0.375 29.914 30.300 -0.018 0.000 0.870 345 R HN 0.340 8.610 8.270 -0.000 0.000 0.451 346 V N 0.454 120.359 119.914 -0.016 0.000 2.283 346 V HA -0.146 3.974 4.120 0.000 0.000 0.243 346 V C 2.375 178.459 176.094 -0.016 0.000 1.039 346 V CA 1.781 64.071 62.300 -0.017 0.000 1.016 346 V CB -0.714 31.101 31.823 -0.014 0.000 0.650 346 V HN 0.365 8.555 8.190 -0.000 0.000 0.449 347 A N -1.029 121.783 122.820 -0.013 0.000 2.178 347 A HA -0.249 4.071 4.320 0.000 0.000 0.218 347 A C 2.168 179.744 177.584 -0.013 0.000 1.157 347 A CA 1.832 53.861 52.037 -0.012 0.000 0.689 347 A CB -0.425 18.569 19.000 -0.010 0.000 0.787 347 A HN 0.639 8.789 8.150 -0.000 0.000 0.465 348 Q N -0.369 119.422 119.800 -0.015 0.000 2.061 348 Q HA -0.000 4.340 4.340 0.000 0.000 0.195 348 Q C 1.865 177.853 176.000 -0.020 0.000 0.967 348 Q CA 1.044 56.838 55.803 -0.016 0.000 0.829 348 Q CB -0.125 28.603 28.738 -0.017 0.000 0.900 348 Q HN 0.676 8.946 8.270 -0.000 0.000 0.450 349 I N 0.549 121.104 120.570 -0.024 0.000 2.493 349 I HA -0.224 3.946 4.170 0.000 0.000 0.254 349 I C 2.636 178.736 176.117 -0.028 0.000 1.160 349 I CA 0.747 62.029 61.300 -0.030 0.000 1.445 349 I CB -0.302 37.677 38.000 -0.035 0.000 1.086 349 I HN 0.198 8.408 8.210 -0.000 0.000 0.433 350 R N 0.822 121.309 120.500 -0.023 0.000 2.120 350 R HA -0.205 4.135 4.340 0.000 0.000 0.234 350 R C 2.296 178.585 176.300 -0.018 0.000 1.123 350 R CA 1.325 57.413 56.100 -0.020 0.000 0.975 350 R CB -0.102 30.189 30.300 -0.016 0.000 0.866 350 R HN 0.399 8.669 8.270 -0.000 0.000 0.446 351 Q N 0.103 119.893 119.800 -0.017 0.000 2.408 351 Q HA -0.079 4.261 4.340 0.000 0.000 0.205 351 Q C 1.218 177.208 176.000 -0.016 0.000 0.919 351 Q CA 0.789 56.584 55.803 -0.014 0.000 0.932 351 Q CB 0.386 29.117 28.738 -0.012 0.000 1.058 351 Q HN 0.459 8.729 8.270 -0.000 0.000 0.517 352 Q N 0.135 119.922 119.800 -0.022 0.000 2.230 352 Q HA -0.007 4.333 4.340 0.000 0.000 0.202 352 Q C 1.985 177.967 176.000 -0.029 0.000 0.963 352 Q CA 1.126 56.914 55.803 -0.026 0.000 0.866 352 Q CB 0.110 28.829 28.738 -0.032 0.000 0.931 352 Q HN 0.451 8.721 8.270 -0.000 0.000 0.452 353 I N 0.369 120.922 120.570 -0.029 0.000 2.439 353 I HA -0.181 3.989 4.170 0.000 0.000 0.251 353 I C 2.078 178.185 176.117 -0.018 0.000 1.139 353 I CA 0.650 61.933 61.300 -0.029 0.000 1.438 353 I CB -0.236 37.747 38.000 -0.029 0.000 1.085 353 I HN 0.103 8.313 8.210 -0.000 0.000 0.427 354 E N 1.743 121.934 120.200 -0.014 0.000 2.058 354 E HA -0.227 4.123 4.350 0.000 0.000 0.194 354 E C 1.612 178.208 176.600 -0.006 0.000 0.997 354 E CA 1.585 57.980 56.400 -0.008 0.000 0.801 354 E CB -0.155 29.541 29.700 -0.008 0.000 0.746 354 E HN 0.697 9.057 8.360 -0.000 0.000 0.450 355 E N 0.148 120.344 120.200 -0.008 0.000 2.451 355 E HA 0.335 4.685 4.350 0.000 0.000 0.194 355 E C -0.074 176.523 176.600 -0.005 0.000 1.027 355 E CA -0.195 56.202 56.400 -0.004 0.000 0.914 355 E CB 0.383 30.080 29.700 -0.004 0.000 1.054 355 E HN -0.046 8.314 8.360 -0.000 0.000 0.461 356 A N 1.849 124.663 122.820 -0.009 0.000 2.484 356 A HA 0.124 4.444 4.320 0.000 0.000 0.268 356 A C 1.105 178.690 177.584 0.002 0.000 1.114 356 A CA -0.081 51.949 52.037 -0.011 0.000 0.780 356 A CB -0.094 18.891 19.000 -0.024 0.000 1.061 356 A HN 0.307 8.457 8.150 -0.000 0.000 0.505 357 T N 0.145 114.704 114.554 0.009 0.000 3.380 357 T HA 0.329 4.679 4.350 0.000 0.000 0.250 357 T C 0.676 175.393 174.700 0.029 0.000 1.082 357 T CA 0.390 62.501 62.100 0.018 0.000 0.968 357 T CB -1.066 67.813 68.868 0.019 0.000 1.027 357 T HN 1.193 9.433 8.240 -0.000 0.000 0.575 358 S N -0.566 115.153 115.700 0.032 0.000 3.319 358 S HA 0.347 4.817 4.470 0.000 0.000 0.310 358 S C -0.591 174.038 174.600 0.048 0.000 1.223 358 S CA -0.600 57.628 58.200 0.047 0.000 1.189 358 S CB 0.529 63.773 63.200 0.074 0.000 1.514 358 S HN 0.029 8.339 8.310 -0.000 0.000 0.554 359 D N -0.695 119.750 120.400 0.074 0.000 2.514 359 D HA 0.185 4.825 4.640 0.000 0.000 0.249 359 D C 1.412 177.774 176.300 0.103 0.000 1.036 359 D CA 0.492 54.537 54.000 0.074 0.000 0.911 359 D CB -0.068 40.778 40.800 0.077 0.000 1.145 359 D HN 0.451 8.821 8.370 -0.000 0.000 0.495 360 Y N 2.468 122.779 120.300 0.019 0.000 2.263 360 Y HA -0.089 4.461 4.550 0.000 0.000 0.292 360 Y C 1.380 177.295 175.900 0.024 0.000 1.130 360 Y CA 1.329 59.443 58.100 0.024 0.000 1.179 360 Y CB -0.041 38.435 38.460 0.027 0.000 0.998 360 Y HN -0.208 8.072 8.280 -0.000 0.000 0.532 361 D N -0.079 120.244 120.400 -0.128 0.000 2.392 361 D HA -0.067 4.573 4.640 0.000 0.000 0.228 361 D C 1.759 177.974 176.300 -0.141 0.000 1.003 361 D CA 0.671 54.556 54.000 -0.190 0.000 0.917 361 D CB 0.022 40.789 40.800 -0.056 0.000 0.890 361 D HN 0.483 8.853 8.370 -0.000 0.000 0.532 362 R N -0.042 120.396 120.500 -0.102 0.000 2.164 362 R HA 0.063 4.403 4.340 0.000 0.000 0.198 362 R C 1.888 178.144 176.300 -0.073 0.000 1.028 362 R CA 0.124 56.185 56.100 -0.065 0.000 1.083 362 R CB 0.472 30.759 30.300 -0.021 0.000 1.026 362 R HN 0.037 8.307 8.270 -0.000 0.000 0.514 363 E N 1.500 121.658 120.200 -0.071 0.000 2.005 363 E HA -0.251 4.099 4.350 0.000 0.000 0.198 363 E C 1.763 178.318 176.600 -0.074 0.000 1.010 363 E CA 2.031 58.407 56.400 -0.040 0.000 0.825 363 E CB -0.055 29.664 29.700 0.032 0.000 0.769 363 E HN 0.261 8.621 8.360 -0.000 0.000 0.456 364 K N 0.855 121.161 120.400 -0.156 0.000 2.211 364 K HA -0.148 4.172 4.320 0.000 0.000 0.204 364 K C 2.027 178.555 176.600 -0.120 0.000 1.047 364 K CA 1.136 57.336 56.287 -0.145 0.000 0.935 364 K CB -0.129 32.219 32.500 -0.252 0.000 0.728 364 K HN 0.024 8.274 8.250 -0.000 0.000 0.452 365 L N 2.352 123.498 121.223 -0.128 0.000 2.005 365 L HA -0.166 4.174 4.340 0.000 0.000 0.207 365 L C 2.928 179.760 176.870 -0.063 0.000 1.072 365 L CA 2.148 56.932 54.840 -0.094 0.000 0.744 365 L CB -1.367 40.639 42.059 -0.089 0.000 0.895 365 L HN 0.571 8.801 8.230 -0.000 0.000 0.433 366 Q N -0.518 119.250 119.800 -0.053 0.000 2.291 366 Q HA -0.200 4.140 4.340 0.000 0.000 0.205 366 Q C 1.566 177.547 176.000 -0.031 0.000 0.970 366 Q CA 1.162 56.942 55.803 -0.037 0.000 0.876 366 Q CB -0.262 28.457 28.738 -0.032 0.000 0.935 366 Q HN 0.535 8.805 8.270 -0.000 0.000 0.455 367 E N 1.195 121.376 120.200 -0.033 0.000 2.051 367 E HA -0.148 4.202 4.350 0.000 0.000 0.192 367 E C 2.143 178.729 176.600 -0.022 0.000 0.991 367 E CA 1.210 57.597 56.400 -0.021 0.000 0.799 367 E CB 0.058 29.748 29.700 -0.017 0.000 0.748 367 E HN 0.364 8.724 8.360 -0.000 0.000 0.449 368 R N 0.256 120.733 120.500 -0.038 0.000 2.092 368 R HA -0.109 4.231 4.340 0.000 0.000 0.231 368 R C 2.639 178.921 176.300 -0.031 0.000 1.119 368 R CA 1.215 57.291 56.100 -0.040 0.000 0.970 368 R CB -0.386 29.878 30.300 -0.059 0.000 0.864 368 R HN 0.205 8.475 8.270 -0.000 0.000 0.440 369 V N -1.476 118.420 119.914 -0.030 0.000 2.427 369 V HA -0.085 4.035 4.120 0.000 0.000 0.248 369 V C 2.085 178.169 176.094 -0.016 0.000 1.051 369 V CA 1.855 64.141 62.300 -0.023 0.000 1.048 369 V CB -0.638 31.171 31.823 -0.024 0.000 0.666 369 V HN 0.247 8.437 8.190 -0.000 0.000 0.456 370 A N 0.369 123.181 122.820 -0.013 0.000 1.929 370 A HA -0.078 4.242 4.320 0.000 0.000 0.216 370 A C 2.278 179.862 177.584 -0.000 0.000 1.176 370 A CA 1.732 53.765 52.037 -0.007 0.000 0.628 370 A CB -0.529 18.467 19.000 -0.006 0.000 0.816 370 A HN 0.613 8.763 8.150 -0.000 0.000 0.444 371 K N -0.505 119.896 120.400 0.002 0.000 2.097 371 K HA -0.026 4.294 4.320 0.000 0.000 0.206 371 K C 1.626 178.232 176.600 0.009 0.000 1.049 371 K CA 1.363 57.658 56.287 0.013 0.000 0.933 371 K CB -0.259 32.250 32.500 0.015 0.000 0.717 371 K HN 0.465 8.715 8.250 -0.000 0.000 0.442 372 L N -0.526 120.696 121.223 -0.002 0.000 2.298 372 L HA 0.048 4.388 4.340 0.000 0.000 0.209 372 L C 2.076 178.943 176.870 -0.003 0.000 1.084 372 L CA 0.341 55.178 54.840 -0.005 0.000 0.816 372 L CB -0.164 41.887 42.059 -0.013 0.000 0.967 372 L HN 0.129 8.359 8.230 -0.000 0.000 0.460 373 A N 0.125 122.942 122.820 -0.005 0.000 2.712 373 A HA 0.399 4.719 4.320 0.000 0.000 0.211 373 A C 1.645 179.228 177.584 -0.002 0.000 1.877 373 A CA 0.712 52.746 52.037 -0.005 0.000 0.686 373 A CB -1.315 17.680 19.000 -0.007 0.000 1.308 373 A HN 0.245 8.395 8.150 -0.000 0.000 0.498 374 G N -1.391 107.408 108.800 -0.002 0.000 3.048 374 G HA2 0.443 4.404 3.960 0.000 0.000 0.151 374 G HA3 0.443 4.404 3.960 0.000 0.000 0.151 374 G C 0.444 175.345 174.900 0.002 0.000 1.803 374 G CA 0.409 45.509 45.100 -0.001 0.000 1.047 374 G HN 1.213 9.503 8.290 -0.000 0.000 0.513 375 G N -2.581 106.220 108.800 0.001 0.000 2.949 375 G HA2 0.520 4.480 3.960 0.000 0.000 0.285 375 G HA3 0.520 4.480 3.960 0.000 0.000 0.285 375 G C -1.952 172.950 174.900 0.004 0.000 1.395 375 G CA -0.327 44.775 45.100 0.004 0.000 0.901 375 G HN 0.680 8.970 8.290 -0.000 0.000 0.519 376 V N -0.076 119.841 119.914 0.006 0.000 2.604 376 V HA 0.782 4.902 4.120 0.000 0.000 0.305 376 V C -0.034 176.062 176.094 0.005 0.000 1.043 376 V CA -0.390 61.914 62.300 0.006 0.000 0.888 376 V CB 1.458 33.288 31.823 0.011 0.000 0.995 376 V HN 1.250 9.440 8.190 -0.000 0.000 0.429 377 A N 4.521 127.344 122.820 0.004 0.000 2.386 377 A HA 0.920 5.240 4.320 0.000 0.000 0.311 377 A C -1.246 176.342 177.584 0.007 0.000 1.068 377 A CA -0.562 51.478 52.037 0.004 0.000 0.743 377 A CB 1.972 20.974 19.000 0.003 0.000 1.258 377 A HN 0.668 8.818 8.150 -0.000 0.000 0.429 378 V N 2.941 122.859 119.914 0.006 0.000 2.487 378 V HA 0.393 4.513 4.120 0.000 0.000 0.298 378 V C -0.390 175.709 176.094 0.009 0.000 1.028 378 V CA -0.231 62.074 62.300 0.009 0.000 0.860 378 V CB 1.504 33.332 31.823 0.008 0.000 0.991 378 V HN 0.759 8.949 8.190 -0.000 0.000 0.427 379 I N 4.675 125.252 120.570 0.012 0.000 2.315 379 I HA 0.376 4.546 4.170 0.000 0.000 0.291 379 I C 0.175 176.299 176.117 0.012 0.000 1.006 379 I CA -0.359 60.949 61.300 0.012 0.000 1.265 379 I CB 1.127 39.136 38.000 0.015 0.000 1.387 379 I HN 0.504 8.714 8.210 -0.000 0.000 0.475 380 K N 5.886 126.291 120.400 0.009 0.000 2.240 380 K HA 0.492 4.813 4.320 0.000 0.000 0.271 380 K C -0.964 175.641 176.600 0.008 0.000 1.018 380 K CA -0.625 55.666 56.287 0.008 0.000 0.874 380 K CB 1.957 34.460 32.500 0.005 0.000 1.098 380 K HN 0.310 8.560 8.250 -0.000 0.000 0.458 381 V N 2.191 122.111 119.914 0.009 0.000 2.465 381 V HA 0.373 4.493 4.120 0.000 0.000 0.279 381 V C 0.704 176.801 176.094 0.006 0.000 1.045 381 V CA -0.858 61.447 62.300 0.008 0.000 0.938 381 V CB 1.340 33.169 31.823 0.010 0.000 0.986 381 V HN 0.894 9.084 8.190 -0.000 0.000 0.467 382 G N 2.630 111.433 108.800 0.004 0.000 2.389 382 G HA2 0.787 4.747 3.960 0.000 0.000 0.328 382 G HA3 0.787 4.747 3.960 0.000 0.000 0.328 382 G C -0.560 174.341 174.900 0.003 0.000 1.133 382 G CA -0.011 45.091 45.100 0.003 0.000 0.891 382 G HN 1.248 9.538 8.290 -0.000 0.000 0.485 383 A N 0.169 122.990 122.820 0.002 0.000 2.610 383 A HA 0.799 5.119 4.320 0.000 0.000 0.291 383 A C 0.713 178.298 177.584 0.001 0.000 1.086 383 A CA 0.297 52.335 52.037 0.002 0.000 0.677 383 A CB 0.841 19.842 19.000 0.002 0.000 1.278 383 A HN 1.706 9.856 8.150 -0.000 0.000 0.414 384 A N -0.006 122.814 122.820 0.000 0.000 1.874 384 A HA 0.348 4.668 4.320 0.000 0.000 0.214 384 A C 1.542 179.127 177.584 0.000 0.000 1.189 384 A CA 2.506 54.543 52.037 0.000 0.000 0.615 384 A CB -0.870 18.129 19.000 -0.001 0.000 0.830 384 A HN 1.733 9.883 8.150 -0.000 0.000 0.443 385 T N -4.179 110.375 114.554 0.000 0.000 2.850 385 T HA 0.486 4.837 4.350 0.000 0.000 0.269 385 T C 0.742 175.443 174.700 0.002 0.000 1.075 385 T CA 0.225 62.325 62.100 0.001 0.000 0.987 385 T CB 1.109 69.977 68.868 -0.001 0.000 1.889 385 T HN 0.192 8.432 8.240 -0.000 0.000 0.584 386 E N -0.493 119.708 120.200 0.002 0.000 2.421 386 E HA 0.104 4.454 4.350 0.000 0.000 0.209 386 E C 2.152 178.754 176.600 0.004 0.000 0.871 386 E CA 0.345 56.747 56.400 0.004 0.000 1.064 386 E CB 0.436 30.140 29.700 0.006 0.000 1.075 386 E HN 0.513 8.873 8.360 -0.000 0.000 0.513 387 V N -0.459 119.456 119.914 0.002 0.000 2.626 387 V HA -0.152 3.968 4.120 0.000 0.000 0.252 387 V C 2.040 178.134 176.094 0.001 0.000 1.067 387 V CA 1.959 64.259 62.300 0.001 0.000 1.081 387 V CB -0.487 31.334 31.823 -0.003 0.000 0.686 387 V HN 0.149 8.339 8.190 -0.000 0.000 0.468 388 E N 0.011 120.211 120.200 0.001 0.000 2.046 388 E HA -0.204 4.146 4.350 0.000 0.000 0.190 388 E C 2.119 178.720 176.600 0.002 0.000 0.982 388 E CA 1.362 57.762 56.400 0.001 0.000 0.800 388 E CB -0.203 29.497 29.700 0.000 0.000 0.756 388 E HN 0.506 8.866 8.360 -0.000 0.000 0.449 389 M N 1.263 120.866 119.600 0.004 0.000 2.082 389 M HA -0.205 4.275 4.480 0.000 0.000 0.258 389 M C 1.785 178.088 176.300 0.006 0.000 1.069 389 M CA 1.767 57.071 55.300 0.005 0.000 1.102 389 M CB -0.037 32.566 32.600 0.006 0.000 1.336 389 M HN -0.084 8.206 8.290 -0.000 0.000 0.404 390 K N -0.496 119.908 120.400 0.007 0.000 2.026 390 K HA -0.218 4.102 4.320 0.000 0.000 0.208 390 K C 1.982 178.585 176.600 0.005 0.000 1.048 390 K CA 1.913 58.205 56.287 0.008 0.000 0.929 390 K CB -0.353 32.153 32.500 0.010 0.000 0.713 390 K HN 0.562 8.812 8.250 -0.000 0.000 0.439 391 E N 1.636 121.837 120.200 0.003 0.000 2.072 391 E HA -0.208 4.142 4.350 0.000 0.000 0.191 391 E C 1.914 178.514 176.600 0.001 0.000 0.985 391 E CA 1.583 57.983 56.400 0.001 0.000 0.801 391 E CB -0.005 29.694 29.700 -0.001 0.000 0.750 391 E HN 0.058 8.418 8.360 -0.000 0.000 0.452 392 K N 0.930 121.331 120.400 0.002 0.000 2.001 392 K HA -0.117 4.203 4.320 0.000 0.000 0.208 392 K C 2.199 178.802 176.600 0.006 0.000 1.048 392 K CA 1.792 58.081 56.287 0.003 0.000 0.932 392 K CB -0.206 32.296 32.500 0.004 0.000 0.715 392 K HN 0.092 8.342 8.250 -0.000 0.000 0.437 393 K N -0.217 120.187 120.400 0.007 0.000 2.074 393 K HA -0.188 4.132 4.320 0.000 0.000 0.209 393 K C 1.929 178.535 176.600 0.009 0.000 1.048 393 K CA 1.520 57.814 56.287 0.011 0.000 0.926 393 K CB -0.312 32.195 32.500 0.012 0.000 0.713 393 K HN 0.277 8.527 8.250 -0.000 0.000 0.444 394 A N 1.033 123.854 122.820 0.003 0.000 1.978 394 A HA -0.172 4.148 4.320 0.000 0.000 0.220 394 A C 2.067 179.645 177.584 -0.010 0.000 1.170 394 A CA 1.459 53.492 52.037 -0.007 0.000 0.636 394 A CB -0.375 18.620 19.000 -0.009 0.000 0.810 394 A HN 0.315 8.465 8.150 -0.000 0.000 0.448 395 R N -0.882 119.617 120.500 -0.002 0.000 2.062 395 R HA -0.021 4.319 4.340 0.000 0.000 0.226 395 R C 2.061 178.367 176.300 0.010 0.000 1.125 395 R CA 1.286 57.386 56.100 -0.000 0.000 0.966 395 R CB -0.397 29.904 30.300 0.001 0.000 0.861 395 R HN 0.384 8.654 8.270 -0.000 0.000 0.433 396 V N 1.540 121.464 119.914 0.015 0.000 2.332 396 V HA -0.242 3.878 4.120 0.000 0.000 0.248 396 V C 2.187 178.309 176.094 0.046 0.000 1.055 396 V CA 1.706 64.023 62.300 0.027 0.000 1.038 396 V CB -0.467 31.370 31.823 0.024 0.000 0.651 396 V HN 0.308 8.498 8.190 -0.000 0.000 0.450 397 E N 0.124 120.349 120.200 0.042 0.000 2.085 397 E HA -0.257 4.093 4.350 0.000 0.000 0.194 397 E C 1.989 178.632 176.600 0.073 0.000 0.994 397 E CA 1.770 58.213 56.400 0.071 0.000 0.801 397 E CB -0.280 29.434 29.700 0.024 0.000 0.743 397 E HN 0.656 9.016 8.360 -0.000 0.000 0.453 398 D N 0.254 120.650 120.400 -0.007 0.000 2.078 398 D HA -0.117 4.523 4.640 0.000 0.000 0.193 398 D C 1.873 178.206 176.300 0.054 0.000 0.990 398 D CA 1.794 55.776 54.000 -0.031 0.000 0.827 398 D CB -0.187 40.594 40.800 -0.031 0.000 0.975 398 D HN 0.165 8.535 8.370 -0.000 0.000 0.451 399 A N 0.702 123.553 122.820 0.052 0.000 1.908 399 A HA -0.157 4.163 4.320 0.000 0.000 0.218 399 A C 2.154 179.789 177.584 0.084 0.000 1.181 399 A CA 0.895 52.966 52.037 0.057 0.000 0.627 399 A CB -0.840 18.182 19.000 0.037 0.000 0.818 399 A HN 0.314 8.464 8.150 -0.000 0.000 0.445 400 L N -0.857 120.430 121.223 0.107 0.000 2.081 400 L HA -0.246 4.094 4.340 0.000 0.000 0.212 400 L C 2.351 179.284 176.870 0.105 0.000 1.080 400 L CA 2.623 57.524 54.840 0.102 0.000 0.754 400 L CB -1.039 41.088 42.059 0.113 0.000 0.893 400 L HN 0.546 8.776 8.230 -0.000 0.000 0.433 401 H N -0.783 118.296 119.070 0.015 0.000 2.363 401 H HA 0.031 4.587 4.556 0.000 0.000 0.301 401 H C 2.177 177.515 175.328 0.018 0.000 1.074 401 H CA 1.433 57.492 56.048 0.018 0.000 1.354 401 H CB -0.135 29.640 29.762 0.021 0.000 1.397 401 H HN 0.408 8.688 8.280 -0.000 0.000 0.516 402 A N 0.209 123.122 122.820 0.155 0.000 1.930 402 A HA -0.189 4.131 4.320 0.000 0.000 0.217 402 A C 2.469 180.086 177.584 0.055 0.000 1.175 402 A CA 2.097 54.187 52.037 0.089 0.000 0.627 402 A CB -1.052 17.986 19.000 0.065 0.000 0.815 402 A HN 0.611 8.761 8.150 -0.000 0.000 0.443 403 T N -1.972 112.609 114.554 0.046 0.000 2.708 403 T HA -0.157 4.193 4.350 0.000 0.000 0.266 403 T C 1.933 176.642 174.700 0.015 0.000 1.037 403 T CA 1.150 63.266 62.100 0.026 0.000 1.146 403 T CB -0.427 68.454 68.868 0.020 0.000 0.865 403 T HN 0.448 8.688 8.240 -0.000 0.000 0.435 404 R N 1.334 121.838 120.500 0.006 0.000 2.159 404 R HA 0.100 4.440 4.340 0.000 0.000 0.237 404 R C 2.809 179.108 176.300 -0.002 0.000 1.131 404 R CA 1.243 57.334 56.100 -0.015 0.000 0.982 404 R CB -0.705 29.560 30.300 -0.057 0.000 0.868 404 R HN 0.605 8.875 8.270 -0.000 0.000 0.453 405 A N 0.955 123.785 122.820 0.017 0.000 1.898 405 A HA 0.042 4.362 4.320 0.000 0.000 0.214 405 A C 2.353 179.948 177.584 0.019 0.000 1.183 405 A CA 1.238 53.290 52.037 0.025 0.000 0.622 405 A CB -0.348 18.678 19.000 0.044 0.000 0.824 405 A HN 0.324 8.474 8.150 -0.000 0.000 0.444 406 A N -0.426 122.405 122.820 0.019 0.000 1.902 406 A HA -0.011 4.309 4.320 0.000 0.000 0.217 406 A C 2.200 179.789 177.584 0.009 0.000 1.181 406 A CA 1.761 53.807 52.037 0.015 0.000 0.623 406 A CB -0.938 18.071 19.000 0.015 0.000 0.818 406 A HN 0.358 8.508 8.150 -0.000 0.000 0.443 407 V N 1.137 121.055 119.914 0.007 0.000 2.407 407 V HA -0.275 3.845 4.120 0.000 0.000 0.248 407 V C 2.526 178.622 176.094 0.002 0.000 1.055 407 V CA 2.362 64.664 62.300 0.003 0.000 1.049 407 V CB -0.825 30.998 31.823 -0.001 0.000 0.662 407 V HN 0.932 9.122 8.190 -0.000 0.000 0.455 408 E N -0.472 119.730 120.200 0.003 0.000 2.385 408 E HA -0.092 4.258 4.350 0.000 0.000 0.194 408 E C 1.596 178.198 176.600 0.004 0.000 1.013 408 E CA 1.009 57.411 56.400 0.002 0.000 0.866 408 E CB 0.118 29.819 29.700 0.001 0.000 0.832 408 E HN 0.662 9.022 8.360 -0.000 0.000 0.500 409 E N -0.153 120.051 120.200 0.006 0.000 2.703 409 E HA 0.201 4.551 4.350 0.000 0.000 0.214 409 E C 0.011 176.614 176.600 0.006 0.000 0.944 409 E CA 0.189 56.593 56.400 0.006 0.000 1.299 409 E CB 1.306 31.010 29.700 0.007 0.000 1.189 409 E HN 0.330 8.690 8.360 -0.000 0.000 0.597 410 G N 0.744 109.549 108.800 0.007 0.000 2.728 410 G HA2 -0.189 3.772 3.960 0.000 0.000 0.294 410 G HA3 -0.189 3.772 3.960 0.000 0.000 0.294 410 G C -0.418 174.488 174.900 0.010 0.000 1.342 410 G CA -0.444 44.660 45.100 0.008 0.000 0.866 410 G HN 0.593 8.883 8.290 -0.000 0.000 0.534 411 V N -2.565 117.355 119.914 0.010 0.000 3.074 411 V HA 0.997 5.117 4.120 0.000 0.000 0.314 411 V C 0.592 176.694 176.094 0.012 0.000 1.117 411 V CA 0.160 62.467 62.300 0.012 0.000 1.014 411 V CB 1.407 33.238 31.823 0.012 0.000 1.057 411 V HN 2.514 10.704 8.190 -0.000 0.000 0.438 412 V N -1.076 118.846 119.914 0.014 0.000 3.167 412 V HA 1.002 5.122 4.120 0.000 0.000 0.310 412 V C 0.366 176.470 176.094 0.017 0.000 1.207 412 V CA -0.722 61.587 62.300 0.016 0.000 1.059 412 V CB 1.295 33.127 31.823 0.015 0.000 1.079 412 V HN 2.129 10.319 8.190 -0.000 0.000 0.446 413 A N 1.068 123.901 122.820 0.021 0.000 2.522 413 A HA 0.631 4.951 4.320 0.000 0.000 0.256 413 A C 0.918 178.515 177.584 0.020 0.000 1.086 413 A CA 0.624 52.675 52.037 0.023 0.000 0.763 413 A CB -0.707 18.312 19.000 0.032 0.000 1.024 413 A HN 2.007 10.157 8.150 -0.000 0.000 0.502 414 G N 1.113 109.922 108.800 0.015 0.000 2.525 414 G HA2 0.492 4.452 3.960 0.000 0.000 0.276 414 G HA3 0.492 4.452 3.960 0.000 0.000 0.276 414 G C 1.221 176.131 174.900 0.016 0.000 1.388 414 G CA 0.035 45.143 45.100 0.013 0.000 1.050 414 G HN 2.254 10.544 8.290 -0.000 0.000 0.520 415 G N -2.210 106.600 108.800 0.017 0.000 2.168 415 G HA2 0.189 4.149 3.960 0.000 0.000 0.257 415 G HA3 0.189 4.149 3.960 0.000 0.000 0.257 415 G C 1.517 176.439 174.900 0.036 0.000 0.997 415 G CA 1.134 46.251 45.100 0.029 0.000 0.708 415 G HN 2.504 10.794 8.290 -0.000 0.000 0.520 416 G N -2.077 106.740 108.800 0.028 0.000 2.203 416 G HA2 -0.093 3.867 3.960 0.000 0.000 0.263 416 G HA3 -0.093 3.867 3.960 0.000 0.000 0.263 416 G C 1.756 176.675 174.900 0.031 0.000 1.012 416 G CA 1.806 46.922 45.100 0.027 0.000 0.749 416 G HN 2.129 10.419 8.290 -0.000 0.000 0.512 417 V N -0.517 119.418 119.914 0.034 0.000 2.379 417 V HA 0.208 4.328 4.120 0.000 0.000 0.245 417 V C 2.921 179.037 176.094 0.036 0.000 1.044 417 V CA 2.391 64.716 62.300 0.040 0.000 1.036 417 V CB -0.639 31.211 31.823 0.046 0.000 0.664 417 V HN 1.476 9.666 8.190 -0.000 0.000 0.453 418 A N 0.410 123.248 122.820 0.030 0.000 1.896 418 A HA -0.273 4.047 4.320 0.000 0.000 0.220 418 A C 2.178 179.775 177.584 0.022 0.000 1.206 418 A CA 2.682 54.735 52.037 0.025 0.000 0.647 418 A CB -1.028 17.984 19.000 0.020 0.000 0.828 418 A HN 0.572 8.722 8.150 -0.000 0.000 0.455 419 L N -1.025 120.210 121.223 0.020 0.000 2.042 419 L HA -0.115 4.225 4.340 0.000 0.000 0.210 419 L C 2.396 179.278 176.870 0.019 0.000 1.076 419 L CA 1.734 56.584 54.840 0.017 0.000 0.749 419 L CB -0.672 41.396 42.059 0.015 0.000 0.893 419 L HN 0.444 8.674 8.230 -0.000 0.000 0.432 420 I N -1.400 119.185 120.570 0.025 0.000 2.335 420 I HA -0.296 3.874 4.170 0.000 0.000 0.251 420 I C 2.454 178.588 176.117 0.028 0.000 1.129 420 I CA 0.840 62.157 61.300 0.027 0.000 1.402 420 I CB -0.125 37.896 38.000 0.035 0.000 1.069 420 I HN 0.183 8.393 8.210 -0.000 0.000 0.424 421 R N -0.098 120.421 120.500 0.030 0.000 2.062 421 R HA -0.070 4.270 4.340 0.000 0.000 0.229 421 R C 2.327 178.640 176.300 0.021 0.000 1.128 421 R CA 1.690 57.808 56.100 0.030 0.000 0.960 421 R CB -1.319 29.001 30.300 0.034 0.000 0.855 421 R HN 0.440 8.710 8.270 -0.000 0.000 0.432 422 V N -0.730 119.194 119.914 0.017 0.000 2.515 422 V HA -0.013 4.107 4.120 0.000 0.000 0.250 422 V C 2.047 178.147 176.094 0.010 0.000 1.058 422 V CA 1.762 64.069 62.300 0.012 0.000 1.064 422 V CB -0.803 31.025 31.823 0.008 0.000 0.675 422 V HN 0.184 8.374 8.190 -0.000 0.000 0.461 423 A N 1.620 124.447 122.820 0.012 0.000 1.940 423 A HA -0.185 4.135 4.320 0.000 0.000 0.219 423 A C 2.553 180.143 177.584 0.010 0.000 1.176 423 A CA 2.764 54.807 52.037 0.010 0.000 0.631 423 A CB -1.022 17.985 19.000 0.012 0.000 0.814 423 A HN 1.008 9.158 8.150 -0.000 0.000 0.446 424 S N -0.459 115.248 115.700 0.012 0.000 2.446 424 S HA -0.018 4.452 4.470 0.000 0.000 0.225 424 S C 1.707 176.312 174.600 0.008 0.000 1.016 424 S CA 0.876 59.083 58.200 0.011 0.000 0.943 424 S CB -0.205 63.003 63.200 0.013 0.000 0.786 424 S HN 0.614 8.924 8.310 -0.000 0.000 0.508 425 K N 1.306 121.712 120.400 0.009 0.000 2.147 425 K HA 0.111 4.431 4.320 0.000 0.000 0.205 425 K C 1.198 177.801 176.600 0.005 0.000 1.049 425 K CA 0.948 57.239 56.287 0.007 0.000 0.936 425 K CB -0.410 32.094 32.500 0.007 0.000 0.722 425 K HN 0.426 8.676 8.250 -0.000 0.000 0.446 426 L N 0.429 121.655 121.223 0.005 0.000 2.685 426 L HA 0.196 4.536 4.340 0.000 0.000 0.233 426 L C 1.865 178.737 176.870 0.004 0.000 1.173 426 L CA -0.380 54.463 54.840 0.004 0.000 0.961 426 L CB -0.094 41.967 42.059 0.003 0.000 1.217 426 L HN 0.043 8.273 8.230 -0.000 0.000 0.478 427 A N -0.051 122.772 122.820 0.004 0.000 2.076 427 A HA -0.191 4.129 4.320 0.000 0.000 0.220 427 A C 1.462 179.047 177.584 0.002 0.000 1.160 427 A CA 1.665 53.704 52.037 0.003 0.000 0.653 427 A CB -0.197 18.805 19.000 0.003 0.000 0.801 427 A HN 0.355 8.505 8.150 -0.000 0.000 0.455 428 D N -1.321 119.081 120.400 0.002 0.000 2.440 428 D HA 0.225 4.865 4.640 0.000 0.000 0.216 428 D C -0.304 175.997 176.300 0.002 0.000 1.150 428 D CA -0.299 53.702 54.000 0.002 0.000 0.832 428 D CB 0.131 40.932 40.800 0.001 0.000 0.992 428 D HN 0.262 8.632 8.370 -0.000 0.000 0.502 429 L N 1.693 122.917 121.223 0.002 0.000 2.410 429 L HA 0.192 4.532 4.340 0.000 0.000 0.273 429 L C 0.288 177.159 176.870 0.002 0.000 1.152 429 L CA 0.493 55.334 54.840 0.002 0.000 0.855 429 L CB 0.161 42.221 42.059 0.002 0.000 1.129 429 L HN -0.194 8.036 8.230 -0.000 0.000 0.463 430 R N 2.734 123.235 120.500 0.002 0.000 2.888 430 R HA 0.732 5.072 4.340 0.000 0.000 0.264 430 R C -0.280 176.021 176.300 0.002 0.000 1.045 430 R CA -0.512 55.590 56.100 0.002 0.000 0.962 430 R CB 1.564 31.865 30.300 0.002 0.000 1.210 430 R HN 0.782 9.052 8.270 -0.000 0.000 0.479 431 G N -0.416 108.385 108.800 0.003 0.000 3.107 431 G HA2 0.202 4.162 3.960 0.000 0.000 0.232 431 G HA3 0.202 4.162 3.960 0.000 0.000 0.232 431 G C 0.043 174.945 174.900 0.003 0.000 1.339 431 G CA -0.308 44.794 45.100 0.003 0.000 1.033 431 G HN 0.429 8.719 8.290 -0.000 0.000 0.567 432 Q N -0.111 119.691 119.800 0.003 0.000 2.378 432 Q HA 0.091 4.431 4.340 0.000 0.000 0.205 432 Q C 0.504 176.505 176.000 0.003 0.000 0.954 432 Q CA 0.694 56.499 55.803 0.003 0.000 0.901 432 Q CB 0.027 28.767 28.738 0.003 0.000 0.981 432 Q HN 0.601 8.871 8.270 -0.000 0.000 0.483 433 N N -1.785 116.917 118.700 0.003 0.000 3.179 433 N HA -0.033 4.707 4.740 0.000 0.000 0.250 433 N C 0.035 175.546 175.510 0.003 0.000 1.507 433 N CA -0.275 52.777 53.050 0.003 0.000 0.883 433 N CB 0.993 39.481 38.487 0.003 0.000 1.435 433 N HN -0.239 8.141 8.380 -0.000 0.000 0.532 434 E N 0.271 120.473 120.200 0.003 0.000 2.110 434 E HA -0.117 4.233 4.350 0.000 0.000 0.193 434 E C 0.605 177.207 176.600 0.003 0.000 0.988 434 E CA 1.806 58.208 56.400 0.003 0.000 0.804 434 E CB -0.294 29.407 29.700 0.002 0.000 0.745 434 E HN 0.526 8.886 8.360 -0.000 0.000 0.458 435 D N 0.135 120.538 120.400 0.004 0.000 2.144 435 D HA -0.154 4.486 4.640 0.000 0.000 0.199 435 D C 1.856 178.159 176.300 0.005 0.000 0.984 435 D CA 0.942 54.945 54.000 0.004 0.000 0.834 435 D CB -0.223 40.580 40.800 0.005 0.000 0.955 435 D HN 0.383 8.753 8.370 -0.000 0.000 0.465 436 Q N 0.081 119.884 119.800 0.005 0.000 2.226 436 Q HA -0.106 4.234 4.340 0.000 0.000 0.204 436 Q C 1.666 177.668 176.000 0.004 0.000 0.975 436 Q CA 0.685 56.490 55.803 0.005 0.000 0.866 436 Q CB -0.014 28.727 28.738 0.005 0.000 0.915 436 Q HN 0.266 8.536 8.270 -0.000 0.000 0.440 437 N N 0.120 118.822 118.700 0.004 0.000 2.106 437 N HA -0.107 4.633 4.740 0.000 0.000 0.188 437 N C 1.887 177.399 175.510 0.004 0.000 1.029 437 N CA 0.924 53.976 53.050 0.003 0.000 0.848 437 N CB -0.413 38.075 38.487 0.003 0.000 1.007 437 N HN 0.014 8.394 8.380 -0.000 0.000 0.423 438 V N 0.991 120.907 119.914 0.004 0.000 2.392 438 V HA -0.180 3.940 4.120 0.000 0.000 0.249 438 V C 2.368 178.465 176.094 0.005 0.000 1.059 438 V CA 2.013 64.315 62.300 0.004 0.000 1.051 438 V CB -1.277 30.548 31.823 0.004 0.000 0.658 438 V HN 0.370 8.560 8.190 -0.000 0.000 0.455 439 G N -0.209 108.594 108.800 0.005 0.000 2.418 439 G HA2 -0.225 3.735 3.960 0.000 0.000 0.217 439 G HA3 -0.225 3.735 3.960 0.000 0.000 0.217 439 G C 1.563 176.467 174.900 0.006 0.000 1.158 439 G CA 1.085 46.189 45.100 0.006 0.000 0.771 439 G HN 0.500 8.790 8.290 -0.000 0.000 0.545 440 I N 0.001 120.574 120.570 0.005 0.000 2.163 440 I HA -0.086 4.084 4.170 0.000 0.000 0.240 440 I C 2.744 178.863 176.117 0.005 0.000 1.081 440 I CA 1.059 62.362 61.300 0.004 0.000 1.353 440 I CB -0.100 37.902 38.000 0.004 0.000 1.054 440 I HN -0.030 8.180 8.210 -0.000 0.000 0.407 441 K N 0.594 120.997 120.400 0.004 0.000 2.113 441 K HA -0.133 4.187 4.320 0.000 0.000 0.208 441 K C 1.944 178.547 176.600 0.005 0.000 1.047 441 K CA 1.053 57.343 56.287 0.004 0.000 0.928 441 K CB -0.739 31.763 32.500 0.004 0.000 0.716 441 K HN 0.120 8.370 8.250 -0.000 0.000 0.446 442 V N 0.517 120.434 119.914 0.006 0.000 2.287 442 V HA -0.306 3.814 4.120 0.000 0.000 0.248 442 V C 2.191 178.289 176.094 0.007 0.000 1.053 442 V CA 2.132 64.436 62.300 0.007 0.000 1.027 442 V CB -0.760 31.067 31.823 0.007 0.000 0.646 442 V HN 0.403 8.593 8.190 -0.000 0.000 0.447 443 A N -0.375 122.449 122.820 0.007 0.000 1.902 443 A HA -0.159 4.161 4.320 0.000 0.000 0.217 443 A C 2.177 179.765 177.584 0.007 0.000 1.181 443 A CA 1.885 53.927 52.037 0.007 0.000 0.623 443 A CB -0.544 18.460 19.000 0.006 0.000 0.818 443 A HN 0.522 8.672 8.150 -0.000 0.000 0.443 444 L N -1.374 119.853 121.223 0.006 0.000 2.017 444 L HA -0.185 4.155 4.340 0.000 0.000 0.208 444 L C 2.775 179.649 176.870 0.007 0.000 1.073 444 L CA 1.858 56.702 54.840 0.006 0.000 0.745 444 L CB -0.554 41.508 42.059 0.006 0.000 0.894 444 L HN 0.352 8.582 8.230 -0.000 0.000 0.432 445 R N 0.058 120.562 120.500 0.007 0.000 2.127 445 R HA -0.160 4.180 4.340 0.000 0.000 0.238 445 R C 2.272 178.577 176.300 0.008 0.000 1.134 445 R CA 1.304 57.408 56.100 0.007 0.000 0.975 445 R CB -0.205 30.099 30.300 0.006 0.000 0.865 445 R HN 0.406 8.676 8.270 -0.000 0.000 0.447 446 A N -0.194 122.631 122.820 0.009 0.000 2.016 446 A HA -0.080 4.240 4.320 0.000 0.000 0.217 446 A C 1.976 179.566 177.584 0.011 0.000 1.162 446 A CA 0.780 52.823 52.037 0.010 0.000 0.662 446 A CB -0.210 18.797 19.000 0.011 0.000 0.812 446 A HN 0.277 8.427 8.150 -0.000 0.000 0.450 447 M N -0.484 119.122 119.600 0.010 0.000 2.374 447 M HA -0.125 4.355 4.480 0.000 0.000 0.264 447 M C 1.575 177.883 176.300 0.013 0.000 1.067 447 M CA 1.077 56.384 55.300 0.011 0.000 1.103 447 M CB -0.169 32.437 32.600 0.010 0.000 1.402 447 M HN 0.458 8.748 8.290 -0.000 0.000 0.444 448 E N -0.159 120.048 120.200 0.012 0.000 2.418 448 E HA -0.097 4.253 4.350 0.000 0.000 0.197 448 E C 1.930 178.537 176.600 0.012 0.000 1.026 448 E CA 0.667 57.075 56.400 0.013 0.000 0.862 448 E CB 0.008 29.714 29.700 0.010 0.000 0.799 448 E HN 0.520 8.880 8.360 -0.000 0.000 0.518 449 A N 1.916 124.743 122.820 0.012 0.000 1.898 449 A HA -0.069 4.251 4.320 0.000 0.000 0.216 449 A C -0.364 177.228 177.584 0.013 0.000 1.181 449 A CA 0.815 52.859 52.037 0.011 0.000 0.620 449 A CB -1.208 17.798 19.000 0.011 0.000 0.819 449 A HN 0.122 8.272 8.150 -0.000 0.000 0.442 450 P HA -0.185 4.235 4.420 -0.000 0.000 0.215 450 P C 1.823 179.135 177.300 0.020 0.000 1.157 450 P CA 0.813 63.924 63.100 0.018 0.000 0.868 450 P CB -0.142 31.570 31.700 0.020 0.000 0.788 451 L N -0.565 120.671 121.223 0.022 0.000 2.012 451 L HA -0.212 4.128 4.340 0.000 0.000 0.210 451 L C 2.330 179.208 176.870 0.014 0.000 1.073 451 L CA 2.046 56.901 54.840 0.026 0.000 0.748 451 L CB -0.500 41.576 42.059 0.028 0.000 0.891 451 L HN -0.094 8.136 8.230 -0.000 0.000 0.431 452 R N -0.834 119.670 120.500 0.006 0.000 2.105 452 R HA -0.193 4.147 4.340 0.000 0.000 0.239 452 R C 2.351 178.650 176.300 -0.002 0.000 1.135 452 R CA 1.434 57.532 56.100 -0.004 0.000 0.967 452 R CB -0.132 30.166 30.300 -0.002 0.000 0.861 452 R HN 0.435 8.705 8.270 -0.000 0.000 0.442 453 Q N 0.289 120.093 119.800 0.006 0.000 2.083 453 Q HA -0.035 4.305 4.340 0.000 0.000 0.198 453 Q C 2.141 178.149 176.000 0.012 0.000 0.969 453 Q CA 1.258 57.066 55.803 0.008 0.000 0.838 453 Q CB -0.030 28.714 28.738 0.010 0.000 0.900 453 Q HN 0.378 8.648 8.270 -0.000 0.000 0.436 454 I N -0.120 120.462 120.570 0.020 0.000 2.151 454 I HA -0.293 3.877 4.170 0.000 0.000 0.243 454 I C 2.235 178.376 176.117 0.040 0.000 1.080 454 I CA 0.980 62.300 61.300 0.033 0.000 1.339 454 I CB -0.308 37.719 38.000 0.046 0.000 1.039 454 I HN -0.024 8.186 8.210 -0.000 0.000 0.409 455 V N 0.459 120.389 119.914 0.026 0.000 2.490 455 V HA -0.256 3.865 4.120 0.000 0.000 0.250 455 V C 2.277 178.368 176.094 -0.005 0.000 1.061 455 V CA 1.603 63.902 62.300 -0.002 0.000 1.064 455 V CB -0.383 31.387 31.823 -0.088 0.000 0.670 455 V HN 0.370 8.560 8.190 -0.000 0.000 0.461 456 L N 0.275 121.495 121.223 -0.004 0.000 2.109 456 L HA -0.062 4.278 4.340 0.000 0.000 0.207 456 L C 2.013 178.885 176.870 0.004 0.000 1.086 456 L CA 1.833 56.670 54.840 -0.004 0.000 0.760 456 L CB -0.704 41.353 42.059 -0.003 0.000 0.910 456 L HN 0.350 8.580 8.230 -0.000 0.000 0.437 457 N N -1.698 117.007 118.700 0.009 0.000 2.519 457 N HA -0.180 4.560 4.740 0.000 0.000 0.186 457 N C 1.234 176.753 175.510 0.015 0.000 1.062 457 N CA 1.005 54.062 53.050 0.011 0.000 0.910 457 N CB -0.188 38.307 38.487 0.012 0.000 0.958 457 N HN 0.415 8.795 8.380 -0.000 0.000 0.445 458 C N -0.229 119.085 119.300 0.022 0.000 2.697 458 C HA 0.270 4.730 4.460 0.000 0.000 0.267 458 C C 1.711 176.713 174.990 0.020 0.000 1.278 458 C CA -0.055 58.981 59.018 0.030 0.000 1.708 458 C CB -0.920 26.858 27.740 0.063 0.000 1.860 458 C HN 0.623 8.853 8.230 -0.000 0.000 0.589 459 G N 1.564 110.371 108.800 0.011 0.000 2.153 459 G HA2 -0.226 3.734 3.960 0.000 0.000 0.252 459 G HA3 -0.226 3.734 3.960 0.000 0.000 0.252 459 G C -0.279 174.623 174.900 0.003 0.000 0.994 459 G CA 0.369 45.472 45.100 0.006 0.000 0.698 459 G HN 0.627 8.917 8.290 -0.000 0.000 0.521 460 E N 0.068 120.266 120.200 -0.002 0.000 2.249 460 E HA 0.466 4.816 4.350 0.000 0.000 0.263 460 E C -0.084 176.493 176.600 -0.038 0.000 0.950 460 E CA -0.890 55.499 56.400 -0.019 0.000 0.827 460 E CB 0.898 30.582 29.700 -0.027 0.000 1.220 460 E HN 0.355 8.715 8.360 -0.000 0.000 0.411 461 E N 2.289 122.462 120.200 -0.045 0.000 2.220 461 E HA 0.033 4.383 4.350 0.000 0.000 0.272 461 E C -1.926 174.637 176.600 -0.061 0.000 1.099 461 E CA -1.418 54.958 56.400 -0.040 0.000 0.907 461 E CB 0.673 30.356 29.700 -0.028 0.000 1.022 461 E HN 0.285 8.645 8.360 -0.000 0.000 0.428 462 P HA -0.110 4.310 4.420 -0.000 0.000 0.219 462 P C 1.370 178.642 177.300 -0.047 0.000 1.154 462 P CA 0.839 63.907 63.100 -0.054 0.000 0.826 462 P CB 0.202 31.883 31.700 -0.031 0.000 0.795 463 S N -0.482 115.200 115.700 -0.030 0.000 2.383 463 S HA -0.085 4.385 4.470 0.000 0.000 0.227 463 S C 2.072 176.658 174.600 -0.024 0.000 1.026 463 S CA 1.039 59.226 58.200 -0.022 0.000 0.981 463 S CB -1.796 61.395 63.200 -0.014 0.000 0.818 463 S HN -0.068 8.242 8.310 -0.000 0.000 0.472 464 V N 1.638 121.535 119.914 -0.028 0.000 2.358 464 V HA -0.113 4.007 4.120 0.000 0.000 0.246 464 V C 2.579 178.659 176.094 -0.023 0.000 1.047 464 V CA 1.404 63.691 62.300 -0.021 0.000 1.035 464 V CB -0.655 31.160 31.823 -0.014 0.000 0.658 464 V HN 0.415 8.605 8.190 -0.000 0.000 0.452 465 V N 0.162 120.036 119.914 -0.066 0.000 2.261 465 V HA -0.258 3.862 4.120 0.000 0.000 0.246 465 V C 2.705 178.790 176.094 -0.017 0.000 1.047 465 V CA 2.087 64.339 62.300 -0.080 0.000 1.015 465 V CB -1.070 30.550 31.823 -0.338 0.000 0.642 465 V HN 0.562 8.752 8.190 -0.000 0.000 0.446 466 A N 0.296 123.099 122.820 -0.028 0.000 1.865 466 A HA -0.292 4.028 4.320 0.000 0.000 0.217 466 A C 2.041 179.627 177.584 0.003 0.000 1.191 466 A CA 2.328 54.363 52.037 -0.004 0.000 0.623 466 A CB -0.886 18.110 19.000 -0.006 0.000 0.826 466 A HN 0.590 8.740 8.150 -0.000 0.000 0.444 467 N N -0.219 118.477 118.700 -0.007 0.000 2.037 467 N HA -0.181 4.559 4.740 0.000 0.000 0.196 467 N C 2.002 177.503 175.510 -0.014 0.000 1.034 467 N CA 2.589 55.634 53.050 -0.009 0.000 0.861 467 N CB -0.911 37.568 38.487 -0.013 0.000 1.039 467 N HN 0.728 9.108 8.380 -0.000 0.000 0.427 468 T N -1.902 112.629 114.554 -0.038 0.000 2.951 468 T HA 0.017 4.367 4.350 0.000 0.000 0.268 468 T C 1.981 176.671 174.700 -0.018 0.000 1.073 468 T CA 0.867 62.913 62.100 -0.091 0.000 1.134 468 T CB -0.529 68.183 68.868 -0.260 0.000 0.884 468 T HN -0.047 8.193 8.240 -0.000 0.000 0.479 469 V N 1.634 121.562 119.914 0.024 0.000 2.427 469 V HA -0.046 4.074 4.120 0.000 0.000 0.248 469 V C 2.699 178.871 176.094 0.130 0.000 1.051 469 V CA 1.649 64.010 62.300 0.102 0.000 1.048 469 V CB -0.498 31.373 31.823 0.079 0.000 0.666 469 V HN 0.526 8.716 8.190 -0.000 0.000 0.456 470 K N 0.358 120.798 120.400 0.067 0.000 2.365 470 K HA -0.020 4.300 4.320 0.000 0.000 0.199 470 K C 2.083 178.706 176.600 0.038 0.000 1.045 470 K CA 1.009 57.326 56.287 0.050 0.000 0.962 470 K CB -0.359 32.157 32.500 0.027 0.000 0.759 470 K HN 0.551 8.801 8.250 -0.000 0.000 0.469 471 G N 1.182 110.001 108.800 0.031 0.000 2.534 471 G HA2 -0.076 3.884 3.960 0.000 0.000 0.217 471 G HA3 -0.076 3.884 3.960 0.000 0.000 0.217 471 G C 0.733 175.618 174.900 -0.025 0.000 1.128 471 G CA 0.528 45.626 45.100 -0.004 0.000 0.784 471 G HN 0.344 8.634 8.290 -0.000 0.000 0.542 472 G N -1.018 107.805 108.800 0.038 0.000 2.606 472 G HA2 0.533 4.493 3.960 0.000 0.000 0.262 472 G HA3 0.533 4.493 3.960 0.000 0.000 0.262 472 G C -1.099 173.812 174.900 0.017 0.000 1.394 472 G CA -0.457 44.618 45.100 -0.041 0.000 1.044 472 G HN 0.116 8.406 8.290 -0.000 0.000 0.553 473 D N -2.236 118.176 120.400 0.020 0.000 2.579 473 D HA 0.489 5.130 4.640 0.000 0.000 0.257 473 D C 0.935 177.283 176.300 0.079 0.000 1.176 473 D CA 0.507 54.528 54.000 0.035 0.000 0.914 473 D CB 1.658 42.452 40.800 -0.011 0.000 1.431 473 D HN 0.835 9.205 8.370 -0.000 0.000 0.454 474 G N 1.312 110.147 108.800 0.058 0.000 2.690 474 G HA2 -0.387 3.573 3.960 0.000 0.000 0.334 474 G HA3 -0.387 3.573 3.960 0.000 0.000 0.334 474 G C 0.380 175.334 174.900 0.089 0.000 1.250 474 G CA 0.824 45.961 45.100 0.061 0.000 0.994 474 G HN 0.651 8.941 8.290 -0.000 0.000 0.549 475 N N -0.142 118.618 118.700 0.099 0.000 2.279 475 N HA 0.296 5.036 4.740 0.000 0.000 0.226 475 N C -0.180 175.421 175.510 0.151 0.000 1.126 475 N CA -0.271 52.840 53.050 0.101 0.000 0.846 475 N CB 0.315 38.844 38.487 0.070 0.000 1.050 475 N HN 0.451 8.831 8.380 -0.000 0.000 0.502 476 Y N 1.246 121.573 120.300 0.044 0.000 2.377 476 Y HA 0.456 5.006 4.550 0.000 0.000 0.330 476 Y C 0.554 176.511 175.900 0.096 0.000 1.108 476 Y CA -0.024 58.115 58.100 0.065 0.000 1.308 476 Y CB 0.443 38.931 38.460 0.047 0.000 1.216 476 Y HN -0.009 8.271 8.280 -0.000 0.000 0.518 477 G N 3.919 112.551 108.800 -0.281 0.000 2.749 477 G HA2 0.251 4.211 3.960 0.000 0.000 0.300 477 G HA3 0.251 4.211 3.960 0.000 0.000 0.300 477 G C -2.449 172.398 174.900 -0.088 0.000 1.352 477 G CA -0.897 44.103 45.100 -0.166 0.000 0.789 477 G HN 0.504 8.794 8.290 -0.000 0.000 0.509 478 Y N 1.424 121.662 120.300 -0.103 0.000 2.328 478 Y HA 0.563 5.113 4.550 0.000 0.000 0.337 478 Y C -0.015 175.783 175.900 -0.170 0.000 1.008 478 Y CA -1.430 56.560 58.100 -0.184 0.000 1.129 478 Y CB 1.516 39.883 38.460 -0.155 0.000 1.185 478 Y HN 0.409 8.689 8.280 -0.000 0.000 0.476 479 N N 4.712 122.994 118.700 -0.696 0.000 2.558 479 N HA 0.221 4.961 4.740 0.000 0.000 0.233 479 N C 0.334 175.376 175.510 -0.780 0.000 1.038 479 N CA 0.456 53.184 53.050 -0.538 0.000 0.934 479 N CB 1.217 39.491 38.487 -0.355 0.000 1.175 479 N HN 0.880 9.260 8.380 -0.000 0.000 0.512 480 A N 3.816 126.359 122.820 -0.462 0.000 1.930 480 A HA -0.037 4.283 4.320 0.000 0.000 0.217 480 A C 2.092 179.555 177.584 -0.202 0.000 1.175 480 A CA 1.655 53.533 52.037 -0.265 0.000 0.627 480 A CB -0.643 18.361 19.000 0.006 0.000 0.815 480 A HN 0.696 8.846 8.150 -0.000 0.000 0.443 481 A N -0.298 122.417 122.820 -0.174 0.000 1.865 481 A HA -0.144 4.176 4.320 0.000 0.000 0.217 481 A C 2.386 179.883 177.584 -0.145 0.000 1.191 481 A CA 2.642 54.605 52.037 -0.124 0.000 0.623 481 A CB -1.195 17.746 19.000 -0.098 0.000 0.826 481 A HN 0.863 9.013 8.150 -0.000 0.000 0.444 482 T N -4.346 110.084 114.554 -0.206 0.000 3.060 482 T HA 0.278 4.628 4.350 0.000 0.000 0.249 482 T C 0.387 174.952 174.700 -0.225 0.000 1.079 482 T CA 0.859 62.852 62.100 -0.180 0.000 1.013 482 T CB -0.169 68.606 68.868 -0.155 0.000 0.975 482 T HN 0.563 8.803 8.240 -0.000 0.000 0.518 483 E N 1.175 121.155 120.200 -0.367 0.000 2.791 483 E HA -0.174 4.176 4.350 0.000 0.000 0.271 483 E C -0.185 176.191 176.600 -0.372 0.000 1.044 483 E CA 0.996 57.183 56.400 -0.356 0.000 0.814 483 E CB -1.268 28.377 29.700 -0.092 0.000 1.400 483 E HN 0.973 9.333 8.360 -0.000 0.000 0.423 484 E N -0.815 119.082 120.200 -0.505 0.000 2.393 484 E HA 0.487 4.837 4.350 0.000 0.000 0.273 484 E C -0.725 175.620 176.600 -0.425 0.000 0.918 484 E CA -0.962 55.228 56.400 -0.349 0.000 0.773 484 E CB 0.995 30.628 29.700 -0.113 0.000 1.275 484 E HN 0.045 8.405 8.360 -0.000 0.000 0.451 485 Y N 0.290 120.572 120.300 -0.030 0.000 2.298 485 Y HA 0.649 5.199 4.550 0.000 0.000 0.329 485 Y C 1.114 176.976 175.900 -0.064 0.000 1.293 485 Y CA 0.837 58.874 58.100 -0.105 0.000 1.388 485 Y CB 1.678 40.081 38.460 -0.095 0.000 1.309 485 Y HN 0.868 9.148 8.280 -0.000 0.000 0.544 486 G N 0.395 109.214 108.800 0.032 0.000 2.325 486 G HA2 0.014 3.974 3.960 0.000 0.000 0.295 486 G HA3 0.014 3.974 3.960 0.000 0.000 0.295 486 G C -1.983 172.989 174.900 0.120 0.000 1.274 486 G CA -1.155 44.025 45.100 0.133 0.000 0.857 486 G HN 0.548 8.838 8.290 -0.000 0.000 0.499 487 N N 1.057 119.830 118.700 0.122 0.000 2.420 487 N HA 0.153 4.893 4.740 0.000 0.000 0.249 487 N C 1.640 177.178 175.510 0.047 0.000 1.033 487 N CA -0.575 52.539 53.050 0.107 0.000 0.944 487 N CB 0.895 39.440 38.487 0.098 0.000 1.113 487 N HN 0.377 8.757 8.380 -0.000 0.000 0.502 488 M N 3.333 122.953 119.600 0.034 0.000 2.149 488 M HA -0.155 4.325 4.480 0.000 0.000 0.261 488 M C 1.596 177.903 176.300 0.011 0.000 1.064 488 M CA 1.109 56.414 55.300 0.008 0.000 1.102 488 M CB -0.579 32.026 32.600 0.008 0.000 1.369 488 M HN 0.546 8.836 8.290 -0.000 0.000 0.408 489 I N 0.254 120.838 120.570 0.022 0.000 2.394 489 I HA -0.230 3.940 4.170 0.000 0.000 0.251 489 I C 1.782 177.907 176.117 0.014 0.000 1.136 489 I CA 1.282 62.592 61.300 0.018 0.000 1.425 489 I CB -1.401 36.613 38.000 0.022 0.000 1.079 489 I HN 0.234 8.444 8.210 -0.000 0.000 0.425 490 D N 0.669 121.081 120.400 0.019 0.000 2.183 490 D HA -0.065 4.575 4.640 0.000 0.000 0.203 490 D C 2.170 178.473 176.300 0.006 0.000 0.969 490 D CA 0.969 54.979 54.000 0.016 0.000 0.842 490 D CB -0.012 40.803 40.800 0.025 0.000 0.957 490 D HN 0.324 8.694 8.370 -0.000 0.000 0.484 491 M N -0.748 118.852 119.600 0.000 0.000 2.618 491 M HA 0.177 4.657 4.480 0.000 0.000 0.240 491 M C 1.141 177.431 176.300 -0.017 0.000 1.123 491 M CA 0.474 55.766 55.300 -0.015 0.000 1.060 491 M CB 0.508 33.089 32.600 -0.031 0.000 1.535 491 M HN 0.022 8.312 8.290 -0.000 0.000 0.507 492 G N 2.024 110.820 108.800 -0.008 0.000 2.155 492 G HA2 -0.254 3.706 3.960 0.000 0.000 0.257 492 G HA3 -0.254 3.706 3.960 0.000 0.000 0.257 492 G C 0.153 175.047 174.900 -0.009 0.000 0.983 492 G CA -0.173 44.923 45.100 -0.007 0.000 0.676 492 G HN 0.557 8.847 8.290 -0.000 0.000 0.528 493 I N 1.792 122.354 120.570 -0.013 0.000 2.227 493 I HA 0.325 4.495 4.170 0.000 0.000 0.297 493 I C 0.544 176.659 176.117 -0.002 0.000 1.173 493 I CA -0.163 61.129 61.300 -0.013 0.000 1.356 493 I CB -0.076 37.909 38.000 -0.026 0.000 1.485 493 I HN 0.063 8.273 8.210 -0.000 0.000 0.604 494 L N 3.403 124.627 121.223 0.002 0.000 2.322 494 L HA 0.603 4.943 4.340 0.000 0.000 0.281 494 L C -0.592 176.284 176.870 0.010 0.000 1.014 494 L CA -0.954 53.891 54.840 0.008 0.000 0.815 494 L CB 1.256 43.321 42.059 0.009 0.000 1.247 494 L HN 0.222 8.452 8.230 -0.000 0.000 0.421 495 D N 2.759 123.167 120.400 0.013 0.000 2.193 495 D HA 0.411 5.051 4.640 0.000 0.000 0.249 495 D C -2.467 173.843 176.300 0.017 0.000 1.034 495 D CA -1.465 52.544 54.000 0.016 0.000 0.902 495 D CB 1.712 42.522 40.800 0.017 0.000 1.182 495 D HN 0.251 8.621 8.370 -0.000 0.000 0.436 496 P HA 0.152 4.572 4.420 -0.000 0.000 0.275 496 P C 0.628 177.938 177.300 0.017 0.000 1.228 496 P CA -0.266 62.846 63.100 0.020 0.000 0.786 496 P CB 0.758 32.474 31.700 0.027 0.000 0.927 497 T N 1.433 115.995 114.554 0.013 0.000 2.701 497 T HA -0.170 4.180 4.350 0.000 0.000 0.263 497 T C 1.640 176.343 174.700 0.005 0.000 1.040 497 T CA 1.284 63.388 62.100 0.008 0.000 1.147 497 T CB -0.461 68.410 68.868 0.005 0.000 0.865 497 T HN 0.487 8.727 8.240 -0.000 0.000 0.426 498 K N 0.879 121.284 120.400 0.008 0.000 2.077 498 K HA -0.192 4.128 4.320 0.000 0.000 0.213 498 K C 2.388 178.998 176.600 0.016 0.000 1.051 498 K CA 1.923 58.215 56.287 0.010 0.000 0.929 498 K CB -0.518 31.994 32.500 0.022 0.000 0.715 498 K HN 0.315 8.565 8.250 -0.000 0.000 0.451 499 V N -0.264 119.667 119.914 0.028 0.000 2.358 499 V HA -0.178 3.942 4.120 0.000 0.000 0.246 499 V C 1.766 177.873 176.094 0.022 0.000 1.047 499 V CA 2.421 64.743 62.300 0.037 0.000 1.035 499 V CB -0.726 31.125 31.823 0.047 0.000 0.658 499 V HN 0.398 8.588 8.190 -0.000 0.000 0.452 500 T N 0.667 115.229 114.554 0.012 0.000 2.708 500 T HA -0.157 4.193 4.350 0.000 0.000 0.266 500 T C 2.044 176.736 174.700 -0.013 0.000 1.037 500 T CA 1.925 64.028 62.100 0.006 0.000 1.146 500 T CB -0.468 68.404 68.868 0.007 0.000 0.865 500 T HN 0.504 8.744 8.240 -0.000 0.000 0.435 501 R N 1.091 121.576 120.500 -0.025 0.000 2.097 501 R HA -0.123 4.217 4.340 0.000 0.000 0.236 501 R C 2.578 178.813 176.300 -0.108 0.000 1.135 501 R CA 2.063 58.130 56.100 -0.057 0.000 0.934 501 R CB -0.824 29.445 30.300 -0.053 0.000 0.846 501 R HN 0.302 8.572 8.270 -0.000 0.000 0.431 502 S N 0.469 116.104 115.700 -0.109 0.000 2.368 502 S HA -0.130 4.340 4.470 0.000 0.000 0.225 502 S C 2.031 176.554 174.600 -0.129 0.000 1.030 502 S CA 1.217 59.291 58.200 -0.211 0.000 0.999 502 S CB -0.345 62.838 63.200 -0.028 0.000 0.844 502 S HN 0.584 8.894 8.310 -0.000 0.000 0.459 503 A N 1.884 124.710 122.820 0.010 0.000 1.884 503 A HA -0.146 4.174 4.320 0.000 0.000 0.219 503 A C 2.124 179.718 177.584 0.017 0.000 1.197 503 A CA 1.552 53.623 52.037 0.057 0.000 0.637 503 A CB -0.993 18.034 19.000 0.045 0.000 0.827 503 A HN 0.458 8.608 8.150 -0.000 0.000 0.450 504 L N -0.764 120.442 121.223 -0.028 0.000 1.994 504 L HA -0.267 4.073 4.340 0.000 0.000 0.208 504 L C 2.828 179.663 176.870 -0.059 0.000 1.071 504 L CA 2.425 57.246 54.840 -0.031 0.000 0.745 504 L CB -0.858 41.180 42.059 -0.034 0.000 0.892 504 L HN 0.571 8.801 8.230 -0.000 0.000 0.431 505 Q N -1.148 118.558 119.800 -0.155 0.000 2.045 505 Q HA -0.268 4.072 4.340 0.000 0.000 0.206 505 Q C 2.050 177.982 176.000 -0.114 0.000 0.991 505 Q CA 2.272 57.955 55.803 -0.200 0.000 0.851 505 Q CB -0.292 28.228 28.738 -0.364 0.000 0.911 505 Q HN 0.487 8.757 8.270 -0.000 0.000 0.418 506 Y N -0.133 120.174 120.300 0.012 0.000 2.163 506 Y HA -0.145 4.405 4.550 0.000 0.000 0.288 506 Y C 2.394 178.300 175.900 0.010 0.000 1.136 506 Y CA 0.747 58.854 58.100 0.011 0.000 1.147 506 Y CB -1.069 37.398 38.460 0.011 0.000 0.987 506 Y HN 0.135 8.415 8.280 -0.000 0.000 0.509 507 A N 0.280 123.195 122.820 0.158 0.000 1.917 507 A HA -0.190 4.130 4.320 0.000 0.000 0.219 507 A C 2.514 180.138 177.584 0.067 0.000 1.182 507 A CA 2.299 54.392 52.037 0.093 0.000 0.633 507 A CB -1.276 17.761 19.000 0.063 0.000 0.819 507 A HN 0.410 8.560 8.150 -0.000 0.000 0.448 508 A N -0.965 121.885 122.820 0.050 0.000 1.877 508 A HA -0.087 4.233 4.320 0.000 0.000 0.216 508 A C 2.474 180.084 177.584 0.043 0.000 1.186 508 A CA 2.175 54.232 52.037 0.033 0.000 0.620 508 A CB -1.082 17.926 19.000 0.014 0.000 0.822 508 A HN 0.600 8.750 8.150 -0.000 0.000 0.443 509 S N -0.419 115.319 115.700 0.063 0.000 2.359 509 S HA -0.183 4.287 4.470 0.000 0.000 0.222 509 S C 1.963 176.601 174.600 0.062 0.000 1.038 509 S CA 2.251 60.495 58.200 0.073 0.000 1.051 509 S CB -0.720 62.553 63.200 0.122 0.000 0.944 509 S HN 0.420 8.730 8.310 -0.000 0.000 0.433 510 V N 2.308 122.264 119.914 0.070 0.000 2.261 510 V HA -0.069 4.051 4.120 0.000 0.000 0.246 510 V C 2.922 179.038 176.094 0.037 0.000 1.047 510 V CA 1.801 64.130 62.300 0.048 0.000 1.015 510 V CB -1.690 30.157 31.823 0.042 0.000 0.642 510 V HN 0.620 8.810 8.190 -0.000 0.000 0.446 511 A N 0.943 123.785 122.820 0.038 0.000 1.972 511 A HA -0.046 4.274 4.320 0.000 0.000 0.219 511 A C 2.397 179.996 177.584 0.025 0.000 1.169 511 A CA 1.905 53.959 52.037 0.029 0.000 0.635 511 A CB -1.324 17.692 19.000 0.027 0.000 0.810 511 A HN 0.558 8.708 8.150 -0.000 0.000 0.446 512 G N 0.054 108.870 108.800 0.027 0.000 2.514 512 G HA2 -0.248 3.712 3.960 0.000 0.000 0.217 512 G HA3 -0.248 3.712 3.960 0.000 0.000 0.217 512 G C 1.572 176.485 174.900 0.022 0.000 1.198 512 G CA 1.132 46.245 45.100 0.023 0.000 0.780 512 G HN 0.430 8.720 8.290 -0.000 0.000 0.565 513 L N -0.531 120.707 121.223 0.024 0.000 2.012 513 L HA -0.098 4.242 4.340 0.000 0.000 0.210 513 L C 2.977 179.859 176.870 0.021 0.000 1.073 513 L CA 1.558 56.412 54.840 0.022 0.000 0.748 513 L CB -0.274 41.799 42.059 0.024 0.000 0.891 513 L HN 0.287 8.517 8.230 -0.000 0.000 0.431 514 M N 0.023 119.635 119.600 0.021 0.000 2.149 514 M HA -0.237 4.243 4.480 0.000 0.000 0.261 514 M C 2.025 178.335 176.300 0.017 0.000 1.064 514 M CA 1.872 57.183 55.300 0.020 0.000 1.102 514 M CB -0.157 32.455 32.600 0.020 0.000 1.369 514 M HN 0.312 8.602 8.290 -0.000 0.000 0.408 515 I N -2.760 117.820 120.570 0.017 0.000 3.001 515 I HA -0.038 4.132 4.170 0.000 0.000 0.268 515 I C 1.558 177.684 176.117 0.015 0.000 1.267 515 I CA 1.157 62.466 61.300 0.015 0.000 1.472 515 I CB -1.085 36.924 38.000 0.014 0.000 1.089 515 I HN 0.242 8.452 8.210 -0.000 0.000 0.468 516 T N -2.421 112.143 114.554 0.017 0.000 3.235 516 T HA 0.167 4.517 4.350 0.000 0.000 0.251 516 T C 0.662 175.374 174.700 0.021 0.000 1.060 516 T CA -0.242 61.869 62.100 0.019 0.000 0.949 516 T CB -0.887 67.992 68.868 0.019 0.000 1.020 516 T HN 0.193 8.433 8.240 -0.000 0.000 0.564 517 T N 2.515 117.080 114.554 0.018 0.000 2.761 517 T HA 0.289 4.639 4.350 0.000 0.000 0.296 517 T C 0.742 175.455 174.700 0.021 0.000 0.934 517 T CA -0.242 61.869 62.100 0.018 0.000 1.091 517 T CB 1.425 70.300 68.868 0.012 0.000 0.896 517 T HN 0.355 8.595 8.240 -0.000 0.000 0.515 518 E N 1.509 121.729 120.200 0.034 0.000 2.465 518 E HA 0.207 4.558 4.350 0.000 0.000 0.209 518 E C -0.006 176.637 176.600 0.071 0.000 0.951 518 E CA -0.045 56.392 56.400 0.062 0.000 0.997 518 E CB 0.502 30.252 29.700 0.084 0.000 1.025 518 E HN 0.591 8.951 8.360 -0.000 0.000 0.500 519 C N 0.208 119.511 119.300 0.004 0.000 2.985 519 C HA 0.737 5.197 4.460 0.000 0.000 0.314 519 C C -1.620 173.295 174.990 -0.126 0.000 1.215 519 C CA -0.705 58.233 59.018 -0.134 0.000 1.414 519 C CB 0.603 28.265 27.740 -0.130 0.000 1.842 519 C HN 0.301 8.531 8.230 -0.000 0.000 0.477 520 M N 4.586 124.080 119.600 -0.176 0.000 2.326 520 M HA 0.559 5.039 4.480 0.000 0.000 0.292 520 M C -1.282 175.059 176.300 0.068 0.000 1.081 520 M CA -0.540 54.762 55.300 0.003 0.000 0.919 520 M CB 2.215 34.889 32.600 0.124 0.000 1.634 520 M HN 0.410 8.700 8.290 -0.000 0.000 0.451 521 V N 1.685 121.628 119.914 0.049 0.000 2.443 521 V HA 0.690 4.810 4.120 0.000 0.000 0.293 521 V C -0.338 175.733 176.094 -0.038 0.000 1.021 521 V CA -0.341 61.964 62.300 0.009 0.000 0.848 521 V CB 1.810 33.620 31.823 -0.023 0.000 0.998 521 V HN 0.953 9.143 8.190 -0.000 0.000 0.424 522 T N 2.214 116.699 114.554 -0.114 0.000 2.812 522 T HA 0.441 4.791 4.350 0.000 0.000 0.294 522 T C -1.136 173.450 174.700 -0.191 0.000 1.159 522 T CA -0.548 61.425 62.100 -0.212 0.000 1.008 522 T CB 1.900 70.510 68.868 -0.431 0.000 1.289 522 T HN 0.585 8.825 8.240 -0.000 0.000 0.514 523 D N 1.385 121.682 120.400 -0.171 0.000 2.368 523 D HA 0.298 4.938 4.640 0.000 0.000 0.240 523 D C 0.210 176.422 176.300 -0.146 0.000 1.169 523 D CA 0.088 54.011 54.000 -0.127 0.000 0.906 523 D CB 0.349 41.090 40.800 -0.098 0.000 1.187 523 D HN 0.379 8.749 8.370 -0.000 0.000 0.435 524 L N 2.401 123.571 121.223 -0.089 0.000 2.417 524 L HA 0.248 4.588 4.340 0.000 0.000 0.268 524 L C -1.411 175.420 176.870 -0.066 0.000 1.158 524 L CA -1.476 53.323 54.840 -0.068 0.000 0.819 524 L CB 0.361 42.401 42.059 -0.032 0.000 1.112 524 L HN 0.333 8.563 8.230 -0.000 0.000 0.458 525 P HA 0.000 4.420 4.420 -0.000 0.000 0.216 525 P CA 0.000 63.076 63.100 -0.040 0.000 0.800 525 P CB 0.000 31.689 31.700 -0.019 0.000 0.726