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 1smd_1_A DATA FIRST_RESID 2 DATA SEQUENCE YSSNTQQGRT SIVHLFEWRW VDIALEcERY LAPKGFGGVQ VSPPNENVAI DATA SEQUENCE HNPFRPWWER YQPVSYKLcT RSGNEDEFRN MVTRcNNVGV RIYVDAVINH DATA SEQUENCE MCGNAVSAGT SSTcGSYFNP GSRDFPAVPY SGWDFNDGKc KTGSGDIENY DATA SEQUENCE NDATQVRDcR LSGLLDLALG KDYVRSKIAE YMNHLIDIGV AGFRIDASKH DATA SEQUENCE MWPGDIKAIL DKLHNLNSNW FPEGSKPFIY QEVIDLGGEP IKSSDYFGNG DATA SEQUENCE RVTEFKYGAK LGTVIRKWNG EKMSYLKNWG EGWGFMPSDR ALVFVDNHDN DATA SEQUENCE QRGHGAGGAS ILTFWDARLY KMAVGFMLAH PYGFTRVMSS YRWPRYFENG DATA SEQUENCE KDVNDWVGPP NDNGVTKEVT INPDTTcGND WVcEHRWRQI RNMVNFRNVV DATA SEQUENCE DGQPFTNWYD NGSNQVAFGR GNRGFIVFNN DDWTFSLTLQ TGLPAGTYcD DATA SEQUENCE VISGDKINGN cTGIKIYVSD DGKAHFSISN SAEDPFIAIH AESKL 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 Y HA 0.000 4.550 4.550 -0.000 0.000 0.201 2 Y C 0.000 175.987 175.900 0.145 0.000 1.272 2 Y CA 0.000 58.202 58.100 0.171 0.000 1.940 2 Y CB 0.000 38.490 38.460 0.049 0.000 1.050 3 S N 1.465 117.249 115.700 0.140 0.000 2.537 3 S HA 0.249 4.721 4.470 0.003 0.000 0.275 3 S C 1.264 175.594 174.600 -0.449 0.000 1.272 3 S CA 0.191 58.308 58.200 -0.138 0.000 1.050 3 S CB 1.472 64.634 63.200 -0.064 0.000 0.961 3 S HN 0.420 8.730 8.310 -0.000 0.000 0.496 4 S N 2.548 117.642 115.700 -1.010 0.000 2.402 4 S HA -0.134 4.337 4.470 0.003 0.000 0.229 4 S C 0.746 175.093 174.600 -0.423 0.000 1.021 4 S CA 0.799 58.122 58.200 -1.462 0.000 0.974 4 S CB -0.439 61.809 63.200 -1.586 0.000 0.800 4 S HN 0.781 9.091 8.310 -0.000 0.000 0.484 5 N N 1.283 119.860 118.700 -0.205 0.000 2.901 5 N HA -0.126 4.616 4.740 0.003 0.000 0.248 5 N C 0.024 175.603 175.510 0.115 0.000 1.044 5 N CA 1.329 54.386 53.050 0.011 0.000 0.847 5 N CB -2.424 36.047 38.487 -0.028 0.000 1.127 5 N HN 0.887 9.267 8.380 -0.000 0.000 0.562 6 T N -1.741 112.839 114.554 0.043 0.000 2.849 6 T HA 0.361 4.713 4.350 0.003 0.000 0.284 6 T C 0.707 175.445 174.700 0.064 0.000 1.004 6 T CA -0.550 61.606 62.100 0.093 0.000 1.021 6 T CB 1.624 70.563 68.868 0.119 0.000 1.013 6 T HN 0.085 8.325 8.240 -0.000 0.000 0.527 7 Q N 0.950 120.781 119.800 0.051 0.000 2.524 7 Q HA 0.133 4.475 4.340 0.003 0.000 0.246 7 Q C -0.247 175.767 176.000 0.023 0.000 1.063 7 Q CA -0.535 55.285 55.803 0.028 0.000 0.945 7 Q CB 0.225 28.969 28.738 0.011 0.000 1.292 7 Q HN 0.566 8.836 8.270 -0.000 0.000 0.518 8 Q N 0.044 119.853 119.800 0.014 0.000 2.289 8 Q HA 0.297 4.639 4.340 0.003 0.000 0.273 8 Q C 0.783 176.782 176.000 -0.001 0.000 1.029 8 Q CA 1.184 56.992 55.803 0.007 0.000 0.896 8 Q CB 0.352 29.093 28.738 0.004 0.000 1.182 8 Q HN 0.943 9.213 8.270 -0.000 0.000 0.385 9 G N 2.461 111.258 108.800 -0.006 0.000 2.176 9 G HA2 -0.275 3.687 3.960 0.003 0.000 0.232 9 G HA3 -0.275 3.687 3.960 0.003 0.000 0.232 9 G C -0.166 174.716 174.900 -0.030 0.000 0.986 9 G CA -0.378 44.708 45.100 -0.023 0.000 0.643 9 G HN 0.460 8.750 8.290 -0.000 0.000 0.522 10 R N 0.581 121.076 120.500 -0.008 0.000 2.371 10 R HA 0.525 4.867 4.340 0.003 0.000 0.312 10 R C 0.916 177.228 176.300 0.019 0.000 0.980 10 R CA 0.196 56.291 56.100 -0.008 0.000 0.867 10 R CB 1.065 31.378 30.300 0.022 0.000 1.163 10 R HN 0.285 8.555 8.270 -0.000 0.000 0.492 11 T N -2.610 111.913 114.554 -0.051 0.000 3.092 11 T HA 0.249 4.601 4.350 0.003 0.000 0.258 11 T C 0.437 174.886 174.700 -0.419 0.000 1.031 11 T CA -0.204 61.832 62.100 -0.108 0.000 0.925 11 T CB 0.392 69.187 68.868 -0.123 0.000 1.036 11 T HN 0.220 8.460 8.240 -0.000 0.000 0.544 12 S N 1.319 116.841 115.700 -0.297 0.000 2.588 12 S HA 0.767 5.239 4.470 0.003 0.000 0.275 12 S C -0.781 173.772 174.600 -0.078 0.000 1.130 12 S CA -1.086 56.880 58.200 -0.390 0.000 0.855 12 S CB 1.746 64.788 63.200 -0.263 0.000 1.116 12 S HN 0.572 8.882 8.310 -0.000 0.000 0.472 13 I N -0.736 119.798 120.570 -0.060 0.000 2.740 13 I HA 0.896 5.068 4.170 0.003 0.000 0.303 13 I C -0.945 175.230 176.117 0.097 0.000 1.044 13 I CA -1.025 60.337 61.300 0.104 0.000 1.064 13 I CB 1.734 39.797 38.000 0.105 0.000 1.249 13 I HN 0.443 8.653 8.210 -0.000 0.000 0.433 14 V N 4.607 124.584 119.914 0.106 0.000 2.555 14 V HA 0.383 4.505 4.120 0.003 0.000 0.302 14 V C -0.835 175.274 176.094 0.026 0.000 1.038 14 V CA -0.379 61.938 62.300 0.028 0.000 0.887 14 V CB 1.706 33.453 31.823 -0.127 0.000 0.991 14 V HN 0.925 9.115 8.190 -0.000 0.000 0.434 15 H N 6.874 125.900 119.070 -0.073 0.000 2.761 15 H HA 0.389 4.947 4.556 0.003 0.000 0.284 15 H C -0.586 174.672 175.328 -0.117 0.000 1.105 15 H CA -0.750 55.279 56.048 -0.032 0.000 1.352 15 H CB 0.921 30.691 29.762 0.014 0.000 1.423 15 H HN 0.609 8.889 8.280 -0.000 0.000 0.464 16 L N 7.601 128.743 121.223 -0.136 0.000 2.449 16 L HA 0.068 4.410 4.340 0.003 0.000 0.255 16 L C -0.124 176.665 176.870 -0.134 0.000 1.167 16 L CA -0.626 53.866 54.840 -0.579 0.000 1.090 16 L CB -0.483 40.928 42.059 -1.081 0.000 1.385 16 L HN 0.567 8.797 8.230 -0.000 0.000 0.411 17 F N 4.254 124.004 119.950 -0.334 0.000 2.569 17 F HA -0.059 4.470 4.527 0.003 0.000 0.395 17 F C 1.405 177.421 175.800 0.361 0.000 1.028 17 F CA 0.341 58.227 58.000 -0.190 0.000 1.158 17 F CB -0.111 38.632 39.000 -0.429 0.000 1.023 17 F HN 0.514 8.814 8.300 -0.000 0.000 0.547 18 E N 2.452 122.692 120.200 0.067 0.000 3.370 18 E HA -0.308 4.044 4.350 0.003 0.000 0.291 18 E C -0.441 176.266 176.600 0.177 0.000 0.916 18 E CA 0.951 57.365 56.400 0.023 0.000 0.981 18 E CB -1.618 27.977 29.700 -0.174 0.000 1.498 18 E HN 0.623 8.983 8.360 -0.000 0.000 0.452 19 W N 1.667 122.896 121.300 -0.119 0.000 2.137 19 W HA 0.151 4.813 4.660 0.003 0.000 0.344 19 W C 1.597 177.931 176.519 -0.308 0.000 1.286 19 W CA 0.059 57.206 57.345 -0.329 0.000 1.240 19 W CB 0.249 29.517 29.460 -0.320 0.000 1.141 19 W HN -0.101 8.079 8.180 -0.000 0.000 0.579 20 R N 1.760 122.164 120.500 -0.160 0.000 2.582 20 R HA 0.037 4.379 4.340 0.003 0.000 0.271 20 R C 1.058 177.358 176.300 0.000 0.000 1.078 20 R CA -0.328 55.617 56.100 -0.259 0.000 1.127 20 R CB 0.485 30.660 30.300 -0.208 0.000 1.038 20 R HN 0.704 8.974 8.270 -0.000 0.000 0.500 21 W N 0.699 122.044 121.300 0.075 0.000 2.338 21 W HA -0.215 4.447 4.660 0.003 0.000 0.304 21 W C 2.000 178.532 176.519 0.022 0.000 1.212 21 W CA 0.069 57.450 57.345 0.060 0.000 1.264 21 W CB -0.318 29.197 29.460 0.092 0.000 1.142 21 W HN 0.425 8.605 8.180 -0.000 0.000 0.512 22 V N 1.154 121.197 119.914 0.214 0.000 2.490 22 V HA -0.265 3.856 4.120 0.003 0.000 0.250 22 V C 1.700 177.842 176.094 0.081 0.000 1.061 22 V CA 2.331 64.701 62.300 0.115 0.000 1.064 22 V CB -0.512 31.349 31.823 0.065 0.000 0.670 22 V HN 0.069 8.259 8.190 -0.000 0.000 0.461 23 D N -0.172 120.264 120.400 0.060 0.000 2.149 23 D HA -0.064 4.578 4.640 0.003 0.000 0.201 23 D C 2.061 178.500 176.300 0.232 0.000 0.972 23 D CA 1.554 55.583 54.000 0.048 0.000 0.835 23 D CB -0.080 40.601 40.800 -0.198 0.000 0.966 23 D HN 0.491 8.861 8.370 -0.000 0.000 0.476 24 I N 1.367 122.103 120.570 0.277 0.000 2.179 24 I HA -0.237 3.935 4.170 0.003 0.000 0.242 24 I C 2.561 178.722 176.117 0.074 0.000 1.088 24 I CA 0.893 62.302 61.300 0.181 0.000 1.357 24 I CB -0.266 37.833 38.000 0.166 0.000 1.051 24 I HN -0.093 8.117 8.210 -0.000 0.000 0.409 25 A N 1.217 124.078 122.820 0.068 0.000 1.892 25 A HA -0.207 4.115 4.320 0.003 0.000 0.218 25 A C 2.318 179.920 177.584 0.030 0.000 1.188 25 A CA 1.647 53.694 52.037 0.016 0.000 0.631 25 A CB -0.973 18.038 19.000 0.018 0.000 0.822 25 A HN 0.385 8.535 8.150 -0.000 0.000 0.447 26 L N -1.221 120.037 121.223 0.058 0.000 2.046 26 L HA -0.200 4.142 4.340 0.003 0.000 0.208 26 L C 2.694 179.613 176.870 0.083 0.000 1.077 26 L CA 1.740 56.616 54.840 0.060 0.000 0.747 26 L CB -0.475 41.616 42.059 0.053 0.000 0.896 26 L HN 0.424 8.654 8.230 -0.000 0.000 0.432 27 E N -0.296 119.973 120.200 0.114 0.000 2.085 27 E HA -0.214 4.138 4.350 0.003 0.000 0.194 27 E C 2.260 178.902 176.600 0.069 0.000 0.994 27 E CA 1.492 57.968 56.400 0.126 0.000 0.801 27 E CB -0.319 29.453 29.700 0.120 0.000 0.743 27 E HN 0.427 8.787 8.360 -0.000 0.000 0.453 28 c N 0.418 119.025 118.600 0.012 0.000 2.413 28 c HA -0.132 4.440 4.570 0.003 0.000 0.276 28 c C 2.386 176.488 174.090 0.021 0.000 1.236 28 c CA 1.313 57.635 56.329 -0.012 0.000 1.735 28 c CB -0.900 41.578 42.510 -0.054 0.000 2.031 28 c HN 0.535 8.765 8.230 -0.000 0.000 0.474 29 E N 0.200 120.417 120.200 0.029 0.000 2.112 29 E HA -0.141 4.211 4.350 0.003 0.000 0.190 29 E C 2.328 178.963 176.600 0.059 0.000 0.979 29 E CA 0.811 57.232 56.400 0.034 0.000 0.814 29 E CB -0.196 29.520 29.700 0.028 0.000 0.762 29 E HN 0.690 9.050 8.360 -0.000 0.000 0.460 30 R N -1.062 119.494 120.500 0.095 0.000 2.280 30 R HA 0.026 4.367 4.340 0.003 0.000 0.195 30 R C 0.890 177.312 176.300 0.203 0.000 0.935 30 R CA 0.824 57.001 56.100 0.127 0.000 1.033 30 R CB 0.188 30.567 30.300 0.131 0.000 0.964 30 R HN 0.228 8.498 8.270 -0.000 0.000 0.489 31 Y N -0.099 120.227 120.300 0.045 0.000 3.147 31 Y HA 0.248 4.800 4.550 0.003 0.000 0.219 31 Y C 1.752 177.700 175.900 0.080 0.000 1.021 31 Y CA -0.222 57.916 58.100 0.064 0.000 1.440 31 Y CB 0.223 38.717 38.460 0.057 0.000 1.472 31 Y HN -0.167 8.113 8.280 -0.000 0.000 0.408 32 L N 0.325 121.644 121.223 0.160 0.000 2.012 32 L HA -0.203 4.138 4.340 0.003 0.000 0.210 32 L C 2.589 179.557 176.870 0.164 0.000 1.073 32 L CA 1.637 56.547 54.840 0.116 0.000 0.748 32 L CB -0.984 41.054 42.059 -0.035 0.000 0.891 32 L HN 0.355 8.585 8.230 -0.000 0.000 0.431 33 A N 0.746 123.611 122.820 0.074 0.000 1.845 33 A HA -0.107 4.215 4.320 0.003 0.000 0.215 33 A C 0.126 177.729 177.584 0.032 0.000 1.195 33 A CA 1.779 53.844 52.037 0.047 0.000 0.616 33 A CB -1.951 17.059 19.000 0.017 0.000 0.832 33 A HN 0.335 8.485 8.150 -0.000 0.000 0.443 34 P HA -0.059 4.361 4.420 -0.000 0.000 0.223 34 P C 0.476 177.745 177.300 -0.053 0.000 1.151 34 P CA 1.210 64.293 63.100 -0.028 0.000 0.787 34 P CB -0.012 31.665 31.700 -0.039 0.000 0.788 35 K N -0.666 119.698 120.400 -0.060 0.000 2.446 35 K HA 0.376 4.698 4.320 0.003 0.000 0.203 35 K C 1.049 177.656 176.600 0.012 0.000 1.027 35 K CA 0.424 56.677 56.287 -0.056 0.000 1.166 35 K CB -0.724 31.659 32.500 -0.194 0.000 0.869 35 K HN 0.110 8.360 8.250 -0.000 0.000 0.504 36 G N 0.664 109.479 108.800 0.025 0.000 2.176 36 G HA2 -0.285 3.677 3.960 0.003 0.000 0.252 36 G HA3 -0.285 3.677 3.960 0.003 0.000 0.252 36 G C -0.240 174.619 174.900 -0.068 0.000 1.024 36 G CA -0.228 44.851 45.100 -0.036 0.000 0.755 36 G HN 0.213 8.503 8.290 -0.000 0.000 0.507 37 F N 0.038 119.986 119.950 -0.004 0.000 2.399 37 F HA 0.524 5.053 4.527 0.003 0.000 0.342 37 F C 1.757 177.563 175.800 0.011 0.000 1.106 37 F CA 0.711 58.717 58.000 0.010 0.000 1.196 37 F CB 1.408 40.424 39.000 0.027 0.000 1.163 37 F HN -0.009 8.291 8.300 -0.000 0.000 0.547 38 G N 0.987 109.896 108.800 0.182 0.000 2.492 38 G HA2 0.430 4.392 3.960 0.003 0.000 0.214 38 G HA3 0.430 4.392 3.960 0.003 0.000 0.214 38 G C 0.411 175.434 174.900 0.205 0.000 1.147 38 G CA 0.602 45.797 45.100 0.159 0.000 0.809 38 G HN 1.010 9.300 8.290 -0.000 0.000 0.533 39 G N -1.854 107.097 108.800 0.251 0.000 2.495 39 G HA2 0.465 4.427 3.960 0.003 0.000 0.294 39 G HA3 0.465 4.427 3.960 0.003 0.000 0.294 39 G C -2.186 172.849 174.900 0.226 0.000 1.397 39 G CA -0.320 44.949 45.100 0.282 0.000 0.790 39 G HN 0.450 8.740 8.290 -0.000 0.000 0.486 40 V N 0.357 120.393 119.914 0.203 0.000 2.588 40 V HA 0.570 4.692 4.120 0.003 0.000 0.304 40 V C -0.164 176.080 176.094 0.250 0.000 1.042 40 V CA -0.692 61.677 62.300 0.114 0.000 0.877 40 V CB 1.679 33.469 31.823 -0.055 0.000 0.996 40 V HN 0.848 9.038 8.190 -0.000 0.000 0.425 41 Q N 3.442 123.386 119.800 0.239 0.000 2.303 41 Q HA 0.630 4.971 4.340 0.003 0.000 0.257 41 Q C -0.721 175.452 176.000 0.290 0.000 0.941 41 Q CA -0.430 55.538 55.803 0.275 0.000 0.931 41 Q CB 1.829 30.682 28.738 0.190 0.000 1.215 41 Q HN 0.812 9.082 8.270 -0.000 0.000 0.437 42 V N 1.138 121.217 119.914 0.275 0.000 2.850 42 V HA 0.611 4.733 4.120 0.003 0.000 0.315 42 V C 0.045 176.396 176.094 0.429 0.000 1.064 42 V CA -0.788 61.741 62.300 0.383 0.000 0.979 42 V CB 1.724 33.761 31.823 0.357 0.000 1.039 42 V HN 0.771 8.961 8.190 -0.000 0.000 0.452 43 S N 2.863 118.869 115.700 0.509 0.000 2.589 43 S HA 0.357 4.829 4.470 0.003 0.000 0.265 43 S C -2.411 172.406 174.600 0.361 0.000 1.342 43 S CA -0.365 58.076 58.200 0.402 0.000 1.005 43 S CB 0.221 63.597 63.200 0.295 0.000 0.909 43 S HN 0.861 9.171 8.310 -0.000 0.000 0.555 44 P HA 0.059 4.479 4.420 -0.000 0.000 0.260 44 P C -1.940 175.496 177.300 0.226 0.000 1.185 44 P CA -0.747 62.432 63.100 0.132 0.000 0.763 44 P CB 0.007 31.664 31.700 -0.071 0.000 0.776 45 P HA -0.038 4.382 4.420 -0.000 0.000 0.255 45 P C -0.140 177.232 177.300 0.120 0.000 1.248 45 P CA 0.608 63.853 63.100 0.243 0.000 0.807 45 P CB 0.201 31.737 31.700 -0.274 0.000 1.150 46 N N 0.529 119.286 118.700 0.094 0.000 2.508 46 N HA 0.056 4.798 4.740 0.003 0.000 0.285 46 N C -0.219 175.265 175.510 -0.044 0.000 1.144 46 N CA -0.479 52.569 53.050 -0.003 0.000 0.978 46 N CB 1.368 39.778 38.487 -0.128 0.000 1.180 46 N HN -0.043 8.337 8.380 -0.000 0.000 0.484 47 E N 0.462 120.617 120.200 -0.075 0.000 2.465 47 E HA -0.083 4.269 4.350 0.003 0.000 0.260 47 E C -0.383 176.131 176.600 -0.143 0.000 0.980 47 E CA 0.038 56.385 56.400 -0.088 0.000 0.927 47 E CB 0.297 29.948 29.700 -0.082 0.000 0.934 47 E HN 0.749 9.109 8.360 -0.000 0.000 0.459 48 N N 1.784 120.406 118.700 -0.131 0.000 2.629 48 N HA 0.245 4.987 4.740 0.003 0.000 0.279 48 N C -0.910 174.493 175.510 -0.178 0.000 1.344 48 N CA -0.763 52.192 53.050 -0.159 0.000 0.789 48 N CB 0.996 39.413 38.487 -0.117 0.000 1.508 48 N HN 0.171 8.551 8.380 -0.000 0.000 0.516 49 V N 0.243 120.039 119.914 -0.196 0.000 2.637 49 V HA 0.323 4.445 4.120 0.003 0.000 0.296 49 V C 0.628 176.662 176.094 -0.101 0.000 1.046 49 V CA -0.461 61.744 62.300 -0.158 0.000 1.066 49 V CB 0.616 32.374 31.823 -0.109 0.000 0.968 49 V HN 0.839 9.029 8.190 -0.000 0.000 0.483 50 A N 6.947 129.733 122.820 -0.056 0.000 2.366 50 A HA 0.620 4.942 4.320 0.003 0.000 0.322 50 A C -0.246 177.196 177.584 -0.236 0.000 1.397 50 A CA -0.386 51.547 52.037 -0.174 0.000 0.984 50 A CB -0.316 18.630 19.000 -0.090 0.000 1.149 50 A HN 0.768 8.918 8.150 -0.000 0.000 0.540 51 I N 2.041 122.412 120.570 -0.330 0.000 2.371 51 I HA 0.182 4.354 4.170 0.003 0.000 0.290 51 I C 0.750 176.582 176.117 -0.475 0.000 1.028 51 I CA -0.151 60.989 61.300 -0.266 0.000 1.345 51 I CB 1.045 38.917 38.000 -0.213 0.000 1.407 51 I HN 0.800 9.010 8.210 -0.000 0.000 0.501 52 H N 2.814 121.834 119.070 -0.084 0.000 2.648 52 H HA 0.178 4.735 4.556 0.003 0.000 0.265 52 H C -0.034 175.300 175.328 0.010 0.000 0.961 52 H CA 0.094 56.125 56.048 -0.029 0.000 1.185 52 H CB 0.319 30.107 29.762 0.043 0.000 1.449 52 H HN 0.419 8.699 8.280 -0.000 0.000 0.523 53 N N 1.477 120.182 118.700 0.008 0.000 2.549 53 N HA 0.143 4.885 4.740 0.003 0.000 0.281 53 N C -2.727 172.700 175.510 -0.138 0.000 1.084 53 N CA -1.808 51.208 53.050 -0.055 0.000 0.862 53 N CB 1.365 39.849 38.487 -0.005 0.000 1.333 53 N HN -0.072 8.308 8.380 -0.000 0.000 0.523 54 P HA 0.141 4.561 4.420 -0.000 0.000 0.271 54 P C -0.437 176.651 177.300 -0.354 0.000 1.244 54 P CA -0.320 62.424 63.100 -0.594 0.000 0.793 54 P CB 0.535 31.363 31.700 -1.454 0.000 0.984 55 F N 2.626 122.370 119.950 -0.344 0.000 2.490 55 F HA 0.090 4.619 4.527 0.003 0.000 0.357 55 F C 0.785 176.573 175.800 -0.021 0.000 1.166 55 F CA -0.112 57.841 58.000 -0.079 0.000 1.116 55 F CB -0.246 38.798 39.000 0.074 0.000 1.171 55 F HN 0.216 8.516 8.300 -0.000 0.000 0.576 56 R N 3.556 123.650 120.500 -0.677 0.000 3.092 56 R HA -0.161 4.181 4.340 0.003 0.000 0.245 56 R C -2.617 173.471 176.300 -0.354 0.000 0.881 56 R CA 0.261 55.987 56.100 -0.624 0.000 0.614 56 R CB -2.353 27.453 30.300 -0.823 0.000 1.128 56 R HN 0.409 8.679 8.270 -0.000 0.000 0.483 57 P HA -0.052 4.368 4.420 -0.000 0.000 0.272 57 P C 1.555 178.556 177.300 -0.498 0.000 1.230 57 P CA -0.459 62.333 63.100 -0.514 0.000 0.788 57 P CB 0.237 31.093 31.700 -1.407 0.000 0.949 58 W N 3.491 124.651 121.300 -0.234 0.000 2.342 58 W HA -0.135 4.527 4.660 0.003 0.000 0.297 58 W C 1.582 178.194 176.519 0.155 0.000 1.213 58 W CA 0.942 58.286 57.345 -0.001 0.000 1.251 58 W CB -1.817 27.797 29.460 0.257 0.000 1.136 58 W HN 0.455 8.635 8.180 -0.000 0.000 0.526 59 W N 3.437 124.346 121.300 -0.652 0.000 2.961 59 W HA 0.027 4.689 4.660 0.003 0.000 0.240 59 W C 1.528 177.984 176.519 -0.105 0.000 1.305 59 W CA 0.867 57.893 57.345 -0.531 0.000 1.465 59 W CB -1.469 27.337 29.460 -1.090 0.000 1.135 59 W HN 0.252 8.432 8.180 -0.000 0.000 0.688 60 E N 1.676 121.811 120.200 -0.109 0.000 2.274 60 E HA -0.131 4.220 4.350 0.003 0.000 0.194 60 E C 1.834 178.441 176.600 0.011 0.000 0.996 60 E CA 0.545 56.917 56.400 -0.045 0.000 0.840 60 E CB -0.506 29.061 29.700 -0.222 0.000 0.772 60 E HN 0.246 8.606 8.360 -0.000 0.000 0.491 61 R N -0.360 120.146 120.500 0.011 0.000 2.280 61 R HA -0.026 4.316 4.340 0.003 0.000 0.207 61 R C 0.426 176.576 176.300 -0.249 0.000 1.043 61 R CA 0.704 56.731 56.100 -0.121 0.000 1.006 61 R CB -0.025 30.184 30.300 -0.152 0.000 0.885 61 R HN 0.302 8.572 8.270 -0.000 0.000 0.467 62 Y N 0.295 120.725 120.300 0.216 0.000 2.625 62 Y HA 0.199 4.750 4.550 0.003 0.000 0.285 62 Y C 0.111 176.175 175.900 0.274 0.000 1.168 62 Y CA 0.002 58.267 58.100 0.274 0.000 1.250 62 Y CB 0.529 39.195 38.460 0.342 0.000 1.130 62 Y HN -0.109 8.171 8.280 -0.000 0.000 0.526 63 Q N 1.088 121.009 119.800 0.201 0.000 2.932 63 Q HA 0.279 4.620 4.340 0.003 0.000 0.248 63 Q C -2.747 173.241 176.000 -0.020 0.000 0.982 63 Q CA -2.053 53.831 55.803 0.135 0.000 0.730 63 Q CB 1.419 30.223 28.738 0.109 0.000 1.249 63 Q HN 0.076 8.346 8.270 -0.000 0.000 0.476 64 P HA -0.021 4.399 4.420 -0.000 0.000 0.269 64 P C 0.130 177.267 177.300 -0.272 0.000 1.215 64 P CA 0.018 63.001 63.100 -0.194 0.000 0.780 64 P CB 1.242 32.804 31.700 -0.229 0.000 0.898 65 V N 0.084 119.811 119.914 -0.311 0.000 3.371 65 V HA 0.128 4.250 4.120 0.003 0.000 0.246 65 V C 0.725 176.700 176.094 -0.199 0.000 1.303 65 V CA 1.365 63.505 62.300 -0.267 0.000 1.156 65 V CB 0.599 32.153 31.823 -0.448 0.000 0.929 65 V HN 0.824 9.014 8.190 -0.000 0.000 0.459 66 S N -2.065 113.415 115.700 -0.368 0.000 2.724 66 S HA 0.453 4.925 4.470 0.003 0.000 0.278 66 S C -0.950 173.239 174.600 -0.687 0.000 1.190 66 S CA -0.344 57.575 58.200 -0.467 0.000 0.860 66 S CB 0.903 63.993 63.200 -0.183 0.000 1.206 66 S HN -0.029 8.281 8.310 -0.000 0.000 0.507 67 Y N 0.940 121.097 120.300 -0.239 0.000 2.636 67 Y HA 0.466 5.018 4.550 0.003 0.000 0.260 67 Y C 0.571 176.378 175.900 -0.155 0.000 1.177 67 Y CA -0.781 57.074 58.100 -0.408 0.000 1.209 67 Y CB 0.001 38.144 38.460 -0.528 0.000 1.166 67 Y HN 0.377 8.657 8.280 -0.000 0.000 0.531 68 K N 1.237 121.638 120.400 0.002 0.000 2.326 68 K HA 0.244 4.565 4.320 0.003 0.000 0.275 68 K C -0.253 176.383 176.600 0.060 0.000 1.018 68 K CA -0.154 56.171 56.287 0.064 0.000 0.962 68 K CB 0.812 33.338 32.500 0.044 0.000 0.953 68 K HN 0.163 8.413 8.250 -0.000 0.000 0.475 69 L N 3.479 124.754 121.223 0.086 0.000 2.399 69 L HA 0.190 4.532 4.340 0.003 0.000 0.257 69 L C -0.297 176.644 176.870 0.118 0.000 1.236 69 L CA -0.563 54.307 54.840 0.049 0.000 1.144 69 L CB -0.017 42.003 42.059 -0.065 0.000 1.379 69 L HN 0.586 8.816 8.230 -0.000 0.000 0.414 70 c N 2.382 121.043 118.600 0.102 0.000 2.892 70 c HA 0.637 5.209 4.570 0.003 0.000 0.360 70 c C 0.315 174.436 174.090 0.050 0.000 1.054 70 c CA -0.123 56.262 56.329 0.093 0.000 1.326 70 c CB 0.588 43.140 42.510 0.070 0.000 1.806 70 c HN 0.858 9.088 8.230 -0.000 0.000 0.490 71 T N 1.862 116.442 114.554 0.044 0.000 2.696 71 T HA 0.504 4.856 4.350 0.003 0.000 0.291 71 T C 0.933 175.568 174.700 -0.109 0.000 1.095 71 T CA -0.675 61.405 62.100 -0.033 0.000 1.026 71 T CB 1.103 69.963 68.868 -0.014 0.000 1.390 71 T HN 0.535 8.775 8.240 -0.000 0.000 0.513 72 R N 0.119 120.527 120.500 -0.153 0.000 2.237 72 R HA 0.029 4.371 4.340 0.003 0.000 0.219 72 R C 2.036 178.161 176.300 -0.292 0.000 1.080 72 R CA 0.980 56.971 56.100 -0.182 0.000 0.995 72 R CB -0.394 29.803 30.300 -0.172 0.000 0.875 72 R HN 0.553 8.823 8.270 -0.000 0.000 0.462 73 S N -0.543 114.868 115.700 -0.482 0.000 2.470 73 S HA 0.135 4.606 4.470 0.003 0.000 0.225 73 S C 0.766 174.751 174.600 -1.024 0.000 1.006 73 S CA 0.686 58.309 58.200 -0.962 0.000 0.934 73 S CB 0.711 62.764 63.200 -1.911 0.000 0.778 73 S HN 0.640 8.950 8.310 -0.000 0.000 0.517 74 G N 1.372 109.852 108.800 -0.533 0.000 2.369 74 G HA2 0.174 4.136 3.960 0.003 0.000 0.293 74 G HA3 0.174 4.136 3.960 0.003 0.000 0.293 74 G C -1.487 173.554 174.900 0.234 0.000 1.301 74 G CA -0.632 44.413 45.100 -0.091 0.000 0.913 74 G HN 0.333 8.623 8.290 -0.000 0.000 0.540 75 N N -0.806 118.072 118.700 0.297 0.000 2.604 75 N HA 0.441 5.183 4.740 0.003 0.000 0.297 75 N C 1.013 176.722 175.510 0.331 0.000 1.266 75 N CA 0.062 53.268 53.050 0.261 0.000 0.961 75 N CB 1.126 39.712 38.487 0.165 0.000 1.166 75 N HN 0.750 9.130 8.380 -0.000 0.000 0.601 76 E N -0.865 119.472 120.200 0.229 0.000 2.077 76 E HA -0.226 4.126 4.350 0.003 0.000 0.193 76 E C 0.377 177.110 176.600 0.221 0.000 0.989 76 E CA 1.394 57.921 56.400 0.212 0.000 0.800 76 E CB -0.095 29.715 29.700 0.183 0.000 0.746 76 E HN 0.536 8.896 8.360 -0.000 0.000 0.452 77 D N 0.510 121.022 120.400 0.187 0.000 2.117 77 D HA -0.173 4.469 4.640 0.003 0.000 0.197 77 D C 1.758 178.153 176.300 0.159 0.000 0.987 77 D CA 1.221 55.312 54.000 0.152 0.000 0.829 77 D CB -0.148 40.726 40.800 0.123 0.000 0.961 77 D HN 0.390 8.760 8.370 -0.000 0.000 0.460 78 E N -0.180 120.153 120.200 0.222 0.000 2.106 78 E HA -0.130 4.221 4.350 0.003 0.000 0.192 78 E C 1.928 178.664 176.600 0.226 0.000 0.984 78 E CA 0.320 56.874 56.400 0.257 0.000 0.806 78 E CB -0.181 29.733 29.700 0.356 0.000 0.750 78 E HN 0.216 8.576 8.360 -0.000 0.000 0.458 79 F N 1.936 121.906 119.950 0.033 0.000 2.102 79 F HA -0.146 4.383 4.527 0.003 0.000 0.298 79 F C 2.252 177.905 175.800 -0.245 0.000 1.105 79 F CA 1.515 59.265 58.000 -0.417 0.000 1.239 79 F CB 0.077 38.743 39.000 -0.557 0.000 0.991 79 F HN -0.216 8.084 8.300 -0.000 0.000 0.474 80 R N 0.176 120.685 120.500 0.015 0.000 2.091 80 R HA -0.221 4.121 4.340 0.003 0.000 0.238 80 R C 2.301 178.550 176.300 -0.085 0.000 1.136 80 R CA 1.503 57.584 56.100 -0.032 0.000 0.959 80 R CB -0.929 29.425 30.300 0.090 0.000 0.856 80 R HN 0.438 8.708 8.270 -0.000 0.000 0.437 81 N N 1.019 119.698 118.700 -0.034 0.000 2.120 81 N HA -0.217 4.525 4.740 0.003 0.000 0.188 81 N C 1.854 177.311 175.510 -0.089 0.000 1.024 81 N CA 1.390 54.428 53.050 -0.020 0.000 0.852 81 N CB 0.001 38.507 38.487 0.031 0.000 1.003 81 N HN 0.222 8.602 8.380 -0.000 0.000 0.424 82 M N 0.824 120.328 119.600 -0.160 0.000 2.067 82 M HA -0.154 4.328 4.480 0.003 0.000 0.260 82 M C 2.006 178.099 176.300 -0.345 0.000 1.069 82 M CA 1.515 56.679 55.300 -0.227 0.000 1.117 82 M CB -0.146 32.290 32.600 -0.274 0.000 1.334 82 M HN -0.026 8.264 8.290 -0.000 0.000 0.407 83 V N 0.548 120.151 119.914 -0.518 0.000 2.332 83 V HA -0.271 3.851 4.120 0.003 0.000 0.248 83 V C 2.333 178.151 176.094 -0.460 0.000 1.055 83 V CA 2.366 64.339 62.300 -0.545 0.000 1.038 83 V CB -1.343 30.108 31.823 -0.620 0.000 0.651 83 V HN 0.602 8.792 8.190 -0.000 0.000 0.450 84 T N -0.286 114.117 114.554 -0.251 0.000 2.674 84 T HA -0.205 4.147 4.350 0.003 0.000 0.265 84 T C 2.088 176.734 174.700 -0.089 0.000 1.039 84 T CA 1.686 63.751 62.100 -0.058 0.000 1.150 84 T CB -0.248 68.701 68.868 0.135 0.000 0.864 84 T HN 0.416 8.656 8.240 -0.000 0.000 0.427 85 R N 0.068 120.510 120.500 -0.096 0.000 2.081 85 R HA -0.035 4.306 4.340 0.003 0.000 0.235 85 R C 2.825 179.050 176.300 -0.125 0.000 1.131 85 R CA 1.402 57.460 56.100 -0.070 0.000 0.960 85 R CB -0.769 29.504 30.300 -0.046 0.000 0.856 85 R HN 0.379 8.649 8.270 -0.000 0.000 0.436 86 c N 0.648 119.127 118.600 -0.202 0.000 2.453 86 c HA -0.027 4.545 4.570 0.003 0.000 0.277 86 c C 2.322 176.234 174.090 -0.296 0.000 1.262 86 c CA 0.462 56.658 56.329 -0.221 0.000 1.718 86 c CB -0.991 41.370 42.510 -0.248 0.000 2.031 86 c HN 0.509 8.739 8.230 -0.000 0.000 0.480 87 N N 1.610 120.007 118.700 -0.505 0.000 2.104 87 N HA -0.100 4.642 4.740 0.003 0.000 0.190 87 N C 1.318 176.563 175.510 -0.443 0.000 1.024 87 N CA 1.183 53.754 53.050 -0.799 0.000 0.853 87 N CB -0.658 36.691 38.487 -1.897 0.000 1.008 87 N HN 0.510 8.890 8.380 -0.000 0.000 0.424 88 N N 0.249 118.851 118.700 -0.162 0.000 2.364 88 N HA -0.088 4.654 4.740 0.003 0.000 0.183 88 N C 1.339 176.848 175.510 -0.002 0.000 1.022 88 N CA 0.621 53.710 53.050 0.065 0.000 0.883 88 N CB 0.005 38.562 38.487 0.118 0.000 0.965 88 N HN 0.278 8.658 8.380 -0.000 0.000 0.438 89 V N -4.221 115.658 119.914 -0.058 0.000 3.376 89 V HA 0.543 4.665 4.120 0.003 0.000 0.313 89 V C 1.086 177.150 176.094 -0.051 0.000 1.393 89 V CA 0.117 62.395 62.300 -0.037 0.000 1.125 89 V CB -0.148 31.660 31.823 -0.025 0.000 1.037 89 V HN 0.176 8.366 8.190 -0.000 0.000 0.440 90 G N 0.326 109.072 108.800 -0.090 0.000 2.147 90 G HA2 -0.190 3.772 3.960 0.003 0.000 0.244 90 G HA3 -0.190 3.772 3.960 0.003 0.000 0.244 90 G C -0.059 174.796 174.900 -0.075 0.000 1.005 90 G CA 0.149 45.197 45.100 -0.087 0.000 0.713 90 G HN 0.959 9.249 8.290 -0.000 0.000 0.515 91 V N 1.971 121.821 119.914 -0.108 0.000 2.357 91 V HA 0.576 4.698 4.120 0.003 0.000 0.284 91 V C 0.571 176.575 176.094 -0.151 0.000 1.018 91 V CA -1.299 60.957 62.300 -0.073 0.000 0.841 91 V CB 1.402 33.196 31.823 -0.049 0.000 0.991 91 V HN 0.338 8.527 8.190 -0.000 0.000 0.437 92 R N 4.176 124.612 120.500 -0.106 0.000 2.560 92 R HA 0.561 4.903 4.340 0.003 0.000 0.270 92 R C -0.617 175.470 176.300 -0.355 0.000 1.074 92 R CA -0.680 55.270 56.100 -0.250 0.000 1.140 92 R CB 1.060 31.211 30.300 -0.249 0.000 1.073 92 R HN 0.430 8.700 8.270 -0.000 0.000 0.527 93 I N 2.454 122.681 120.570 -0.571 0.000 2.433 93 I HA 0.304 4.476 4.170 0.003 0.000 0.292 93 I C -0.714 174.958 176.117 -0.741 0.000 1.001 93 I CA -0.914 60.085 61.300 -0.501 0.000 1.119 93 I CB 1.198 38.929 38.000 -0.449 0.000 1.289 93 I HN 0.428 8.638 8.210 -0.000 0.000 0.438 94 Y N 4.608 124.861 120.300 -0.078 0.000 2.350 94 Y HA 0.476 5.028 4.550 0.003 0.000 0.338 94 Y C 0.175 176.035 175.900 -0.066 0.000 0.961 94 Y CA -0.934 57.116 58.100 -0.084 0.000 1.100 94 Y CB 1.932 40.476 38.460 0.141 0.000 1.179 94 Y HN 0.180 8.460 8.280 -0.000 0.000 0.454 95 V N 3.082 122.968 119.914 -0.046 0.000 2.509 95 V HA 0.112 4.234 4.120 0.003 0.000 0.284 95 V C -0.186 176.004 176.094 0.160 0.000 1.047 95 V CA -0.672 61.681 62.300 0.090 0.000 0.952 95 V CB 1.468 33.353 31.823 0.104 0.000 0.988 95 V HN 0.670 8.860 8.190 -0.000 0.000 0.469 96 D N 4.266 124.772 120.400 0.177 0.000 2.352 96 D HA 0.326 4.968 4.640 0.003 0.000 0.245 96 D C 0.083 176.502 176.300 0.199 0.000 1.224 96 D CA -0.089 54.013 54.000 0.170 0.000 0.879 96 D CB 1.184 42.110 40.800 0.210 0.000 1.057 96 D HN 0.669 9.039 8.370 -0.000 0.000 0.491 97 A N 4.288 127.211 122.820 0.173 0.000 2.316 97 A HA 0.395 4.717 4.320 0.003 0.000 0.311 97 A C -0.153 177.507 177.584 0.126 0.000 1.339 97 A CA -0.674 51.453 52.037 0.150 0.000 0.960 97 A CB 0.532 19.525 19.000 -0.012 0.000 1.152 97 A HN 0.385 8.535 8.150 -0.000 0.000 0.547 98 V N 5.453 125.453 119.914 0.142 0.000 2.304 98 V HA 0.180 4.302 4.120 0.003 0.000 0.262 98 V C 0.860 176.936 176.094 -0.031 0.000 1.061 98 V CA 0.314 62.641 62.300 0.045 0.000 0.872 98 V CB -0.262 31.591 31.823 0.051 0.000 1.077 98 V HN 0.876 9.066 8.190 -0.000 0.000 0.480 99 I N 0.887 121.418 120.570 -0.064 0.000 4.240 99 I HA 0.343 4.515 4.170 0.003 0.000 0.331 99 I C 1.473 177.541 176.117 -0.082 0.000 1.381 99 I CA 0.211 61.480 61.300 -0.050 0.000 1.136 99 I CB 0.212 38.188 38.000 -0.041 0.000 1.137 99 I HN 0.474 8.684 8.210 -0.000 0.000 0.411 100 N N 1.583 120.207 118.700 -0.125 0.000 2.300 100 N HA -0.072 4.670 4.740 0.003 0.000 0.179 100 N C 0.640 176.173 175.510 0.038 0.000 1.016 100 N CA 1.114 54.168 53.050 0.008 0.000 0.876 100 N CB 0.151 38.742 38.487 0.174 0.000 0.979 100 N HN 0.690 9.070 8.380 -0.000 0.000 0.432 101 H N -3.502 115.582 119.070 0.025 0.000 2.942 101 H HA 0.341 4.898 4.556 0.003 0.000 0.316 101 H C -0.411 174.904 175.328 -0.021 0.000 1.323 101 H CA -0.915 55.141 56.048 0.012 0.000 1.144 101 H CB 0.627 30.400 29.762 0.018 0.000 1.866 101 H HN -0.165 8.115 8.280 -0.000 0.000 0.545 102 M N 0.693 120.364 119.600 0.119 0.000 2.325 102 M HA 0.305 4.787 4.480 0.003 0.000 0.220 102 M C 0.973 177.313 176.300 0.065 0.000 0.728 102 M CA -0.408 54.832 55.300 -0.100 0.000 1.790 102 M CB 0.131 32.409 32.600 -0.536 0.000 1.150 102 M HN 0.864 9.154 8.290 -0.000 0.000 0.887 103 C N -0.009 119.313 119.300 0.037 0.000 2.452 103 C HA 0.807 5.268 4.460 0.003 0.000 0.358 103 C C 1.002 176.050 174.990 0.096 0.000 1.404 103 C CA -0.885 58.191 59.018 0.097 0.000 2.242 103 C CB -0.489 27.301 27.740 0.084 0.000 2.090 103 C HN 0.834 9.064 8.230 -0.000 0.000 0.596 104 G N 1.252 110.097 108.800 0.075 0.000 2.432 104 G HA2 0.155 4.117 3.960 0.003 0.000 0.239 104 G HA3 0.155 4.117 3.960 0.003 0.000 0.239 104 G C 0.886 175.814 174.900 0.047 0.000 1.291 104 G CA 0.188 45.306 45.100 0.031 0.000 0.863 104 G HN 1.068 9.358 8.290 -0.000 0.000 0.560 105 N N 1.202 119.903 118.700 0.001 0.000 2.515 105 N HA -0.012 4.730 4.740 0.003 0.000 0.185 105 N C 1.466 176.966 175.510 -0.016 0.000 1.109 105 N CA 0.787 53.827 53.050 -0.016 0.000 0.903 105 N CB 0.197 38.655 38.487 -0.049 0.000 0.969 105 N HN 0.398 8.778 8.380 -0.000 0.000 0.450 106 A N 0.527 123.343 122.820 -0.006 0.000 2.390 106 A HA 0.329 4.651 4.320 0.003 0.000 0.232 106 A C 0.720 178.309 177.584 0.009 0.000 1.233 106 A CA -0.371 51.660 52.037 -0.010 0.000 0.907 106 A CB 0.242 19.232 19.000 -0.017 0.000 0.967 106 A HN 0.087 8.237 8.150 -0.000 0.000 0.512 107 V N 1.602 121.542 119.914 0.044 0.000 3.237 107 V HA 0.211 4.333 4.120 0.003 0.000 0.305 107 V C 1.045 177.154 176.094 0.025 0.000 1.096 107 V CA 0.470 62.819 62.300 0.082 0.000 1.130 107 V CB 1.448 33.377 31.823 0.177 0.000 1.048 107 V HN 0.619 8.809 8.190 -0.000 0.000 0.484 108 S N 2.886 118.584 115.700 -0.004 0.000 2.508 108 S HA 0.731 5.202 4.470 0.003 0.000 0.284 108 S C -0.054 174.371 174.600 -0.291 0.000 1.192 108 S CA -0.305 57.833 58.200 -0.104 0.000 1.070 108 S CB 1.384 64.541 63.200 -0.071 0.000 1.004 108 S HN 1.264 9.574 8.310 -0.000 0.000 0.493 109 A N 2.713 125.319 122.820 -0.357 0.000 2.507 109 A HA 0.676 4.998 4.320 0.003 0.000 0.235 109 A C 1.104 178.351 177.584 -0.562 0.000 1.070 109 A CA 0.430 52.094 52.037 -0.622 0.000 0.768 109 A CB -0.756 18.006 19.000 -0.397 0.000 1.011 109 A HN 2.235 10.385 8.150 -0.000 0.000 0.502 110 G N -0.780 107.529 108.800 -0.818 0.000 2.288 110 G HA2 0.392 4.354 3.960 0.003 0.000 0.227 110 G HA3 0.392 4.354 3.960 0.003 0.000 0.227 110 G C 0.109 174.805 174.900 -0.339 0.000 1.339 110 G CA 0.693 45.593 45.100 -0.334 0.000 1.057 110 G HN 1.902 10.192 8.290 -0.000 0.000 0.470 111 T N -2.554 111.977 114.554 -0.039 0.000 3.339 111 T HA 0.528 4.879 4.350 0.003 0.000 0.292 111 T C 0.741 175.549 174.700 0.180 0.000 1.012 111 T CA 1.080 63.257 62.100 0.127 0.000 0.937 111 T CB 0.647 69.606 68.868 0.152 0.000 1.164 111 T HN 1.235 9.475 8.240 -0.000 0.000 0.509 112 S N 2.835 118.654 115.700 0.197 0.000 4.183 112 S HA 0.452 4.924 4.470 0.003 0.000 0.195 112 S C 0.320 175.105 174.600 0.309 0.000 1.421 112 S CA -0.490 57.850 58.200 0.234 0.000 0.920 112 S CB -1.035 62.290 63.200 0.208 0.000 1.525 112 S HN 0.778 9.088 8.310 -0.000 0.000 0.447 113 S N 0.793 116.635 115.700 0.238 0.000 2.634 113 S HA 0.416 4.888 4.470 0.003 0.000 0.296 113 S C 1.120 175.752 174.600 0.053 0.000 1.104 113 S CA -0.318 57.948 58.200 0.111 0.000 0.920 113 S CB 1.137 64.412 63.200 0.126 0.000 1.111 113 S HN 0.446 8.756 8.310 -0.000 0.000 0.493 114 T N -3.126 111.424 114.554 -0.006 0.000 3.051 114 T HA -0.052 4.300 4.350 0.003 0.000 0.269 114 T C 1.085 175.795 174.700 0.017 0.000 1.127 114 T CA 0.868 62.962 62.100 -0.009 0.000 1.107 114 T CB -0.605 68.237 68.868 -0.043 0.000 0.898 114 T HN 0.622 8.862 8.240 -0.000 0.000 0.517 115 c N 0.706 119.325 118.600 0.032 0.000 3.385 115 c HA 0.677 5.249 4.570 0.003 0.000 0.288 115 c C 2.031 176.162 174.090 0.067 0.000 1.429 115 c CA -0.152 56.204 56.329 0.046 0.000 1.778 115 c CB -0.977 41.558 42.510 0.041 0.000 2.503 115 c HN 0.886 9.116 8.230 -0.000 0.000 0.646 116 G N 1.522 110.374 108.800 0.087 0.000 2.162 116 G HA2 -0.229 3.732 3.960 0.003 0.000 0.260 116 G HA3 -0.229 3.732 3.960 0.003 0.000 0.260 116 G C 0.244 175.230 174.900 0.145 0.000 0.976 116 G CA 0.607 45.773 45.100 0.110 0.000 0.655 116 G HN 0.574 8.864 8.290 -0.000 0.000 0.533 117 S N -0.325 115.465 115.700 0.150 0.000 2.560 117 S HA 0.387 4.859 4.470 0.003 0.000 0.284 117 S C 0.042 174.822 174.600 0.301 0.000 1.327 117 S CA -0.201 58.112 58.200 0.189 0.000 1.055 117 S CB 0.756 64.041 63.200 0.142 0.000 0.868 117 S HN 0.570 8.880 8.310 -0.000 0.000 0.506 118 Y N 3.882 124.272 120.300 0.149 0.000 2.301 118 Y HA 0.560 5.111 4.550 0.002 0.000 0.325 118 Y C -0.477 175.523 175.900 0.166 0.000 1.203 118 Y CA -0.963 57.187 58.100 0.084 0.000 1.255 118 Y CB 0.410 38.865 38.460 -0.009 0.000 1.232 118 Y HN 0.578 8.858 8.280 -0.000 0.000 0.501 119 F N 3.203 122.564 119.950 -0.982 0.000 2.678 119 F HA 0.457 4.985 4.527 0.003 0.000 0.308 119 F C -2.009 173.136 175.800 -1.090 0.000 1.118 119 F CA -1.343 56.121 58.000 -0.893 0.000 0.959 119 F CB 1.296 39.957 39.000 -0.565 0.000 1.305 119 F HN 0.403 8.703 8.300 -0.000 0.000 0.443 120 N N 2.936 121.094 118.700 -0.902 0.000 2.607 120 N HA 0.442 5.183 4.740 0.003 0.000 0.271 120 N C -2.640 172.584 175.510 -0.477 0.000 1.142 120 N CA -2.336 50.328 53.050 -0.643 0.000 0.810 120 N CB 2.175 40.421 38.487 -0.402 0.000 1.306 120 N HN 0.283 8.663 8.380 -0.000 0.000 0.536 121 P HA 0.037 4.457 4.420 -0.000 0.000 0.218 121 P C 1.261 178.474 177.300 -0.146 0.000 1.149 121 P CA 0.914 63.928 63.100 -0.144 0.000 0.817 121 P CB 0.256 31.975 31.700 0.032 0.000 0.785 122 G N -0.041 108.671 108.800 -0.147 0.000 2.422 122 G HA2 -0.207 3.755 3.960 0.003 0.000 0.218 122 G HA3 -0.207 3.755 3.960 0.003 0.000 0.218 122 G C 1.466 176.298 174.900 -0.114 0.000 1.140 122 G CA 1.185 46.217 45.100 -0.114 0.000 0.775 122 G HN 0.431 8.721 8.290 -0.000 0.000 0.545 123 S N -1.427 114.195 115.700 -0.130 0.000 2.540 123 S HA 0.304 4.776 4.470 0.003 0.000 0.218 123 S C 1.083 175.627 174.600 -0.093 0.000 0.977 123 S CA 0.215 58.358 58.200 -0.096 0.000 0.918 123 S CB 0.421 63.583 63.200 -0.062 0.000 0.806 123 S HN 0.262 8.572 8.310 -0.000 0.000 0.496 124 R N 1.151 121.562 120.500 -0.150 0.000 3.532 124 R HA -0.107 4.234 4.340 0.003 0.000 0.284 124 R C -1.302 175.079 176.300 0.135 0.000 1.140 124 R CA 0.886 56.919 56.100 -0.112 0.000 0.768 124 R CB -2.183 28.021 30.300 -0.160 0.000 1.252 124 R HN 0.520 8.790 8.270 -0.000 0.000 0.454 125 D N 0.095 120.427 120.400 -0.113 0.000 2.373 125 D HA 0.207 4.849 4.640 0.003 0.000 0.227 125 D C -0.665 175.448 176.300 -0.312 0.000 1.091 125 D CA -0.082 53.889 54.000 -0.047 0.000 0.840 125 D CB 0.345 41.114 40.800 -0.052 0.000 1.060 125 D HN 0.039 8.409 8.370 -0.000 0.000 0.502 126 F N 4.241 124.339 119.950 0.247 0.000 2.622 126 F HA 0.277 4.805 4.527 0.003 0.000 0.338 126 F C -1.665 174.234 175.800 0.165 0.000 1.334 126 F CA -1.629 56.502 58.000 0.219 0.000 1.179 126 F CB 1.661 40.833 39.000 0.286 0.000 1.471 126 F HN 0.215 8.515 8.300 -0.000 0.000 0.576 127 P HA -0.217 4.203 4.420 -0.000 0.000 0.218 127 P C 1.569 178.959 177.300 0.150 0.000 1.146 127 P CA 1.391 64.610 63.100 0.198 0.000 0.813 127 P CB 0.310 32.132 31.700 0.202 0.000 0.778 128 A N -1.230 121.677 122.820 0.144 0.000 2.168 128 A HA -0.048 4.274 4.320 0.003 0.000 0.215 128 A C 2.083 179.676 177.584 0.015 0.000 1.152 128 A CA 1.079 53.163 52.037 0.079 0.000 0.716 128 A CB -1.230 17.812 19.000 0.071 0.000 0.794 128 A HN 0.043 8.193 8.150 -0.000 0.000 0.465 129 V N 0.504 120.404 119.914 -0.022 0.000 2.283 129 V HA 0.031 4.153 4.120 0.003 0.000 0.239 129 V C -1.458 174.586 176.094 -0.083 0.000 1.035 129 V CA 1.253 63.450 62.300 -0.172 0.000 1.018 129 V CB -1.037 30.456 31.823 -0.549 0.000 0.658 129 V HN 0.472 8.662 8.190 -0.000 0.000 0.459 130 P HA 0.428 4.848 4.420 -0.000 0.000 0.290 130 P C -1.940 175.431 177.300 0.119 0.000 1.283 130 P CA -0.290 62.853 63.100 0.072 0.000 0.869 130 P CB 1.431 33.223 31.700 0.153 0.000 1.100 131 Y N -0.522 119.997 120.300 0.365 0.000 2.512 131 Y HA 0.523 5.074 4.550 0.003 0.000 0.348 131 Y C 0.832 177.020 175.900 0.479 0.000 0.990 131 Y CA -0.445 57.899 58.100 0.406 0.000 1.033 131 Y CB 2.290 40.954 38.460 0.342 0.000 1.259 131 Y HN 0.479 8.759 8.280 -0.000 0.000 0.461 132 S N -0.768 115.314 115.700 0.637 0.000 2.811 132 S HA 0.607 5.078 4.470 0.003 0.000 0.311 132 S C 1.051 175.976 174.600 0.541 0.000 1.152 132 S CA -0.306 58.196 58.200 0.503 0.000 0.864 132 S CB 1.291 64.730 63.200 0.398 0.000 1.226 132 S HN 0.858 9.168 8.310 -0.000 0.000 0.541 133 G N -0.429 108.542 108.800 0.285 0.000 2.479 133 G HA2 -0.136 3.826 3.960 0.003 0.000 0.220 133 G HA3 -0.136 3.826 3.960 0.003 0.000 0.220 133 G C 0.579 175.521 174.900 0.071 0.000 1.115 133 G CA 0.317 45.492 45.100 0.125 0.000 0.757 133 G HN 0.772 9.062 8.290 -0.000 0.000 0.560 134 W N 0.509 121.936 121.300 0.211 0.000 3.077 134 W HA 0.235 4.895 4.660 0.000 0.000 0.245 134 W C 0.915 177.490 176.519 0.093 0.000 1.316 134 W CA -0.095 57.326 57.345 0.126 0.000 1.537 134 W CB 0.526 30.030 29.460 0.073 0.000 1.131 134 W HN 0.086 8.266 8.180 -0.000 0.000 0.695 135 D N -1.255 119.293 120.400 0.246 0.000 2.431 135 D HA 0.117 4.758 4.640 0.003 0.000 0.213 135 D C -0.374 175.593 176.300 -0.556 0.000 1.130 135 D CA 0.252 54.181 54.000 -0.119 0.000 0.834 135 D CB 0.023 40.730 40.800 -0.155 0.000 0.985 135 D HN -0.011 8.359 8.370 -0.000 0.000 0.504 136 F N 0.365 120.327 119.950 0.020 0.000 2.556 136 F HA 0.319 4.848 4.527 0.002 0.000 0.327 136 F C 1.420 177.227 175.800 0.012 0.000 1.059 136 F CA -1.033 56.958 58.000 -0.014 0.000 0.953 136 F CB 0.947 39.941 39.000 -0.011 0.000 1.227 136 F HN -0.386 7.914 8.300 -0.000 0.000 0.478 137 N N 0.966 119.778 118.700 0.185 0.000 2.515 137 N HA -0.083 4.659 4.740 0.003 0.000 0.191 137 N C 0.965 176.539 175.510 0.105 0.000 1.182 137 N CA 0.408 53.533 53.050 0.125 0.000 0.879 137 N CB -0.373 38.184 38.487 0.115 0.000 0.984 137 N HN 0.549 8.929 8.380 -0.000 0.000 0.453 138 D N 0.397 120.862 120.400 0.108 0.000 2.191 138 D HA -0.189 4.453 4.640 0.003 0.000 0.190 138 D C 1.817 178.139 176.300 0.035 0.000 1.007 138 D CA 1.590 55.621 54.000 0.053 0.000 0.865 138 D CB -0.439 40.376 40.800 0.025 0.000 0.929 138 D HN 0.378 8.748 8.370 -0.000 0.000 0.447 139 G N 0.136 108.959 108.800 0.039 0.000 2.448 139 G HA2 -0.223 3.739 3.960 0.003 0.000 0.218 139 G HA3 -0.223 3.739 3.960 0.003 0.000 0.218 139 G C 1.611 176.539 174.900 0.047 0.000 1.135 139 G CA 0.457 45.577 45.100 0.034 0.000 0.784 139 G HN 0.245 8.535 8.290 -0.000 0.000 0.543 140 K N -0.611 119.827 120.400 0.062 0.000 2.167 140 K HA 0.036 4.357 4.320 0.003 0.000 0.203 140 K C 1.086 177.727 176.600 0.068 0.000 1.052 140 K CA -0.062 56.267 56.287 0.070 0.000 0.956 140 K CB -0.180 32.376 32.500 0.092 0.000 0.735 140 K HN 0.299 8.549 8.250 -0.000 0.000 0.451 141 c N 2.485 121.121 118.600 0.060 0.000 2.676 141 c HA 0.088 4.660 4.570 0.003 0.000 0.416 141 c C 1.060 175.169 174.090 0.031 0.000 1.299 141 c CA -0.060 56.296 56.329 0.045 0.000 2.048 141 c CB 0.023 42.553 42.510 0.033 0.000 2.713 141 c HN 0.550 8.780 8.230 -0.000 0.000 0.624 142 K N 2.410 122.825 120.400 0.024 0.000 2.469 142 K HA 0.206 4.528 4.320 0.003 0.000 0.204 142 K C 0.273 176.877 176.600 0.006 0.000 1.047 142 K CA -0.140 56.157 56.287 0.017 0.000 1.072 142 K CB -0.058 32.455 32.500 0.021 0.000 0.863 142 K HN 0.725 8.975 8.250 -0.000 0.000 0.530 143 T N -2.624 111.930 114.554 -0.000 0.000 2.882 143 T HA 0.305 4.656 4.350 0.003 0.000 0.287 143 T C 1.376 176.071 174.700 -0.008 0.000 1.014 143 T CA -0.300 61.795 62.100 -0.009 0.000 1.049 143 T CB 1.628 70.485 68.868 -0.019 0.000 1.001 143 T HN 0.181 8.421 8.240 -0.000 0.000 0.525 144 G N 0.340 109.135 108.800 -0.009 0.000 2.443 144 G HA2 -0.131 3.831 3.960 0.003 0.000 0.219 144 G HA3 -0.131 3.831 3.960 0.003 0.000 0.219 144 G C 1.596 176.489 174.900 -0.013 0.000 1.131 144 G CA 0.757 45.851 45.100 -0.009 0.000 0.775 144 G HN 0.933 9.223 8.290 -0.000 0.000 0.547 145 S N -1.480 114.211 115.700 -0.016 0.000 2.497 145 S HA 0.383 4.855 4.470 0.003 0.000 0.218 145 S C 1.894 176.481 174.600 -0.022 0.000 1.023 145 S CA 1.036 59.224 58.200 -0.020 0.000 0.913 145 S CB 0.232 63.419 63.200 -0.023 0.000 0.800 145 S HN 1.469 9.779 8.310 -0.000 0.000 0.505 146 G N 0.809 109.598 108.800 -0.019 0.000 2.176 146 G HA2 -0.174 3.787 3.960 0.003 0.000 0.253 146 G HA3 -0.174 3.787 3.960 0.003 0.000 0.253 146 G C -0.412 174.474 174.900 -0.022 0.000 0.979 146 G CA 0.287 45.377 45.100 -0.016 0.000 0.641 146 G HN 0.568 8.858 8.290 -0.000 0.000 0.530 147 D N -0.420 119.961 120.400 -0.031 0.000 2.384 147 D HA 0.607 5.249 4.640 0.003 0.000 0.250 147 D C 0.927 177.194 176.300 -0.054 0.000 1.029 147 D CA -0.664 53.309 54.000 -0.044 0.000 0.990 147 D CB 0.920 41.692 40.800 -0.046 0.000 1.175 147 D HN 0.192 8.562 8.370 -0.000 0.000 0.532 148 I N 1.242 121.769 120.570 -0.072 0.000 2.533 148 I HA 0.004 4.176 4.170 0.003 0.000 0.284 148 I C 1.276 177.344 176.117 -0.082 0.000 1.109 148 I CA 0.651 61.879 61.300 -0.120 0.000 1.412 148 I CB 0.570 38.460 38.000 -0.183 0.000 1.396 148 I HN 0.348 8.558 8.210 -0.000 0.000 0.543 149 E N 3.308 123.454 120.200 -0.090 0.000 2.391 149 E HA 0.097 4.448 4.350 0.003 0.000 0.206 149 E C 0.002 176.594 176.600 -0.013 0.000 0.851 149 E CA 0.037 56.417 56.400 -0.033 0.000 1.059 149 E CB 0.580 30.265 29.700 -0.025 0.000 1.065 149 E HN 0.499 8.859 8.360 -0.000 0.000 0.512 150 N N -0.461 118.196 118.700 -0.071 0.000 2.430 150 N HA 0.085 4.827 4.740 0.003 0.000 0.290 150 N C -1.059 174.381 175.510 -0.116 0.000 1.063 150 N CA -0.331 52.707 53.050 -0.020 0.000 0.883 150 N CB 0.774 39.257 38.487 -0.007 0.000 1.465 150 N HN -0.097 8.283 8.380 -0.000 0.000 0.493 151 Y N 1.507 121.796 120.300 -0.017 0.000 2.529 151 Y HA 0.202 4.755 4.550 0.004 0.000 0.290 151 Y C 1.396 177.278 175.900 -0.030 0.000 1.177 151 Y CA 0.241 58.323 58.100 -0.030 0.000 1.305 151 Y CB 0.137 38.577 38.460 -0.034 0.000 1.047 151 Y HN 0.528 8.808 8.280 -0.000 0.000 0.522 152 N N -0.262 118.475 118.700 0.061 0.000 2.353 152 N HA -0.065 4.676 4.740 0.003 0.000 0.185 152 N C -0.327 175.186 175.510 0.005 0.000 1.098 152 N CA 0.533 53.606 53.050 0.038 0.000 0.872 152 N CB 0.233 38.741 38.487 0.035 0.000 0.970 152 N HN 0.237 8.617 8.380 -0.000 0.000 0.467 153 D N 0.273 120.655 120.400 -0.029 0.000 2.460 153 D HA 0.374 5.016 4.640 0.003 0.000 0.232 153 D C 0.834 177.088 176.300 -0.076 0.000 1.079 153 D CA -0.524 53.455 54.000 -0.036 0.000 0.864 153 D CB 1.175 41.955 40.800 -0.034 0.000 1.048 153 D HN 0.020 8.390 8.370 -0.000 0.000 0.523 154 A N 2.974 125.764 122.820 -0.049 0.000 1.948 154 A HA -0.192 4.129 4.320 0.003 0.000 0.220 154 A C 1.975 179.455 177.584 -0.174 0.000 1.177 154 A CA 2.011 53.980 52.037 -0.114 0.000 0.636 154 A CB -0.608 18.366 19.000 -0.042 0.000 0.815 154 A HN 0.601 8.751 8.150 -0.000 0.000 0.449 155 T N 0.665 115.226 114.554 0.012 0.000 2.777 155 T HA -0.185 4.167 4.350 0.003 0.000 0.266 155 T C 2.087 176.796 174.700 0.015 0.000 1.040 155 T CA 1.656 63.836 62.100 0.134 0.000 1.141 155 T CB -0.360 68.650 68.868 0.236 0.000 0.868 155 T HN 0.876 9.116 8.240 -0.000 0.000 0.444 156 Q N 1.024 120.796 119.800 -0.046 0.000 2.123 156 Q HA -0.013 4.329 4.340 0.003 0.000 0.199 156 Q C 2.270 178.184 176.000 -0.143 0.000 0.966 156 Q CA 1.054 56.812 55.803 -0.074 0.000 0.845 156 Q CB -0.932 27.755 28.738 -0.086 0.000 0.907 156 Q HN 0.326 8.596 8.270 -0.000 0.000 0.439 157 V N 1.251 121.021 119.914 -0.240 0.000 2.380 157 V HA -0.278 3.844 4.120 0.003 0.000 0.251 157 V C 2.101 178.096 176.094 -0.165 0.000 1.063 157 V CA 2.370 64.495 62.300 -0.292 0.000 1.055 157 V CB -0.490 31.104 31.823 -0.382 0.000 0.657 157 V HN 0.303 8.493 8.190 -0.000 0.000 0.455 158 R N -0.772 119.567 120.500 -0.269 0.000 2.237 158 R HA 0.081 4.423 4.340 0.003 0.000 0.195 158 R C 1.546 177.816 176.300 -0.051 0.000 0.956 158 R CA 0.593 56.521 56.100 -0.287 0.000 1.029 158 R CB -0.011 29.724 30.300 -0.942 0.000 0.972 158 R HN 0.458 8.728 8.270 -0.000 0.000 0.493 159 D N -1.169 119.251 120.400 0.033 0.000 2.392 159 D HA 0.107 4.749 4.640 0.003 0.000 0.206 159 D C 0.091 176.432 176.300 0.069 0.000 1.046 159 D CA 0.260 54.330 54.000 0.117 0.000 0.865 159 D CB 0.353 41.264 40.800 0.185 0.000 0.969 159 D HN 0.075 8.445 8.370 -0.000 0.000 0.509 160 c N 0.912 119.527 118.600 0.025 0.000 2.328 160 c HA 0.471 5.043 4.570 0.003 0.000 0.378 160 c C 0.807 174.896 174.090 -0.002 0.000 1.249 160 c CA -0.866 55.467 56.329 0.006 0.000 2.204 160 c CB 1.064 43.559 42.510 -0.026 0.000 2.218 160 c HN 0.065 8.295 8.230 -0.000 0.000 0.564 161 R N 0.957 121.445 120.500 -0.020 0.000 2.340 161 R HA 0.367 4.709 4.340 0.003 0.000 0.300 161 R C -0.616 175.624 176.300 -0.100 0.000 1.069 161 R CA -0.500 55.572 56.100 -0.047 0.000 0.984 161 R CB 0.396 30.667 30.300 -0.047 0.000 1.003 161 R HN 0.489 8.759 8.270 -0.000 0.000 0.459 162 L N 3.326 124.445 121.223 -0.173 0.000 2.407 162 L HA 0.016 4.357 4.340 0.003 0.000 0.282 162 L C 0.552 177.285 176.870 -0.228 0.000 1.110 162 L CA 0.838 55.519 54.840 -0.265 0.000 0.863 162 L CB 0.627 42.377 42.059 -0.516 0.000 1.207 162 L HN 0.845 9.075 8.230 -0.000 0.000 0.454 163 S N 3.914 119.520 115.700 -0.156 0.000 3.581 163 S HA -0.173 4.299 4.470 0.003 0.000 0.354 163 S C 1.188 175.700 174.600 -0.147 0.000 1.059 163 S CA 1.535 59.645 58.200 -0.150 0.000 1.060 163 S CB -1.681 61.403 63.200 -0.193 0.000 0.908 163 S HN 2.415 10.725 8.310 -0.000 0.000 0.475 164 G N -0.981 107.747 108.800 -0.119 0.000 2.176 164 G HA2 -0.268 3.693 3.960 0.003 0.000 0.253 164 G HA3 -0.268 3.693 3.960 0.003 0.000 0.253 164 G C 0.005 174.850 174.900 -0.091 0.000 0.979 164 G CA 0.166 45.210 45.100 -0.093 0.000 0.641 164 G HN 1.010 9.300 8.290 -0.000 0.000 0.530 165 L N 1.399 122.540 121.223 -0.138 0.000 2.410 165 L HA 0.365 4.707 4.340 0.003 0.000 0.273 165 L C 1.374 178.227 176.870 -0.028 0.000 1.144 165 L CA -0.687 54.078 54.840 -0.124 0.000 0.863 165 L CB 0.724 42.570 42.059 -0.356 0.000 1.140 165 L HN 0.086 8.316 8.230 -0.000 0.000 0.463 166 L N 3.360 124.598 121.223 0.026 0.000 2.628 166 L HA -0.083 4.259 4.340 0.003 0.000 0.274 166 L C 0.214 177.227 176.870 0.239 0.000 1.209 166 L CA 0.312 55.192 54.840 0.066 0.000 0.930 166 L CB -0.114 41.877 42.059 -0.113 0.000 1.183 166 L HN 0.583 8.813 8.230 -0.000 0.000 0.492 167 D N 3.975 124.518 120.400 0.238 0.000 2.339 167 D HA 0.307 4.949 4.640 0.003 0.000 0.241 167 D C -0.176 176.240 176.300 0.192 0.000 1.183 167 D CA -0.302 53.817 54.000 0.198 0.000 0.859 167 D CB 0.741 41.613 40.800 0.120 0.000 1.067 167 D HN 0.263 8.633 8.370 -0.000 0.000 0.484 168 L N 2.505 123.736 121.223 0.012 0.000 2.456 168 L HA 0.233 4.575 4.340 0.003 0.000 0.272 168 L C 0.700 177.472 176.870 -0.164 0.000 1.189 168 L CA -0.605 54.048 54.840 -0.312 0.000 0.846 168 L CB 0.785 42.613 42.059 -0.385 0.000 1.111 168 L HN 0.494 8.724 8.230 -0.000 0.000 0.475 169 A N 5.304 127.993 122.820 -0.219 0.000 2.990 169 A HA 0.260 4.582 4.320 0.003 0.000 0.282 169 A C 1.098 178.660 177.584 -0.037 0.000 1.688 169 A CA -0.323 51.680 52.037 -0.057 0.000 1.391 169 A CB -0.512 18.475 19.000 -0.023 0.000 1.112 169 A HN 0.832 8.982 8.150 -0.000 0.000 0.588 170 L N 1.383 122.607 121.223 0.002 0.000 2.549 170 L HA -0.102 4.240 4.340 0.003 0.000 0.229 170 L C 2.378 179.273 176.870 0.041 0.000 1.158 170 L CA 0.936 55.788 54.840 0.020 0.000 0.842 170 L CB -0.256 41.835 42.059 0.054 0.000 0.952 170 L HN 0.727 8.957 8.230 -0.000 0.000 0.452 171 G N 0.082 108.911 108.800 0.047 0.000 2.484 171 G HA2 -0.100 3.861 3.960 0.003 0.000 0.218 171 G HA3 -0.100 3.861 3.960 0.003 0.000 0.218 171 G C 0.754 175.668 174.900 0.025 0.000 1.130 171 G CA -0.073 45.043 45.100 0.026 0.000 0.784 171 G HN 0.288 8.578 8.290 -0.000 0.000 0.543 172 K N 0.505 120.930 120.400 0.041 0.000 2.205 172 K HA 0.206 4.527 4.320 0.003 0.000 0.279 172 K C 0.282 176.922 176.600 0.067 0.000 1.027 172 K CA -0.226 56.101 56.287 0.066 0.000 0.932 172 K CB 1.905 34.472 32.500 0.111 0.000 1.032 172 K HN -0.041 8.209 8.250 -0.000 0.000 0.466 173 D N 1.477 121.920 120.400 0.071 0.000 2.219 173 D HA -0.206 4.436 4.640 0.003 0.000 0.205 173 D C 1.466 177.814 176.300 0.081 0.000 0.970 173 D CA 1.187 55.222 54.000 0.057 0.000 0.851 173 D CB 0.092 40.922 40.800 0.049 0.000 0.943 173 D HN 0.620 8.990 8.370 -0.000 0.000 0.488 174 Y N 0.440 120.760 120.300 0.033 0.000 2.114 174 Y HA -0.201 4.352 4.550 0.004 0.000 0.284 174 Y C 2.066 178.020 175.900 0.090 0.000 1.143 174 Y CA 1.558 59.691 58.100 0.056 0.000 1.135 174 Y CB -0.608 37.894 38.460 0.070 0.000 0.980 174 Y HN -0.092 8.188 8.280 -0.000 0.000 0.499 175 V N 1.158 121.105 119.914 0.054 0.000 2.295 175 V HA -0.336 3.786 4.120 0.003 0.000 0.246 175 V C 2.395 178.459 176.094 -0.050 0.000 1.049 175 V CA 2.412 64.728 62.300 0.026 0.000 1.024 175 V CB -0.720 31.105 31.823 0.004 0.000 0.648 175 V HN 0.362 8.552 8.190 -0.000 0.000 0.447 176 R N 0.051 120.525 120.500 -0.043 0.000 2.105 176 R HA -0.142 4.200 4.340 0.003 0.000 0.239 176 R C 2.560 178.798 176.300 -0.103 0.000 1.135 176 R CA 1.699 57.762 56.100 -0.061 0.000 0.967 176 R CB -0.524 29.755 30.300 -0.035 0.000 0.861 176 R HN 0.457 8.727 8.270 -0.000 0.000 0.442 177 S N 0.560 116.186 115.700 -0.123 0.000 2.355 177 S HA -0.066 4.405 4.470 0.003 0.000 0.222 177 S C 1.697 176.174 174.600 -0.205 0.000 1.031 177 S CA 0.984 59.095 58.200 -0.147 0.000 0.993 177 S CB 0.026 63.152 63.200 -0.124 0.000 0.859 177 S HN 0.183 8.493 8.310 -0.000 0.000 0.453 178 K N 1.374 121.595 120.400 -0.300 0.000 2.057 178 K HA 0.046 4.368 4.320 0.003 0.000 0.207 178 K C 1.946 178.393 176.600 -0.254 0.000 1.049 178 K CA 1.000 57.115 56.287 -0.287 0.000 0.931 178 K CB -0.766 31.519 32.500 -0.358 0.000 0.714 178 K HN 0.402 8.652 8.250 -0.000 0.000 0.440 179 I N 1.063 121.499 120.570 -0.223 0.000 2.179 179 I HA -0.260 3.912 4.170 0.003 0.000 0.242 179 I C 2.419 178.379 176.117 -0.261 0.000 1.088 179 I CA 1.269 62.394 61.300 -0.292 0.000 1.357 179 I CB -0.424 37.467 38.000 -0.182 0.000 1.051 179 I HN 0.044 8.254 8.210 -0.000 0.000 0.409 180 A N 0.087 122.778 122.820 -0.216 0.000 1.978 180 A HA -0.273 4.048 4.320 0.003 0.000 0.220 180 A C 2.246 179.701 177.584 -0.216 0.000 1.170 180 A CA 1.950 53.855 52.037 -0.221 0.000 0.636 180 A CB -0.640 18.261 19.000 -0.164 0.000 0.810 180 A HN 0.491 8.641 8.150 -0.000 0.000 0.448 181 E N -1.408 118.689 120.200 -0.172 0.000 2.038 181 E HA -0.249 4.103 4.350 0.003 0.000 0.195 181 E C 1.853 178.411 176.600 -0.069 0.000 1.000 181 E CA 1.672 58.001 56.400 -0.118 0.000 0.803 181 E CB -0.361 29.280 29.700 -0.098 0.000 0.750 181 E HN 0.717 9.077 8.360 -0.000 0.000 0.448 182 Y N 0.783 120.926 120.300 -0.262 0.000 2.114 182 Y HA -0.224 4.328 4.550 0.003 0.000 0.284 182 Y C 2.034 177.825 175.900 -0.182 0.000 1.143 182 Y CA 2.003 59.954 58.100 -0.249 0.000 1.135 182 Y CB -0.478 37.612 38.460 -0.618 0.000 0.980 182 Y HN 0.049 8.329 8.280 -0.000 0.000 0.499 183 M N 0.182 119.470 119.600 -0.520 0.000 2.159 183 M HA -0.239 4.243 4.480 0.003 0.000 0.263 183 M C 1.773 177.906 176.300 -0.278 0.000 1.063 183 M CA 1.698 56.635 55.300 -0.606 0.000 1.110 183 M CB -0.432 31.709 32.600 -0.765 0.000 1.374 183 M HN 0.271 8.561 8.290 -0.000 0.000 0.411 184 N N -0.444 118.095 118.700 -0.268 0.000 2.188 184 N HA -0.165 4.576 4.740 0.003 0.000 0.184 184 N C 1.543 177.004 175.510 -0.082 0.000 1.018 184 N CA 1.119 53.979 53.050 -0.317 0.000 0.858 184 N CB -0.621 37.494 38.487 -0.621 0.000 0.989 184 N HN 0.566 8.946 8.380 -0.000 0.000 0.426 185 H N 0.756 119.749 119.070 -0.129 0.000 2.290 185 H HA -0.040 4.517 4.556 0.003 0.000 0.298 185 H C 2.009 177.339 175.328 0.003 0.000 1.087 185 H CA 1.197 57.230 56.048 -0.027 0.000 1.291 185 H CB 0.031 29.796 29.762 0.005 0.000 1.369 185 H HN 0.081 8.361 8.280 -0.000 0.000 0.492 186 L N 0.436 121.617 121.223 -0.071 0.000 2.017 186 L HA -0.212 4.130 4.340 0.003 0.000 0.208 186 L C 2.755 179.639 176.870 0.023 0.000 1.073 186 L CA 1.099 55.896 54.840 -0.070 0.000 0.745 186 L CB -0.361 41.641 42.059 -0.095 0.000 0.894 186 L HN 0.378 8.608 8.230 -0.000 0.000 0.432 187 I N 0.023 120.633 120.570 0.066 0.000 2.163 187 I HA -0.323 3.849 4.170 0.003 0.000 0.243 187 I C 2.046 178.237 176.117 0.123 0.000 1.085 187 I CA 1.350 62.688 61.300 0.064 0.000 1.347 187 I CB -0.479 37.572 38.000 0.085 0.000 1.044 187 I HN 0.300 8.510 8.210 -0.000 0.000 0.408 188 D N 0.823 121.324 120.400 0.167 0.000 2.219 188 D HA -0.106 4.535 4.640 0.003 0.000 0.205 188 D C 2.195 178.624 176.300 0.215 0.000 0.970 188 D CA 1.144 55.274 54.000 0.218 0.000 0.851 188 D CB -0.158 40.790 40.800 0.246 0.000 0.943 188 D HN 0.380 8.750 8.370 -0.000 0.000 0.488 189 I N -0.249 120.425 120.570 0.174 0.000 2.394 189 I HA -0.106 4.066 4.170 0.003 0.000 0.251 189 I C 1.699 177.929 176.117 0.188 0.000 1.136 189 I CA 1.354 62.749 61.300 0.158 0.000 1.425 189 I CB 0.096 38.152 38.000 0.094 0.000 1.079 189 I HN 0.178 8.388 8.210 -0.000 0.000 0.425 190 G N -0.211 108.680 108.800 0.152 0.000 2.321 190 G HA2 -0.141 3.821 3.960 0.003 0.000 0.174 190 G HA3 -0.141 3.821 3.960 0.003 0.000 0.174 190 G C 0.131 174.988 174.900 -0.071 0.000 1.008 190 G CA -0.426 44.766 45.100 0.152 0.000 0.739 190 G HN 0.029 8.319 8.290 -0.000 0.000 0.502 191 V N 1.358 121.175 119.914 -0.162 0.000 2.763 191 V HA 0.408 4.530 4.120 0.003 0.000 0.306 191 V C 1.728 177.558 176.094 -0.439 0.000 1.059 191 V CA 1.180 63.266 62.300 -0.356 0.000 1.138 191 V CB 1.466 33.068 31.823 -0.369 0.000 0.940 191 V HN 0.821 9.011 8.190 -0.000 0.000 0.489 192 A N 3.401 125.868 122.820 -0.588 0.000 2.178 192 A HA 0.617 4.939 4.320 0.003 0.000 0.211 192 A C 0.968 178.298 177.584 -0.422 0.000 1.157 192 A CA 0.885 52.550 52.037 -0.620 0.000 0.780 192 A CB -0.137 18.508 19.000 -0.592 0.000 0.828 192 A HN 1.371 9.521 8.150 -0.000 0.000 0.476 193 G N -2.108 106.373 108.800 -0.531 0.000 2.317 193 G HA2 0.456 4.417 3.960 0.003 0.000 0.293 193 G HA3 0.456 4.417 3.960 0.003 0.000 0.293 193 G C -1.521 172.942 174.900 -0.728 0.000 1.287 193 G CA -0.768 44.129 45.100 -0.338 0.000 0.850 193 G HN 0.222 8.512 8.290 -0.000 0.000 0.515 194 F N -0.395 119.530 119.950 -0.041 0.000 2.613 194 F HA 0.711 5.240 4.527 0.003 0.000 0.310 194 F C 0.273 175.693 175.800 -0.633 0.000 1.085 194 F CA -0.873 56.995 58.000 -0.221 0.000 0.945 194 F CB 2.487 41.361 39.000 -0.210 0.000 1.298 194 F HN 0.484 8.784 8.300 -0.000 0.000 0.455 195 R N 3.306 123.525 120.500 -0.468 0.000 2.207 195 R HA 0.488 4.830 4.340 0.003 0.000 0.334 195 R C -1.302 174.844 176.300 -0.257 0.000 1.013 195 R CA -0.426 55.188 56.100 -0.810 0.000 0.858 195 R CB 0.437 30.409 30.300 -0.547 0.000 1.094 195 R HN 0.592 8.862 8.270 -0.000 0.000 0.457 196 I N 4.379 124.821 120.570 -0.214 0.000 2.291 196 I HA 0.072 4.243 4.170 0.003 0.000 0.292 196 I C 0.232 176.349 176.117 0.001 0.000 1.064 196 I CA -0.538 60.719 61.300 -0.072 0.000 1.269 196 I CB 0.464 38.425 38.000 -0.066 0.000 1.418 196 I HN 0.664 8.874 8.210 -0.000 0.000 0.485 197 D N 5.626 126.069 120.400 0.072 0.000 2.443 197 D HA 0.262 4.903 4.640 0.003 0.000 0.239 197 D C 0.979 177.363 176.300 0.139 0.000 1.136 197 D CA 0.441 54.532 54.000 0.153 0.000 0.879 197 D CB 0.836 41.802 40.800 0.276 0.000 1.195 197 D HN 0.777 9.147 8.370 -0.000 0.000 0.443 198 A N 2.802 125.721 122.820 0.165 0.000 2.640 198 A HA -0.247 4.075 4.320 0.003 0.000 0.300 198 A C 1.830 179.506 177.584 0.154 0.000 1.499 198 A CA 1.193 53.365 52.037 0.224 0.000 0.759 198 A CB -2.005 17.170 19.000 0.292 0.000 1.048 198 A HN 0.455 8.605 8.150 -0.000 0.000 0.450 199 S N -0.608 115.099 115.700 0.013 0.000 2.419 199 S HA -0.167 4.304 4.470 0.003 0.000 0.233 199 S C 1.830 176.312 174.600 -0.197 0.000 1.016 199 S CA 1.503 59.642 58.200 -0.102 0.000 0.974 199 S CB -0.147 62.892 63.200 -0.267 0.000 0.786 199 S HN 0.855 9.165 8.310 -0.000 0.000 0.492 200 K N 0.674 120.922 120.400 -0.253 0.000 2.211 200 K HA -0.144 4.177 4.320 0.003 0.000 0.204 200 K C 1.052 177.413 176.600 -0.399 0.000 1.047 200 K CA 1.170 57.255 56.287 -0.336 0.000 0.935 200 K CB -0.119 32.149 32.500 -0.387 0.000 0.728 200 K HN 0.487 8.738 8.250 -0.000 0.000 0.452 201 H N -0.614 118.436 119.070 -0.034 0.000 2.524 201 H HA 0.180 4.738 4.556 0.003 0.000 0.280 201 H C 0.081 175.360 175.328 -0.081 0.000 1.018 201 H CA 0.308 56.321 56.048 -0.058 0.000 1.165 201 H CB 0.126 29.890 29.762 0.005 0.000 1.411 201 H HN 0.177 8.457 8.280 -0.000 0.000 0.569 202 M N -0.435 119.165 119.600 0.001 0.000 2.644 202 M HA 0.213 4.695 4.480 0.003 0.000 0.304 202 M C -1.115 175.175 176.300 -0.018 0.000 1.215 202 M CA -0.871 54.443 55.300 0.024 0.000 0.871 202 M CB 2.451 35.123 32.600 0.121 0.000 1.740 202 M HN -0.013 8.277 8.290 -0.000 0.000 0.464 203 W N 1.590 122.935 121.300 0.076 0.000 2.287 203 W HA 0.304 4.965 4.660 0.003 0.000 0.313 203 W C -1.807 174.693 176.519 -0.031 0.000 1.267 203 W CA -1.101 56.246 57.345 0.003 0.000 1.201 203 W CB -0.136 29.313 29.460 -0.019 0.000 1.196 203 W HN 0.470 8.650 8.180 -0.000 0.000 0.536 204 P HA -0.235 4.185 4.420 -0.000 0.000 0.217 204 P C 1.718 179.037 177.300 0.032 0.000 1.151 204 P CA 2.538 65.567 63.100 -0.118 0.000 0.849 204 P CB 0.106 31.570 31.700 -0.392 0.000 0.787 205 G N -0.593 108.252 108.800 0.076 0.000 2.408 205 G HA2 -0.226 3.735 3.960 0.003 0.000 0.217 205 G HA3 -0.226 3.735 3.960 0.003 0.000 0.217 205 G C 1.258 176.193 174.900 0.058 0.000 1.150 205 G CA 0.795 45.923 45.100 0.047 0.000 0.776 205 G HN 0.186 8.476 8.290 -0.000 0.000 0.542 206 D N 0.616 121.085 120.400 0.115 0.000 2.117 206 D HA -0.036 4.606 4.640 0.003 0.000 0.198 206 D C 2.580 178.918 176.300 0.063 0.000 0.982 206 D CA 0.362 54.419 54.000 0.094 0.000 0.828 206 D CB -0.145 40.749 40.800 0.157 0.000 0.967 206 D HN 0.352 8.722 8.370 -0.000 0.000 0.464 207 I N 0.959 121.580 120.570 0.085 0.000 2.208 207 I HA -0.245 3.927 4.170 0.003 0.000 0.245 207 I C 2.501 178.631 176.117 0.021 0.000 1.097 207 I CA 0.994 62.328 61.300 0.055 0.000 1.363 207 I CB -0.195 37.869 38.000 0.108 0.000 1.051 207 I HN -0.053 8.157 8.210 -0.000 0.000 0.413 208 K N 1.491 121.910 120.400 0.031 0.000 2.032 208 K HA -0.220 4.102 4.320 0.003 0.000 0.209 208 K C 2.162 178.761 176.600 -0.002 0.000 1.048 208 K CA 1.826 58.122 56.287 0.014 0.000 0.927 208 K CB -0.161 32.350 32.500 0.019 0.000 0.712 208 K HN 0.324 8.574 8.250 -0.000 0.000 0.441 209 A N 1.113 123.934 122.820 0.000 0.000 1.972 209 A HA -0.123 4.198 4.320 0.003 0.000 0.219 209 A C 2.157 179.726 177.584 -0.026 0.000 1.169 209 A CA 1.294 53.326 52.037 -0.009 0.000 0.635 209 A CB -0.397 18.601 19.000 -0.004 0.000 0.810 209 A HN 0.335 8.485 8.150 -0.000 0.000 0.446 210 I N -0.388 120.160 120.570 -0.037 0.000 2.233 210 I HA -0.201 3.971 4.170 0.003 0.000 0.243 210 I C 2.200 178.265 176.117 -0.088 0.000 1.093 210 I CA 0.924 62.179 61.300 -0.074 0.000 1.380 210 I CB -0.282 37.661 38.000 -0.096 0.000 1.067 210 I HN 0.260 8.470 8.210 -0.000 0.000 0.413 211 L N 0.226 121.404 121.223 -0.074 0.000 2.191 211 L HA -0.228 4.114 4.340 0.003 0.000 0.212 211 L C 1.980 178.822 176.870 -0.047 0.000 1.103 211 L CA 0.969 55.766 54.840 -0.073 0.000 0.769 211 L CB -0.839 41.186 42.059 -0.057 0.000 0.908 211 L HN 0.272 8.502 8.230 -0.000 0.000 0.438 212 D N 0.817 121.197 120.400 -0.032 0.000 2.149 212 D HA -0.169 4.473 4.640 0.003 0.000 0.198 212 D C 1.939 178.232 176.300 -0.013 0.000 0.990 212 D CA 1.305 55.295 54.000 -0.016 0.000 0.839 212 D CB -0.031 40.763 40.800 -0.011 0.000 0.948 212 D HN 0.332 8.702 8.370 -0.000 0.000 0.460 213 K N -0.180 120.201 120.400 -0.030 0.000 2.487 213 K HA 0.127 4.449 4.320 0.003 0.000 0.192 213 K C 0.520 177.101 176.600 -0.032 0.000 1.027 213 K CA -0.017 56.253 56.287 -0.027 0.000 1.054 213 K CB 0.421 32.889 32.500 -0.052 0.000 0.824 213 K HN 0.135 8.385 8.250 -0.000 0.000 0.510 214 L N 0.976 122.176 121.223 -0.040 0.000 2.399 214 L HA 0.209 4.551 4.340 0.003 0.000 0.266 214 L C 0.618 177.535 176.870 0.079 0.000 1.114 214 L CA -0.654 54.157 54.840 -0.049 0.000 0.804 214 L CB 0.571 42.590 42.059 -0.067 0.000 1.146 214 L HN 0.181 8.411 8.230 -0.000 0.000 0.451 215 H N 0.435 119.504 119.070 -0.001 0.000 2.597 215 H HA 0.135 4.693 4.556 0.003 0.000 0.370 215 H C -0.326 175.007 175.328 0.009 0.000 1.281 215 H CA -0.673 55.380 56.048 0.009 0.000 1.422 215 H CB 0.697 30.473 29.762 0.023 0.000 1.524 215 H HN 0.575 8.855 8.280 -0.000 0.000 0.607 216 N N -0.062 118.728 118.700 0.150 0.000 2.347 216 N HA 0.138 4.880 4.740 0.003 0.000 0.253 216 N C -0.380 175.177 175.510 0.078 0.000 1.274 216 N CA -0.640 52.453 53.050 0.073 0.000 0.941 216 N CB 0.738 39.254 38.487 0.048 0.000 1.200 216 N HN 0.212 8.592 8.380 -0.000 0.000 0.514 217 L N 1.036 122.265 121.223 0.010 0.000 2.473 217 L HA 0.047 4.389 4.340 0.003 0.000 0.268 217 L C 0.942 177.930 176.870 0.197 0.000 1.215 217 L CA -0.309 54.520 54.840 -0.019 0.000 0.823 217 L CB 0.123 41.929 42.059 -0.421 0.000 1.099 217 L HN 0.611 8.841 8.230 -0.000 0.000 0.483 218 N N 1.084 119.989 118.700 0.340 0.000 2.414 218 N HA -0.094 4.648 4.740 0.003 0.000 0.268 218 N C 0.890 176.601 175.510 0.335 0.000 1.286 218 N CA 0.230 53.492 53.050 0.353 0.000 0.896 218 N CB 0.892 39.648 38.487 0.449 0.000 1.093 218 N HN 0.651 9.031 8.380 -0.000 0.000 0.480 219 S N 2.739 118.526 115.700 0.144 0.000 2.595 219 S HA -0.010 4.462 4.470 0.003 0.000 0.235 219 S C 1.172 175.744 174.600 -0.046 0.000 0.974 219 S CA 0.103 58.347 58.200 0.073 0.000 0.942 219 S CB -0.013 63.205 63.200 0.030 0.000 0.766 219 S HN 0.563 8.873 8.310 -0.000 0.000 0.536 220 N N 0.282 118.877 118.700 -0.174 0.000 2.300 220 N HA 0.041 4.783 4.740 0.003 0.000 0.179 220 N C 0.675 175.870 175.510 -0.524 0.000 1.016 220 N CA 1.012 53.780 53.050 -0.470 0.000 0.876 220 N CB -0.009 37.927 38.487 -0.919 0.000 0.979 220 N HN 0.625 9.005 8.380 -0.000 0.000 0.432 221 W N -0.492 120.671 121.300 -0.229 0.000 2.904 221 W HA 0.283 4.945 4.660 0.003 0.000 0.265 221 W C -0.261 175.849 176.519 -0.683 0.000 1.138 221 W CA -0.194 56.832 57.345 -0.531 0.000 1.455 221 W CB 0.070 29.031 29.460 -0.832 0.000 0.924 221 W HN -0.178 8.002 8.180 -0.000 0.000 0.619 222 F N 1.809 121.870 119.950 0.185 0.000 2.469 222 F HA 0.453 4.982 4.527 0.003 0.000 0.332 222 F C -1.888 173.944 175.800 0.053 0.000 1.103 222 F CA -2.975 55.085 58.000 0.100 0.000 0.979 222 F CB 0.099 39.153 39.000 0.089 0.000 1.137 222 F HN -0.442 7.858 8.300 -0.000 0.000 0.463 223 P HA 0.016 4.436 4.420 -0.000 0.000 0.267 223 P C -0.543 176.826 177.300 0.115 0.000 1.200 223 P CA -0.151 63.017 63.100 0.114 0.000 0.772 223 P CB 0.525 32.278 31.700 0.088 0.000 0.855 224 E N 0.924 121.167 120.200 0.071 0.000 2.452 224 E HA 0.305 4.656 4.350 0.003 0.000 0.261 224 E C 1.541 178.173 176.600 0.052 0.000 0.987 224 E CA 1.627 58.061 56.400 0.056 0.000 0.926 224 E CB -0.600 29.119 29.700 0.031 0.000 0.934 224 E HN 0.753 9.113 8.360 -0.000 0.000 0.452 225 G N 2.180 111.008 108.800 0.046 0.000 2.157 225 G HA2 -0.295 3.667 3.960 0.003 0.000 0.248 225 G HA3 -0.295 3.667 3.960 0.003 0.000 0.248 225 G C 0.270 175.191 174.900 0.035 0.000 0.979 225 G CA 0.231 45.353 45.100 0.036 0.000 0.650 225 G HN 0.471 8.761 8.290 -0.000 0.000 0.529 226 S N 0.566 116.293 115.700 0.045 0.000 2.562 226 S HA 0.447 4.919 4.470 0.003 0.000 0.281 226 S C 0.513 175.099 174.600 -0.023 0.000 1.333 226 S CA 0.139 58.349 58.200 0.017 0.000 1.052 226 S CB 1.124 64.341 63.200 0.029 0.000 0.884 226 S HN 0.481 8.791 8.310 -0.000 0.000 0.506 227 K N 3.049 123.429 120.400 -0.033 0.000 2.138 227 K HA 0.414 4.736 4.320 0.003 0.000 0.263 227 K C -2.593 173.972 176.600 -0.060 0.000 0.965 227 K CA -2.182 54.084 56.287 -0.035 0.000 0.868 227 K CB 0.795 33.279 32.500 -0.026 0.000 1.083 227 K HN 0.327 8.577 8.250 -0.000 0.000 0.443 228 P HA -0.070 4.350 4.420 -0.000 0.000 0.268 228 P C -0.688 176.655 177.300 0.072 0.000 1.205 228 P CA -0.184 62.900 63.100 -0.027 0.000 0.771 228 P CB 0.311 32.050 31.700 0.065 0.000 0.858 229 F N 4.624 124.543 119.950 -0.052 0.000 2.495 229 F HA 0.239 4.768 4.527 0.003 0.000 0.365 229 F C -0.268 175.567 175.800 0.060 0.000 1.090 229 F CA -0.551 57.447 58.000 -0.005 0.000 1.235 229 F CB -0.005 39.025 39.000 0.050 0.000 1.119 229 F HN 0.106 8.406 8.300 -0.000 0.000 0.562 230 I N 8.586 128.925 120.570 -0.384 0.000 2.436 230 I HA 0.217 4.388 4.170 0.003 0.000 0.289 230 I C -1.130 174.708 176.117 -0.467 0.000 1.010 230 I CA -0.793 60.294 61.300 -0.355 0.000 1.098 230 I CB 1.057 38.959 38.000 -0.164 0.000 1.266 230 I HN 0.576 8.786 8.210 -0.000 0.000 0.434 231 Y N 3.327 123.324 120.300 -0.505 0.000 2.373 231 Y HA 0.722 5.274 4.550 0.003 0.000 0.336 231 Y C -0.726 175.094 175.900 -0.134 0.000 0.979 231 Y CA -1.189 56.701 58.100 -0.350 0.000 1.080 231 Y CB 1.017 39.228 38.460 -0.415 0.000 1.190 231 Y HN 0.498 8.778 8.280 -0.000 0.000 0.446 232 Q N 2.541 122.366 119.800 0.043 0.000 2.271 232 Q HA 0.247 4.589 4.340 0.003 0.000 0.258 232 Q C -0.818 175.212 176.000 0.050 0.000 0.936 232 Q CA -0.885 54.916 55.803 -0.003 0.000 0.909 232 Q CB 2.390 31.112 28.738 -0.026 0.000 1.253 232 Q HN 0.751 9.021 8.270 -0.000 0.000 0.440 233 E N 2.908 123.136 120.200 0.046 0.000 2.070 233 E HA 0.233 4.584 4.350 0.003 0.000 0.282 233 E C -1.362 175.264 176.600 0.043 0.000 1.104 233 E CA -0.273 56.219 56.400 0.154 0.000 0.876 233 E CB 0.542 30.349 29.700 0.180 0.000 1.055 233 E HN 0.331 8.691 8.360 -0.000 0.000 0.401 234 V N 7.051 127.015 119.914 0.082 0.000 2.447 234 V HA 0.306 4.427 4.120 0.003 0.000 0.292 234 V C -0.044 176.085 176.094 0.058 0.000 1.021 234 V CA -0.686 61.567 62.300 -0.080 0.000 0.850 234 V CB 1.448 33.105 31.823 -0.276 0.000 1.005 234 V HN 0.638 8.828 8.190 -0.000 0.000 0.426 235 I N 4.190 124.683 120.570 -0.129 0.000 2.322 235 I HA 0.384 4.556 4.170 0.003 0.000 0.292 235 I C -0.420 175.627 176.117 -0.116 0.000 1.060 235 I CA 0.357 61.479 61.300 -0.297 0.000 1.309 235 I CB 0.806 38.453 38.000 -0.588 0.000 1.415 235 I HN 0.576 8.786 8.210 -0.000 0.000 0.492 236 D N 6.919 127.320 120.400 0.002 0.000 2.358 236 D HA 0.318 4.960 4.640 0.003 0.000 0.253 236 D C -0.286 176.043 176.300 0.048 0.000 1.288 236 D CA -0.328 53.685 54.000 0.022 0.000 0.950 236 D CB 1.277 42.107 40.800 0.050 0.000 1.197 236 D HN 0.273 8.643 8.370 -0.000 0.000 0.550 237 L N 2.672 123.905 121.223 0.017 0.000 2.818 237 L HA 0.561 4.902 4.340 0.003 0.000 0.243 237 L C 1.152 178.046 176.870 0.040 0.000 1.185 237 L CA 0.490 55.353 54.840 0.037 0.000 0.988 237 L CB 0.191 42.262 42.059 0.020 0.000 1.292 237 L HN 0.699 8.929 8.230 -0.000 0.000 0.519 238 G N -1.209 107.612 108.800 0.034 0.000 2.756 238 G HA2 0.210 4.171 3.960 0.003 0.000 0.678 238 G HA3 0.210 4.171 3.960 0.003 0.000 0.678 238 G C 0.428 175.338 174.900 0.017 0.000 1.349 238 G CA -0.409 44.711 45.100 0.032 0.000 0.847 238 G HN 0.736 9.026 8.290 -0.000 0.000 0.548 239 G N -0.471 108.339 108.800 0.018 0.000 2.372 239 G HA2 0.147 4.109 3.960 0.003 0.000 0.297 239 G HA3 0.147 4.109 3.960 0.003 0.000 0.297 239 G C 0.023 174.932 174.900 0.014 0.000 1.005 239 G CA 1.730 46.839 45.100 0.014 0.000 1.173 239 G HN 1.257 9.547 8.290 -0.000 0.000 0.511 240 E N -0.450 119.761 120.200 0.018 0.000 2.372 240 E HA 0.301 4.653 4.350 0.003 0.000 0.279 240 E C -1.739 174.875 176.600 0.023 0.000 0.946 240 E CA -1.667 54.749 56.400 0.027 0.000 0.769 240 E CB 2.387 32.105 29.700 0.030 0.000 1.230 240 E HN 0.059 8.419 8.360 -0.000 0.000 0.442 241 P HA -0.088 4.332 4.420 -0.000 0.000 0.218 241 P C 0.397 177.703 177.300 0.011 0.000 1.149 241 P CA 1.090 64.200 63.100 0.016 0.000 0.817 241 P CB 0.456 32.165 31.700 0.015 0.000 0.785 242 I N 0.729 121.305 120.570 0.010 0.000 2.416 242 I HA 0.165 4.337 4.170 0.003 0.000 0.288 242 I C 0.533 176.673 176.117 0.038 0.000 1.051 242 I CA -0.356 60.955 61.300 0.018 0.000 1.375 242 I CB 0.470 38.470 38.000 0.000 0.000 1.407 242 I HN -0.213 7.997 8.210 -0.000 0.000 0.516 243 K N 3.866 124.295 120.400 0.049 0.000 2.318 243 K HA 0.312 4.634 4.320 0.003 0.000 0.249 243 K C 0.728 177.373 176.600 0.075 0.000 0.942 243 K CA -0.749 55.556 56.287 0.031 0.000 0.808 243 K CB 1.728 34.216 32.500 -0.019 0.000 1.189 243 K HN 0.628 8.878 8.250 -0.000 0.000 0.428 244 S N 0.087 115.809 115.700 0.036 0.000 2.400 244 S HA -0.206 4.265 4.470 0.003 0.000 0.232 244 S C 1.659 176.108 174.600 -0.252 0.000 1.025 244 S CA 1.748 59.972 58.200 0.041 0.000 0.993 244 S CB -0.459 62.794 63.200 0.087 0.000 0.808 244 S HN 0.627 8.937 8.310 -0.000 0.000 0.478 245 S N 2.087 117.455 115.700 -0.554 0.000 2.442 245 S HA -0.138 4.333 4.470 0.003 0.000 0.236 245 S C 1.262 175.421 174.600 -0.734 0.000 1.007 245 S CA 1.099 58.497 58.200 -1.337 0.000 0.965 245 S CB -0.670 62.092 63.200 -0.729 0.000 0.773 245 S HN 0.465 8.775 8.310 -0.000 0.000 0.504 246 D N 0.690 120.898 120.400 -0.320 0.000 2.309 246 D HA -0.053 4.589 4.640 0.003 0.000 0.212 246 D C 0.644 176.727 176.300 -0.363 0.000 0.968 246 D CA 1.015 54.839 54.000 -0.292 0.000 0.882 246 D CB -0.245 40.357 40.800 -0.329 0.000 0.918 246 D HN 0.637 9.007 8.370 -0.000 0.000 0.503 247 Y N -1.102 119.119 120.300 -0.132 0.000 2.458 247 Y HA 0.120 4.672 4.550 0.003 0.000 0.256 247 Y C 1.404 177.424 175.900 0.199 0.000 1.159 247 Y CA -0.440 57.681 58.100 0.034 0.000 1.261 247 Y CB -0.035 38.456 38.460 0.050 0.000 1.119 247 Y HN -0.173 8.107 8.280 -0.000 0.000 0.524 248 F N -0.176 119.900 119.950 0.208 0.000 2.333 248 F HA -0.071 4.458 4.527 0.003 0.000 0.300 248 F C 2.280 178.235 175.800 0.258 0.000 1.083 248 F CA 0.940 59.064 58.000 0.206 0.000 1.395 248 F CB -1.229 37.840 39.000 0.115 0.000 1.056 248 F HN 0.104 8.404 8.300 -0.000 0.000 0.529 249 G N -0.603 108.408 108.800 0.352 0.000 2.534 249 G HA2 -0.182 3.780 3.960 0.003 0.000 0.217 249 G HA3 -0.182 3.780 3.960 0.003 0.000 0.217 249 G C 1.538 176.578 174.900 0.233 0.000 1.128 249 G CA 0.408 45.678 45.100 0.284 0.000 0.784 249 G HN 0.257 8.547 8.290 -0.000 0.000 0.542 250 N N 0.374 119.204 118.700 0.216 0.000 2.405 250 N HA 0.238 4.979 4.740 0.003 0.000 0.175 250 N C 1.150 176.657 175.510 -0.004 0.000 1.051 250 N CA 0.998 54.106 53.050 0.097 0.000 0.899 250 N CB 1.029 39.590 38.487 0.124 0.000 1.000 250 N HN 0.445 8.825 8.380 -0.000 0.000 0.451 251 G N -0.291 108.587 108.800 0.130 0.000 2.356 251 G HA2 0.065 4.027 3.960 0.003 0.000 0.266 251 G HA3 0.065 4.027 3.960 0.003 0.000 0.266 251 G C -1.254 173.861 174.900 0.359 0.000 1.312 251 G CA -0.919 44.183 45.100 0.005 0.000 0.922 251 G HN -0.026 8.264 8.290 -0.000 0.000 0.480 252 R N -1.152 119.482 120.500 0.223 0.000 2.726 252 R HA 0.604 4.945 4.340 0.003 0.000 0.272 252 R C -0.577 175.852 176.300 0.214 0.000 1.097 252 R CA -0.250 55.978 56.100 0.213 0.000 1.198 252 R CB 0.976 31.362 30.300 0.142 0.000 1.114 252 R HN 0.370 8.640 8.270 -0.000 0.000 0.550 253 V N 0.278 120.329 119.914 0.228 0.000 2.841 253 V HA 0.148 4.270 4.120 0.003 0.000 0.310 253 V C -0.028 176.180 176.094 0.191 0.000 1.090 253 V CA -1.069 61.371 62.300 0.233 0.000 0.930 253 V CB 2.074 34.094 31.823 0.329 0.000 1.014 253 V HN 0.974 9.164 8.190 -0.000 0.000 0.425 254 T N 0.240 114.918 114.554 0.207 0.000 2.867 254 T HA 0.259 4.610 4.350 0.003 0.000 0.297 254 T C -0.102 174.669 174.700 0.119 0.000 0.989 254 T CA -0.142 62.076 62.100 0.197 0.000 1.159 254 T CB 0.824 69.840 68.868 0.247 0.000 0.928 254 T HN 0.680 8.920 8.240 -0.000 0.000 0.538 255 E N 2.597 122.745 120.200 -0.086 0.000 2.079 255 E HA 0.323 4.674 4.350 0.003 0.000 0.252 255 E C -0.312 176.040 176.600 -0.413 0.000 0.992 255 E CA -1.136 55.169 56.400 -0.158 0.000 0.829 255 E CB -0.589 29.023 29.700 -0.147 0.000 1.158 255 E HN 0.684 9.044 8.360 -0.000 0.000 0.435 256 F N 2.194 122.038 119.950 -0.177 0.000 2.451 256 F HA -0.004 4.525 4.527 0.003 0.000 0.299 256 F C 1.762 177.424 175.800 -0.228 0.000 1.101 256 F CA 0.784 58.679 58.000 -0.174 0.000 1.436 256 F CB 0.169 39.175 39.000 0.010 0.000 1.074 256 F HN 0.353 8.653 8.300 -0.000 0.000 0.553 257 K N -0.985 119.321 120.400 -0.156 0.000 2.211 257 K HA -0.209 4.113 4.320 0.003 0.000 0.203 257 K C 1.790 178.080 176.600 -0.518 0.000 1.050 257 K CA 1.100 57.228 56.287 -0.265 0.000 0.945 257 K CB -0.371 31.953 32.500 -0.293 0.000 0.732 257 K HN 0.257 8.507 8.250 -0.000 0.000 0.451 258 Y N 1.166 120.911 120.300 -0.925 0.000 2.070 258 Y HA -0.221 4.331 4.550 0.003 0.000 0.280 258 Y C 2.354 178.121 175.900 -0.222 0.000 1.148 258 Y CA 2.029 59.666 58.100 -0.772 0.000 1.125 258 Y CB -0.666 37.368 38.460 -0.710 0.000 0.975 258 Y HN 0.041 8.321 8.280 -0.000 0.000 0.492 259 G N -0.725 108.031 108.800 -0.073 0.000 2.408 259 G HA2 -0.184 3.778 3.960 0.003 0.000 0.217 259 G HA3 -0.184 3.778 3.960 0.003 0.000 0.217 259 G C 1.778 176.669 174.900 -0.015 0.000 1.150 259 G CA 0.804 45.889 45.100 -0.024 0.000 0.776 259 G HN 0.613 8.903 8.290 -0.000 0.000 0.542 260 A N 0.965 123.788 122.820 0.006 0.000 1.877 260 A HA -0.011 4.311 4.320 0.003 0.000 0.216 260 A C 2.390 180.004 177.584 0.050 0.000 1.186 260 A CA 1.950 54.015 52.037 0.048 0.000 0.620 260 A CB -0.249 18.800 19.000 0.082 0.000 0.822 260 A HN 0.204 8.354 8.150 -0.000 0.000 0.443 261 K N -0.693 119.766 120.400 0.097 0.000 2.103 261 K HA 0.011 4.333 4.320 0.003 0.000 0.204 261 K C 1.817 178.394 176.600 -0.039 0.000 1.052 261 K CA 0.815 57.214 56.287 0.188 0.000 0.945 261 K CB -0.938 31.842 32.500 0.466 0.000 0.722 261 K HN 0.405 8.655 8.250 -0.000 0.000 0.443 262 L N 0.973 122.096 121.223 -0.166 0.000 2.083 262 L HA -0.036 4.305 4.340 0.003 0.000 0.209 262 L C 2.019 178.675 176.870 -0.356 0.000 1.083 262 L CA 1.986 56.530 54.840 -0.493 0.000 0.752 262 L CB -1.057 40.700 42.059 -0.503 0.000 0.899 262 L HN 0.241 8.472 8.230 -0.000 0.000 0.433 263 G N -2.107 106.561 108.800 -0.221 0.000 2.404 263 G HA2 -0.231 3.731 3.960 0.003 0.000 0.215 263 G HA3 -0.231 3.731 3.960 0.003 0.000 0.215 263 G C 1.432 176.149 174.900 -0.304 0.000 1.174 263 G CA 1.129 46.091 45.100 -0.230 0.000 0.780 263 G HN 0.418 8.708 8.290 -0.000 0.000 0.537 264 T N 0.871 115.313 114.554 -0.188 0.000 2.777 264 T HA -0.085 4.267 4.350 0.003 0.000 0.266 264 T C 2.537 177.173 174.700 -0.107 0.000 1.040 264 T CA 1.138 63.170 62.100 -0.112 0.000 1.141 264 T CB -0.257 68.672 68.868 0.101 0.000 0.868 264 T HN 0.048 8.288 8.240 -0.000 0.000 0.444 265 V N 1.475 121.304 119.914 -0.142 0.000 2.295 265 V HA -0.123 3.999 4.120 0.003 0.000 0.246 265 V C 2.392 178.330 176.094 -0.260 0.000 1.049 265 V CA 1.516 63.704 62.300 -0.186 0.000 1.024 265 V CB -0.546 31.079 31.823 -0.330 0.000 0.648 265 V HN 0.485 8.675 8.190 -0.000 0.000 0.447 266 I N -0.638 119.731 120.570 -0.335 0.000 2.439 266 I HA -0.159 4.013 4.170 0.003 0.000 0.251 266 I C 2.461 178.430 176.117 -0.246 0.000 1.139 266 I CA 1.260 62.371 61.300 -0.315 0.000 1.438 266 I CB -0.326 37.464 38.000 -0.350 0.000 1.085 266 I HN 0.196 8.406 8.210 -0.000 0.000 0.427 267 R N 1.052 121.370 120.500 -0.302 0.000 2.313 267 R HA 0.047 4.389 4.340 0.003 0.000 0.199 267 R C 0.152 176.401 176.300 -0.086 0.000 0.958 267 R CA 0.059 55.955 56.100 -0.341 0.000 1.047 267 R CB 0.053 29.795 30.300 -0.929 0.000 0.955 267 R HN 0.173 8.443 8.270 -0.000 0.000 0.481 268 K N -0.019 120.351 120.400 -0.050 0.000 3.148 268 K HA -0.181 4.141 4.320 0.003 0.000 0.267 268 K C -1.005 175.760 176.600 0.275 0.000 0.996 268 K CA 0.433 56.760 56.287 0.066 0.000 0.737 268 K CB -0.885 31.637 32.500 0.037 0.000 1.308 268 K HN 0.132 8.382 8.250 -0.000 0.000 0.470 269 W N 0.732 122.022 121.300 -0.017 0.000 2.332 269 W HA 0.304 4.966 4.660 0.003 0.000 0.351 269 W C 1.400 177.933 176.519 0.024 0.000 1.195 269 W CA -1.225 56.122 57.345 0.003 0.000 1.334 269 W CB 0.112 29.576 29.460 0.007 0.000 1.206 269 W HN 0.237 8.417 8.180 -0.000 0.000 0.637 270 N N 0.694 119.529 118.700 0.226 0.000 2.710 270 N HA -0.224 4.517 4.740 0.003 0.000 0.249 270 N C 0.750 176.336 175.510 0.127 0.000 1.059 270 N CA 1.860 54.991 53.050 0.134 0.000 0.720 270 N CB -1.148 37.427 38.487 0.147 0.000 0.983 270 N HN 0.951 9.331 8.380 -0.000 0.000 0.544 271 G N -0.501 108.368 108.800 0.115 0.000 2.249 271 G HA2 -0.323 3.639 3.960 0.003 0.000 0.273 271 G HA3 -0.323 3.639 3.960 0.003 0.000 0.273 271 G C -0.122 174.855 174.900 0.129 0.000 1.036 271 G CA 0.805 45.965 45.100 0.101 0.000 0.824 271 G HN 0.701 8.991 8.290 -0.000 0.000 0.504 272 E N 0.075 120.352 120.200 0.128 0.000 2.277 272 E HA 0.623 4.975 4.350 0.003 0.000 0.274 272 E C 0.565 177.110 176.600 -0.091 0.000 1.022 272 E CA -0.490 55.987 56.400 0.129 0.000 0.853 272 E CB 0.789 30.621 29.700 0.219 0.000 1.086 272 E HN 0.546 8.906 8.360 -0.000 0.000 0.397 273 K N 2.317 122.526 120.400 -0.318 0.000 2.512 273 K HA 0.343 4.665 4.320 0.003 0.000 0.263 273 K C 0.422 176.841 176.600 -0.302 0.000 0.966 273 K CA -0.809 55.254 56.287 -0.374 0.000 0.851 273 K CB 1.122 33.327 32.500 -0.493 0.000 1.395 273 K HN 0.385 8.635 8.250 -0.000 0.000 0.440 274 M N 1.073 120.512 119.600 -0.268 0.000 2.149 274 M HA -0.186 4.295 4.480 0.003 0.000 0.261 274 M C 1.956 178.243 176.300 -0.022 0.000 1.064 274 M CA 2.339 57.486 55.300 -0.256 0.000 1.102 274 M CB -0.486 31.924 32.600 -0.315 0.000 1.369 274 M HN 0.864 9.154 8.290 -0.000 0.000 0.408 275 S N -0.240 115.460 115.700 -0.000 0.000 2.440 275 S HA -0.165 4.306 4.470 0.003 0.000 0.238 275 S C 1.538 176.348 174.600 0.351 0.000 1.010 275 S CA 0.912 59.261 58.200 0.248 0.000 0.972 275 S CB -0.755 62.528 63.200 0.139 0.000 0.774 275 S HN 0.426 8.736 8.310 -0.000 0.000 0.501 276 Y N 1.600 121.997 120.300 0.162 0.000 2.509 276 Y HA 0.293 4.845 4.550 0.003 0.000 0.293 276 Y C 1.894 178.022 175.900 0.380 0.000 1.133 276 Y CA -0.720 57.504 58.100 0.207 0.000 1.283 276 Y CB -0.808 37.779 38.460 0.212 0.000 1.001 276 Y HN 0.297 8.577 8.280 -0.000 0.000 0.555 277 L N 0.541 121.957 121.223 0.320 0.000 2.551 277 L HA -0.160 4.182 4.340 0.003 0.000 0.228 277 L C 2.178 179.042 176.870 -0.011 0.000 1.153 277 L CA 0.769 55.635 54.840 0.043 0.000 0.851 277 L CB -0.418 41.391 42.059 -0.417 0.000 0.959 277 L HN 0.248 8.478 8.230 -0.000 0.000 0.451 278 K N 0.982 121.197 120.400 -0.308 0.000 2.360 278 K HA -0.191 4.130 4.320 0.003 0.000 0.201 278 K C 0.846 177.247 176.600 -0.333 0.000 1.046 278 K CA 1.811 57.505 56.287 -0.989 0.000 0.940 278 K CB -0.506 31.266 32.500 -1.215 0.000 0.748 278 K HN 0.597 8.847 8.250 -0.000 0.000 0.465 279 N N -0.742 117.953 118.700 -0.009 0.000 2.433 279 N HA 0.006 4.748 4.740 0.003 0.000 0.270 279 N C -0.762 174.866 175.510 0.196 0.000 1.354 279 N CA -0.983 52.096 53.050 0.049 0.000 0.889 279 N CB 0.169 38.657 38.487 0.000 0.000 1.285 279 N HN 0.267 8.647 8.380 -0.000 0.000 0.503 280 W N 1.936 123.099 121.300 -0.229 0.000 2.257 280 W HA 0.303 4.965 4.660 0.003 0.000 0.337 280 W C 0.511 176.669 176.519 -0.602 0.000 1.321 280 W CA 1.938 58.844 57.345 -0.731 0.000 1.267 280 W CB 0.659 29.613 29.460 -0.842 0.000 1.187 280 W HN 0.509 8.689 8.180 -0.000 0.000 0.565 281 G N 3.904 111.857 108.800 -1.411 0.000 2.358 281 G HA2 -0.284 3.678 3.960 0.003 0.000 0.198 281 G HA3 -0.284 3.678 3.960 0.003 0.000 0.198 281 G C 0.324 174.684 174.900 -0.900 0.000 1.220 281 G CA 0.052 44.414 45.100 -1.231 0.000 1.187 281 G HN 0.441 8.731 8.290 -0.000 0.000 0.544 282 E N 0.582 120.573 120.200 -0.347 0.000 2.147 282 E HA -0.043 4.308 4.350 0.003 0.000 0.199 282 E C 2.564 179.025 176.600 -0.232 0.000 1.005 282 E CA 2.202 58.507 56.400 -0.158 0.000 0.810 282 E CB -0.698 28.997 29.700 -0.007 0.000 0.736 282 E HN 0.978 9.338 8.360 -0.000 0.000 0.460 283 G N -0.669 108.001 108.800 -0.217 0.000 2.516 283 G HA2 -0.235 3.727 3.960 0.003 0.000 0.221 283 G HA3 -0.235 3.727 3.960 0.003 0.000 0.221 283 G C 0.468 175.240 174.900 -0.213 0.000 1.107 283 G CA 0.714 45.723 45.100 -0.152 0.000 0.747 283 G HN 0.274 8.564 8.290 -0.000 0.000 0.567 284 W N -0.534 120.326 121.300 -0.733 0.000 3.123 284 W HA 0.474 5.136 4.660 0.003 0.000 0.383 284 W C 1.528 177.659 176.519 -0.646 0.000 1.102 284 W CA -0.353 56.502 57.345 -0.818 0.000 1.865 284 W CB 0.205 28.883 29.460 -1.303 0.000 1.111 284 W HN 0.295 8.475 8.180 -0.000 0.000 0.621 285 G N -0.541 108.109 108.800 -0.250 0.000 2.141 285 G HA2 -0.276 3.686 3.960 0.003 0.000 0.231 285 G HA3 -0.276 3.686 3.960 0.003 0.000 0.231 285 G C 0.080 175.095 174.900 0.193 0.000 0.984 285 G CA -0.524 44.568 45.100 -0.013 0.000 0.660 285 G HN -0.024 8.266 8.290 -0.000 0.000 0.525 286 F N 1.242 121.147 119.950 -0.075 0.000 2.399 286 F HA 0.676 5.205 4.527 0.003 0.000 0.313 286 F C 1.530 177.385 175.800 0.092 0.000 1.202 286 F CA -1.384 56.585 58.000 -0.051 0.000 1.192 286 F CB 0.132 38.955 39.000 -0.296 0.000 1.256 286 F HN 0.324 8.624 8.300 -0.000 0.000 0.558 287 M N 1.402 121.245 119.600 0.406 0.000 2.157 287 M HA 0.424 4.905 4.480 0.003 0.000 0.304 287 M C -2.581 173.894 176.300 0.291 0.000 1.171 287 M CA -1.511 54.008 55.300 0.365 0.000 1.157 287 M CB -0.122 32.733 32.600 0.426 0.000 1.403 287 M HN 0.132 8.422 8.290 -0.000 0.000 0.473 288 P HA 0.017 4.437 4.420 -0.000 0.000 0.265 288 P C 0.230 177.458 177.300 -0.120 0.000 1.193 288 P CA 0.113 63.206 63.100 -0.011 0.000 0.765 288 P CB 0.785 32.394 31.700 -0.152 0.000 0.823 289 S N 2.631 118.251 115.700 -0.134 0.000 2.402 289 S HA -0.203 4.269 4.470 0.003 0.000 0.233 289 S C 1.327 175.708 174.600 -0.364 0.000 1.030 289 S CA 1.901 59.810 58.200 -0.485 0.000 1.003 289 S CB -0.854 62.169 63.200 -0.295 0.000 0.813 289 S HN 0.629 8.939 8.310 -0.000 0.000 0.477 290 D N -0.383 119.863 120.400 -0.258 0.000 2.378 290 D HA -0.037 4.605 4.640 0.003 0.000 0.227 290 D C 1.428 177.566 176.300 -0.270 0.000 1.012 290 D CA 0.343 54.203 54.000 -0.234 0.000 0.905 290 D CB -0.207 40.461 40.800 -0.219 0.000 0.895 290 D HN 0.320 8.690 8.370 -0.000 0.000 0.532 291 R N -0.279 120.028 120.500 -0.322 0.000 2.509 291 R HA 0.404 4.746 4.340 0.003 0.000 0.297 291 R C 0.237 176.464 176.300 -0.121 0.000 0.951 291 R CA -0.097 55.824 56.100 -0.298 0.000 1.103 291 R CB 0.633 30.464 30.300 -0.782 0.000 1.283 291 R HN 0.160 8.430 8.270 -0.000 0.000 0.534 292 A N 1.952 124.664 122.820 -0.179 0.000 2.310 292 A HA 0.490 4.812 4.320 0.003 0.000 0.299 292 A C -0.415 177.114 177.584 -0.092 0.000 1.147 292 A CA -0.372 51.585 52.037 -0.134 0.000 0.818 292 A CB 0.718 19.540 19.000 -0.297 0.000 1.096 292 A HN 0.107 8.257 8.150 -0.000 0.000 0.495 293 L N 4.881 126.086 121.223 -0.031 0.000 2.298 293 L HA 0.622 4.963 4.340 0.003 0.000 0.284 293 L C -0.371 176.454 176.870 -0.075 0.000 1.013 293 L CA -0.325 54.513 54.840 -0.003 0.000 0.824 293 L CB 0.805 42.859 42.059 -0.008 0.000 1.221 293 L HN 0.683 8.913 8.230 -0.000 0.000 0.418 294 V N 3.264 123.057 119.914 -0.203 0.000 2.881 294 V HA 0.844 4.966 4.120 0.003 0.000 0.316 294 V C -0.749 175.199 176.094 -0.243 0.000 1.070 294 V CA -0.619 61.367 62.300 -0.524 0.000 0.976 294 V CB 1.880 33.110 31.823 -0.988 0.000 1.038 294 V HN 0.718 8.908 8.190 -0.000 0.000 0.446 295 F N -0.442 119.318 119.950 -0.318 0.000 2.744 295 F HA 0.759 5.288 4.527 0.003 0.000 0.311 295 F C -0.004 175.796 175.800 -0.000 0.000 1.144 295 F CA -0.866 57.044 58.000 -0.150 0.000 0.938 295 F CB 0.743 39.655 39.000 -0.146 0.000 1.292 295 F HN 0.249 8.549 8.300 -0.000 0.000 0.444 296 V N -0.018 120.017 119.914 0.202 0.000 2.379 296 V HA 0.047 4.169 4.120 0.003 0.000 0.243 296 V C 0.129 176.385 176.094 0.269 0.000 1.035 296 V CA 1.915 64.312 62.300 0.162 0.000 1.035 296 V CB -0.531 31.315 31.823 0.038 0.000 0.673 296 V HN 0.912 9.102 8.190 -0.000 0.000 0.457 297 D N -0.387 120.248 120.400 0.390 0.000 2.552 297 D HA 0.330 4.972 4.640 0.003 0.000 0.239 297 D C -0.967 175.497 176.300 0.272 0.000 1.139 297 D CA -0.639 53.577 54.000 0.360 0.000 0.914 297 D CB 1.803 42.780 40.800 0.296 0.000 1.461 297 D HN 0.277 8.647 8.370 -0.000 0.000 0.462 298 N N -1.750 117.015 118.700 0.108 0.000 2.761 298 N HA 0.106 4.847 4.740 0.003 0.000 0.283 298 N C 1.150 176.525 175.510 -0.225 0.000 1.377 298 N CA -0.483 52.492 53.050 -0.124 0.000 0.791 298 N CB 0.476 38.734 38.487 -0.382 0.000 1.540 298 N HN 0.569 8.949 8.380 -0.000 0.000 0.539 299 H N -0.754 118.081 119.070 -0.391 0.000 2.387 299 H HA -0.042 4.516 4.556 0.003 0.000 0.299 299 H C 0.082 174.990 175.328 -0.700 0.000 1.099 299 H CA 1.455 56.993 56.048 -0.851 0.000 1.315 299 H CB -0.264 28.620 29.762 -1.464 0.000 1.380 299 H HN 0.551 8.831 8.280 -0.000 0.000 0.513 300 D N 1.427 121.324 120.400 -0.837 0.000 2.085 300 D HA -0.128 4.514 4.640 0.003 0.000 0.199 300 D C 1.928 178.120 176.300 -0.179 0.000 0.981 300 D CA 1.574 55.327 54.000 -0.411 0.000 0.834 300 D CB -0.169 40.486 40.800 -0.241 0.000 0.992 300 D HN 0.535 8.905 8.370 -0.000 0.000 0.457 301 N N 1.194 119.858 118.700 -0.061 0.000 2.494 301 N HA -0.155 4.587 4.740 0.003 0.000 0.182 301 N C 1.524 177.082 175.510 0.080 0.000 1.076 301 N CA 0.589 53.691 53.050 0.087 0.000 0.908 301 N CB -0.641 37.964 38.487 0.197 0.000 0.967 301 N HN 0.359 8.739 8.380 -0.000 0.000 0.449 302 Q N -0.387 119.419 119.800 0.009 0.000 2.436 302 Q HA 0.077 4.419 4.340 0.003 0.000 0.209 302 Q C 1.074 177.180 176.000 0.177 0.000 0.965 302 Q CA 0.629 56.493 55.803 0.102 0.000 0.910 302 Q CB -0.111 28.691 28.738 0.107 0.000 0.980 302 Q HN 0.263 8.533 8.270 -0.000 0.000 0.491 303 R N 0.091 120.593 120.500 0.004 0.000 2.468 303 R HA 0.196 4.537 4.340 0.003 0.000 0.280 303 R C 0.368 176.807 176.300 0.230 0.000 0.963 303 R CA 0.368 56.449 56.100 -0.031 0.000 1.083 303 R CB 0.788 30.700 30.300 -0.645 0.000 1.200 303 R HN 0.443 8.713 8.270 -0.000 0.000 0.541 304 G N 1.133 110.097 108.800 0.274 0.000 2.221 304 G HA2 -0.307 3.655 3.960 0.003 0.000 0.265 304 G HA3 -0.307 3.655 3.960 0.003 0.000 0.265 304 G C -0.072 175.106 174.900 0.464 0.000 1.041 304 G CA 0.657 45.956 45.100 0.332 0.000 0.807 304 G HN 0.392 8.682 8.290 -0.000 0.000 0.502 305 H N -0.463 118.663 119.070 0.092 0.000 2.923 305 H HA 0.507 5.064 4.556 0.003 0.000 0.290 305 H C 2.586 177.923 175.328 0.015 0.000 1.365 305 H CA 1.075 57.163 56.048 0.065 0.000 1.982 305 H CB -1.066 28.758 29.762 0.103 0.000 1.551 305 H HN 0.606 8.886 8.280 -0.000 0.000 0.591 306 G N 0.919 109.804 108.800 0.143 0.000 3.725 306 G HA2 -0.102 3.860 3.960 0.003 0.000 0.331 306 G HA3 -0.102 3.860 3.960 0.003 0.000 0.331 306 G C 0.121 174.972 174.900 -0.081 0.000 0.871 306 G CA 2.108 47.204 45.100 -0.006 0.000 0.725 306 G HN 0.892 9.182 8.290 -0.000 0.000 1.346 307 A N -2.803 120.001 122.820 -0.028 0.000 2.517 307 A HA 0.751 5.073 4.320 0.003 0.000 0.297 307 A C 0.640 178.288 177.584 0.107 0.000 1.050 307 A CA 0.931 52.953 52.037 -0.025 0.000 0.694 307 A CB 1.033 19.936 19.000 -0.163 0.000 1.277 307 A HN 2.549 10.699 8.150 -0.000 0.000 0.400 308 G N 0.458 109.311 108.800 0.088 0.000 2.336 308 G HA2 0.361 4.323 3.960 0.003 0.000 0.194 308 G HA3 0.361 4.323 3.960 0.003 0.000 0.194 308 G C 1.797 176.763 174.900 0.111 0.000 0.999 308 G CA 1.064 46.228 45.100 0.108 0.000 0.669 308 G HN 2.838 11.128 8.290 -0.000 0.000 0.482 309 G N 0.837 109.703 108.800 0.111 0.000 2.672 309 G HA2 0.033 3.995 3.960 0.003 0.000 0.324 309 G HA3 0.033 3.995 3.960 0.003 0.000 0.324 309 G C 1.673 176.660 174.900 0.145 0.000 1.286 309 G CA 2.731 47.906 45.100 0.126 0.000 1.004 309 G HN 1.935 10.226 8.290 -0.000 0.000 0.548 310 A N -0.174 122.754 122.820 0.179 0.000 2.125 310 A HA 0.221 4.543 4.320 0.003 0.000 0.219 310 A C 2.671 180.305 177.584 0.084 0.000 1.156 310 A CA 3.051 55.214 52.037 0.210 0.000 0.671 310 A CB -0.650 18.564 19.000 0.357 0.000 0.794 310 A HN 1.987 10.137 8.150 -0.000 0.000 0.459 311 S N -0.504 115.208 115.700 0.020 0.000 2.470 311 S HA 0.116 4.588 4.470 0.003 0.000 0.225 311 S C 0.764 175.249 174.600 -0.191 0.000 1.006 311 S CA -0.200 57.841 58.200 -0.266 0.000 0.934 311 S CB -0.392 62.731 63.200 -0.128 0.000 0.778 311 S HN 0.270 8.580 8.310 -0.000 0.000 0.517 312 I N 2.909 123.459 120.570 -0.033 0.000 2.752 312 I HA 0.115 4.287 4.170 0.003 0.000 0.289 312 I C 0.351 176.483 176.117 0.025 0.000 1.197 312 I CA -0.087 61.230 61.300 0.029 0.000 1.432 312 I CB -0.376 37.690 38.000 0.111 0.000 1.359 312 I HN 0.325 8.535 8.210 -0.000 0.000 0.571 313 L N 6.531 127.796 121.223 0.070 0.000 2.325 313 L HA 0.472 4.814 4.340 0.003 0.000 0.279 313 L C 0.571 177.615 176.870 0.291 0.000 1.054 313 L CA -0.254 54.677 54.840 0.151 0.000 0.804 313 L CB 1.643 43.789 42.059 0.144 0.000 1.200 313 L HN 0.795 9.025 8.230 -0.000 0.000 0.436 314 T N -1.798 112.814 114.554 0.096 0.000 2.778 314 T HA 0.327 4.678 4.350 0.003 0.000 0.293 314 T C 0.796 175.035 174.700 -0.768 0.000 1.144 314 T CA -0.644 61.237 62.100 -0.365 0.000 1.010 314 T CB 0.817 69.570 68.868 -0.192 0.000 1.325 314 T HN 0.419 8.659 8.240 -0.000 0.000 0.515 315 F N -0.917 118.491 119.950 -0.903 0.000 2.250 315 F HA 0.119 4.647 4.527 0.003 0.000 0.301 315 F C 1.719 177.420 175.800 -0.166 0.000 1.077 315 F CA 0.287 57.970 58.000 -0.529 0.000 1.348 315 F CB -1.133 37.588 39.000 -0.465 0.000 1.040 315 F HN 0.578 8.878 8.300 -0.000 0.000 0.509 316 W N 1.586 122.383 121.300 -0.837 0.000 2.374 316 W HA -0.118 4.544 4.660 0.003 0.000 0.288 316 W C 1.010 177.430 176.519 -0.163 0.000 1.218 316 W CA 1.078 58.137 57.345 -0.476 0.000 1.245 316 W CB -0.320 28.807 29.460 -0.556 0.000 1.126 316 W HN 0.021 8.201 8.180 -0.000 0.000 0.545 317 D N 0.120 120.572 120.400 0.087 0.000 2.894 317 D HA 0.228 4.869 4.640 0.003 0.000 0.248 317 D C 1.651 178.067 176.300 0.193 0.000 1.291 317 D CA 0.425 54.496 54.000 0.118 0.000 0.840 317 D CB 0.001 40.856 40.800 0.092 0.000 1.044 317 D HN 0.053 8.423 8.370 -0.000 0.000 0.484 318 A N 1.526 124.481 122.820 0.225 0.000 1.916 318 A HA -0.354 3.968 4.320 0.003 0.000 0.224 318 A C 2.196 179.960 177.584 0.301 0.000 1.366 318 A CA 1.945 54.176 52.037 0.324 0.000 0.692 318 A CB -0.568 18.510 19.000 0.130 0.000 0.841 318 A HN 0.310 8.460 8.150 -0.000 0.000 0.480 319 R N -0.747 119.859 120.500 0.176 0.000 2.083 319 R HA -0.073 4.268 4.340 0.003 0.000 0.237 319 R C 2.183 178.577 176.300 0.156 0.000 1.137 319 R CA 1.808 58.000 56.100 0.154 0.000 0.951 319 R CB -0.362 29.995 30.300 0.095 0.000 0.851 319 R HN 0.591 8.861 8.270 -0.000 0.000 0.434 320 L N -0.714 120.581 121.223 0.120 0.000 2.156 320 L HA -0.155 4.187 4.340 0.003 0.000 0.208 320 L C 2.271 179.185 176.870 0.073 0.000 1.095 320 L CA 0.854 55.722 54.840 0.046 0.000 0.770 320 L CB -0.540 41.520 42.059 0.001 0.000 0.914 320 L HN 0.282 8.512 8.230 -0.000 0.000 0.439 321 Y N 1.477 121.816 120.300 0.064 0.000 2.128 321 Y HA -0.308 4.244 4.550 0.003 0.000 0.284 321 Y C 2.566 178.541 175.900 0.126 0.000 1.154 321 Y CA 1.720 59.881 58.100 0.102 0.000 1.149 321 Y CB -0.109 38.467 38.460 0.193 0.000 0.976 321 Y HN -0.002 8.278 8.280 -0.000 0.000 0.505 322 K N -0.604 119.948 120.400 0.253 0.000 2.097 322 K HA -0.208 4.113 4.320 0.003 0.000 0.206 322 K C 2.193 178.771 176.600 -0.037 0.000 1.049 322 K CA 1.878 58.308 56.287 0.238 0.000 0.933 322 K CB -0.241 32.535 32.500 0.460 0.000 0.717 322 K HN 0.399 8.649 8.250 -0.000 0.000 0.442 323 M N 0.160 119.645 119.600 -0.191 0.000 2.086 323 M HA -0.156 4.326 4.480 0.003 0.000 0.261 323 M C 2.472 178.542 176.300 -0.384 0.000 1.067 323 M CA 1.611 56.591 55.300 -0.534 0.000 1.116 323 M CB -0.364 32.026 32.600 -0.350 0.000 1.348 323 M HN 0.226 8.516 8.290 -0.000 0.000 0.407 324 A N -0.223 122.416 122.820 -0.301 0.000 1.902 324 A HA -0.111 4.211 4.320 0.003 0.000 0.217 324 A C 2.191 179.661 177.584 -0.190 0.000 1.181 324 A CA 1.644 53.510 52.037 -0.285 0.000 0.623 324 A CB -0.997 17.846 19.000 -0.263 0.000 0.818 324 A HN 0.312 8.462 8.150 -0.000 0.000 0.443 325 V N -0.090 119.668 119.914 -0.260 0.000 2.427 325 V HA -0.160 3.961 4.120 0.003 0.000 0.248 325 V C 2.797 178.865 176.094 -0.044 0.000 1.051 325 V CA 1.854 64.047 62.300 -0.179 0.000 1.048 325 V CB -1.397 30.254 31.823 -0.287 0.000 0.666 325 V HN 0.621 8.811 8.190 -0.000 0.000 0.456 326 G N -0.859 107.916 108.800 -0.042 0.000 2.421 326 G HA2 -0.322 3.640 3.960 0.003 0.000 0.216 326 G HA3 -0.322 3.640 3.960 0.003 0.000 0.216 326 G C 1.579 176.541 174.900 0.102 0.000 1.171 326 G CA 1.034 46.163 45.100 0.048 0.000 0.775 326 G HN 0.483 8.773 8.290 -0.000 0.000 0.543 327 F N 0.903 120.813 119.950 -0.068 0.000 2.102 327 F HA -0.010 4.519 4.527 0.003 0.000 0.298 327 F C 2.669 178.518 175.800 0.082 0.000 1.105 327 F CA 2.059 60.016 58.000 -0.072 0.000 1.239 327 F CB -0.102 38.564 39.000 -0.557 0.000 0.991 327 F HN 0.166 8.466 8.300 -0.000 0.000 0.474 328 M N -0.022 119.695 119.600 0.194 0.000 2.080 328 M HA -0.230 4.252 4.480 0.003 0.000 0.260 328 M C 1.905 178.280 176.300 0.125 0.000 1.068 328 M CA 1.959 57.416 55.300 0.261 0.000 1.109 328 M CB -0.451 32.303 32.600 0.256 0.000 1.342 328 M HN 0.290 8.580 8.290 -0.000 0.000 0.405 329 L N -0.023 121.232 121.223 0.052 0.000 2.275 329 L HA -0.077 4.265 4.340 0.003 0.000 0.215 329 L C 2.583 179.502 176.870 0.083 0.000 1.119 329 L CA 0.790 55.648 54.840 0.029 0.000 0.790 329 L CB -0.733 41.327 42.059 0.001 0.000 0.919 329 L HN 0.436 8.666 8.230 -0.000 0.000 0.443 330 A N -2.110 120.740 122.820 0.049 0.000 2.030 330 A HA -0.060 4.262 4.320 0.003 0.000 0.215 330 A C 1.181 178.987 177.584 0.369 0.000 1.164 330 A CA 0.159 52.292 52.037 0.159 0.000 0.697 330 A CB -0.326 18.593 19.000 -0.134 0.000 0.827 330 A HN 0.290 8.440 8.150 -0.000 0.000 0.457 331 H N 0.914 120.043 119.070 0.099 0.000 2.683 331 H HA 0.163 4.720 4.556 0.003 0.000 0.339 331 H C -1.651 173.728 175.328 0.085 0.000 1.081 331 H CA -1.289 54.760 56.048 0.001 0.000 1.432 331 H CB 1.469 31.095 29.762 -0.226 0.000 1.462 331 H HN 0.095 8.375 8.280 -0.000 0.000 0.557 332 P HA -0.154 4.266 4.420 -0.000 0.000 0.222 332 P C 0.261 177.622 177.300 0.102 0.000 1.147 332 P CA 0.718 63.794 63.100 -0.040 0.000 0.790 332 P CB -0.151 31.472 31.700 -0.128 0.000 0.780 333 Y N 2.149 122.579 120.300 0.215 0.000 2.544 333 Y HA 0.326 4.878 4.550 0.003 0.000 0.330 333 Y C 1.305 177.222 175.900 0.029 0.000 1.136 333 Y CA 1.287 59.479 58.100 0.152 0.000 1.417 333 Y CB -0.307 38.286 38.460 0.221 0.000 1.229 333 Y HN 0.299 8.579 8.280 -0.000 0.000 0.532 334 G N 4.630 113.087 108.800 -0.572 0.000 2.894 334 G HA2 -0.325 3.637 3.960 0.003 0.000 0.247 334 G HA3 -0.325 3.637 3.960 0.003 0.000 0.247 334 G C -1.229 173.561 174.900 -0.184 0.000 1.442 334 G CA -0.254 44.559 45.100 -0.477 0.000 0.897 334 G HN 0.894 9.184 8.290 -0.000 0.000 0.550 335 F N 2.141 121.939 119.950 -0.254 0.000 2.405 335 F HA 0.608 5.136 4.527 0.003 0.000 0.355 335 F C 1.249 176.935 175.800 -0.191 0.000 1.121 335 F CA 0.126 58.011 58.000 -0.191 0.000 1.112 335 F CB 1.197 40.102 39.000 -0.159 0.000 1.126 335 F HN 0.798 9.098 8.300 -0.000 0.000 0.481 336 T N 4.228 118.325 114.554 -0.762 0.000 2.845 336 T HA 0.435 4.786 4.350 0.003 0.000 0.288 336 T C -0.371 174.071 174.700 -0.430 0.000 0.980 336 T CA -0.925 60.889 62.100 -0.476 0.000 1.071 336 T CB 1.457 70.119 68.868 -0.343 0.000 0.941 336 T HN 0.776 9.016 8.240 -0.000 0.000 0.487 337 R N 2.405 122.798 120.500 -0.179 0.000 2.393 337 R HA 0.588 4.930 4.340 0.003 0.000 0.315 337 R C -1.387 174.921 176.300 0.012 0.000 0.952 337 R CA -0.701 55.351 56.100 -0.080 0.000 0.842 337 R CB 1.397 31.658 30.300 -0.066 0.000 1.163 337 R HN 0.612 8.882 8.270 -0.000 0.000 0.450 338 V N 5.454 125.392 119.914 0.040 0.000 2.567 338 V HA 0.309 4.431 4.120 0.003 0.000 0.289 338 V C 0.279 176.439 176.094 0.111 0.000 1.049 338 V CA -0.634 61.722 62.300 0.094 0.000 0.969 338 V CB 1.461 33.375 31.823 0.151 0.000 0.995 338 V HN 0.792 8.982 8.190 -0.000 0.000 0.471 339 M N 3.967 123.649 119.600 0.138 0.000 2.367 339 M HA 0.553 5.035 4.480 0.003 0.000 0.339 339 M C -0.233 176.100 176.300 0.054 0.000 1.177 339 M CA 0.534 55.903 55.300 0.115 0.000 1.068 339 M CB 1.626 34.321 32.600 0.158 0.000 1.602 339 M HN 0.627 8.917 8.290 -0.000 0.000 0.457 340 S N 2.514 118.210 115.700 -0.007 0.000 2.733 340 S HA 0.777 5.249 4.470 0.003 0.000 0.294 340 S C -1.239 173.405 174.600 0.073 0.000 1.149 340 S CA -0.607 57.599 58.200 0.011 0.000 1.034 340 S CB 0.673 63.865 63.200 -0.014 0.000 1.015 340 S HN 0.840 9.150 8.310 -0.000 0.000 0.486 341 S N 2.818 118.531 115.700 0.021 0.000 2.786 341 S HA 0.799 5.271 4.470 0.003 0.000 0.307 341 S C -1.343 173.320 174.600 0.105 0.000 1.121 341 S CA -0.705 57.506 58.200 0.018 0.000 0.975 341 S CB 0.753 63.808 63.200 -0.241 0.000 1.220 341 S HN 0.789 9.099 8.310 -0.000 0.000 0.550 342 Y N -0.908 119.421 120.300 0.048 0.000 2.499 342 Y HA 0.719 5.271 4.550 0.003 0.000 0.347 342 Y C -0.421 175.452 175.900 -0.045 0.000 0.987 342 Y CA -1.282 56.746 58.100 -0.120 0.000 1.044 342 Y CB 0.764 39.016 38.460 -0.348 0.000 1.245 342 Y HN 0.387 8.667 8.280 -0.000 0.000 0.461 343 R N 2.095 122.626 120.500 0.052 0.000 2.441 343 R HA 0.369 4.711 4.340 0.003 0.000 0.284 343 R C -1.445 175.137 176.300 0.470 0.000 1.070 343 R CA -0.300 55.867 56.100 0.113 0.000 1.047 343 R CB 0.815 31.079 30.300 -0.059 0.000 1.016 343 R HN 0.977 9.247 8.270 -0.000 0.000 0.477 344 W N 2.527 124.056 121.300 0.382 0.000 3.031 344 W HA 0.494 5.156 4.660 0.003 0.000 0.337 344 W C -2.622 174.056 176.519 0.266 0.000 1.187 344 W CA -2.609 54.899 57.345 0.272 0.000 1.166 344 W CB 0.274 29.885 29.460 0.251 0.000 1.437 344 W HN 0.328 8.508 8.180 -0.000 0.000 0.551 345 P HA 0.140 4.560 4.420 -0.000 0.000 0.237 345 P C -0.236 177.072 177.300 0.014 0.000 1.788 345 P CA -0.132 63.013 63.100 0.074 0.000 1.061 345 P CB 0.077 31.824 31.700 0.079 0.000 1.967 346 R N 2.372 122.690 120.500 -0.303 0.000 2.502 346 R HA 0.114 4.456 4.340 0.003 0.000 0.292 346 R C -0.951 175.200 176.300 -0.250 0.000 0.998 346 R CA 0.267 56.100 56.100 -0.445 0.000 1.056 346 R CB -0.095 29.588 30.300 -1.029 0.000 0.939 346 R HN 0.299 8.569 8.270 -0.000 0.000 0.411 347 Y N 5.434 125.512 120.300 -0.370 0.000 2.307 347 Y HA 0.280 4.832 4.550 0.003 0.000 0.323 347 Y C -1.691 174.059 175.900 -0.251 0.000 1.100 347 Y CA -1.062 56.908 58.100 -0.216 0.000 1.140 347 Y CB 0.758 39.188 38.460 -0.049 0.000 1.159 347 Y HN 0.466 8.746 8.280 -0.000 0.000 0.436 348 F N 4.511 124.188 119.950 -0.455 0.000 2.421 348 F HA 0.278 4.807 4.527 0.003 0.000 0.358 348 F C 0.674 176.208 175.800 -0.443 0.000 1.115 348 F CA -0.395 57.422 58.000 -0.306 0.000 1.160 348 F CB 1.137 40.008 39.000 -0.214 0.000 1.123 348 F HN 0.535 8.835 8.300 -0.000 0.000 0.508 349 E N 3.389 123.595 120.200 0.009 0.000 2.427 349 E HA 0.161 4.513 4.350 0.003 0.000 0.259 349 E C -0.773 175.886 176.600 0.099 0.000 1.267 349 E CA -0.324 56.131 56.400 0.092 0.000 1.425 349 E CB -0.528 29.320 29.700 0.246 0.000 1.482 349 E HN 0.487 8.847 8.360 -0.000 0.000 0.460 350 N N 1.552 120.290 118.700 0.064 0.000 2.492 350 N HA -0.237 4.505 4.740 0.003 0.000 0.297 350 N C 0.500 176.059 175.510 0.083 0.000 1.456 350 N CA 1.585 54.665 53.050 0.051 0.000 0.683 350 N CB -0.642 37.860 38.487 0.024 0.000 1.007 350 N HN 0.706 9.086 8.380 -0.000 0.000 0.478 351 G N 1.103 109.958 108.800 0.091 0.000 2.956 351 G HA2 -0.296 3.666 3.960 0.003 0.000 0.210 351 G HA3 -0.296 3.666 3.960 0.003 0.000 0.210 351 G C -0.014 175.029 174.900 0.239 0.000 1.316 351 G CA 0.459 45.621 45.100 0.104 0.000 0.819 351 G HN 0.728 9.018 8.290 -0.000 0.000 0.544 352 K N 1.488 122.048 120.400 0.265 0.000 2.164 352 K HA 0.476 4.798 4.320 0.003 0.000 0.258 352 K C -1.426 175.315 176.600 0.235 0.000 0.951 352 K CA -0.478 55.980 56.287 0.285 0.000 0.844 352 K CB 1.560 34.173 32.500 0.188 0.000 1.099 352 K HN 0.190 8.440 8.250 -0.000 0.000 0.435 353 D N 3.313 123.764 120.400 0.086 0.000 2.352 353 D HA 0.011 4.652 4.640 0.003 0.000 0.245 353 D C 0.995 177.361 176.300 0.110 0.000 1.224 353 D CA -0.388 53.461 54.000 -0.252 0.000 0.879 353 D CB 0.907 41.462 40.800 -0.409 0.000 1.057 353 D HN 0.301 8.671 8.370 -0.000 0.000 0.491 354 V N 1.629 121.654 119.914 0.185 0.000 3.510 354 V HA 0.097 4.219 4.120 0.003 0.000 0.270 354 V C 0.647 177.005 176.094 0.440 0.000 1.201 354 V CA 0.573 63.074 62.300 0.334 0.000 1.166 354 V CB -0.560 31.468 31.823 0.342 0.000 0.825 354 V HN 0.362 8.552 8.190 -0.000 0.000 0.484 355 N N 1.662 120.522 118.700 0.267 0.000 2.275 355 N HA 0.084 4.826 4.740 0.003 0.000 0.236 355 N C 0.865 176.291 175.510 -0.140 0.000 1.154 355 N CA 0.729 53.766 53.050 -0.022 0.000 0.866 355 N CB 0.309 38.827 38.487 0.051 0.000 1.093 355 N HN 0.800 9.180 8.380 -0.000 0.000 0.515 356 D N -0.467 120.024 120.400 0.153 0.000 2.378 356 D HA -0.121 4.521 4.640 0.003 0.000 0.227 356 D C 1.493 177.972 176.300 0.297 0.000 1.012 356 D CA 0.103 54.173 54.000 0.117 0.000 0.905 356 D CB -0.433 40.569 40.800 0.336 0.000 0.895 356 D HN 0.477 8.847 8.370 -0.000 0.000 0.532 357 W N 0.439 121.970 121.300 0.386 0.000 2.812 357 W HA 0.292 4.954 4.660 0.003 0.000 0.263 357 W C -0.195 176.440 176.519 0.193 0.000 1.284 357 W CA -0.587 56.989 57.345 0.384 0.000 1.430 357 W CB -0.677 28.996 29.460 0.355 0.000 1.088 357 W HN -0.301 7.879 8.180 -0.000 0.000 0.623 358 V N 3.374 122.864 119.914 -0.707 0.000 2.644 358 V HA 0.126 4.248 4.120 0.003 0.000 0.305 358 V C 1.438 177.548 176.094 0.025 0.000 1.053 358 V CA 1.063 62.977 62.300 -0.644 0.000 1.186 358 V CB -0.255 31.149 31.823 -0.698 0.000 0.895 358 V HN 0.179 8.369 8.190 -0.000 0.000 0.490 359 G N 6.441 115.244 108.800 0.005 0.000 2.535 359 G HA2 0.471 4.432 3.960 0.003 0.000 0.282 359 G HA3 0.471 4.432 3.960 0.003 0.000 0.282 359 G C -2.357 172.239 174.900 -0.506 0.000 1.350 359 G CA -1.020 44.049 45.100 -0.052 0.000 1.039 359 G HN 0.640 8.930 8.290 -0.000 0.000 0.509 360 P HA 0.160 4.580 4.420 -0.000 0.000 0.271 360 P C -2.643 174.136 177.300 -0.868 0.000 1.233 360 P CA -0.930 61.304 63.100 -1.443 0.000 0.789 360 P CB -0.256 30.954 31.700 -0.818 0.000 0.951 361 P HA 0.039 4.459 4.420 -0.000 0.000 0.262 361 P C -0.308 176.785 177.300 -0.345 0.000 1.182 361 P CA 0.754 63.501 63.100 -0.589 0.000 0.761 361 P CB -0.266 30.963 31.700 -0.784 0.000 0.795 362 N N 0.343 118.932 118.700 -0.185 0.000 2.825 362 N HA 0.430 5.172 4.740 0.003 0.000 0.253 362 N C -1.816 173.682 175.510 -0.020 0.000 1.426 362 N CA -0.902 52.099 53.050 -0.082 0.000 0.851 362 N CB 1.320 39.776 38.487 -0.051 0.000 1.470 362 N HN -0.021 8.359 8.380 -0.000 0.000 0.517 363 D N 0.497 120.903 120.400 0.010 0.000 2.454 363 D HA 0.314 4.956 4.640 0.003 0.000 0.247 363 D C -0.558 175.786 176.300 0.074 0.000 1.129 363 D CA -0.076 53.940 54.000 0.026 0.000 0.877 363 D CB 0.451 41.255 40.800 0.007 0.000 1.082 363 D HN 0.615 8.985 8.370 -0.000 0.000 0.537 364 N N 1.924 120.696 118.700 0.121 0.000 2.725 364 N HA -0.225 4.517 4.740 0.003 0.000 0.251 364 N C 1.132 176.837 175.510 0.326 0.000 1.031 364 N CA 1.369 54.551 53.050 0.220 0.000 0.720 364 N CB -0.952 37.603 38.487 0.113 0.000 0.930 364 N HN 0.876 9.256 8.380 -0.000 0.000 0.543 365 G N -3.000 105.988 108.800 0.312 0.000 2.258 365 G HA2 -0.330 3.632 3.960 0.003 0.000 0.233 365 G HA3 -0.330 3.632 3.960 0.003 0.000 0.233 365 G C 0.021 174.910 174.900 -0.019 0.000 1.006 365 G CA 0.128 45.262 45.100 0.057 0.000 0.620 365 G HN 0.533 8.823 8.290 -0.000 0.000 0.511 366 V N 3.136 123.059 119.914 0.015 0.000 2.439 366 V HA 0.413 4.534 4.120 0.003 0.000 0.271 366 V C 1.092 177.164 176.094 -0.037 0.000 1.040 366 V CA 0.419 62.709 62.300 -0.018 0.000 1.002 366 V CB 0.882 32.704 31.823 -0.001 0.000 1.000 366 V HN 0.350 8.540 8.190 -0.000 0.000 0.477 367 T N 6.339 120.856 114.554 -0.062 0.000 2.902 367 T HA 0.087 4.439 4.350 0.003 0.000 0.301 367 T C 0.375 175.075 174.700 -0.001 0.000 1.012 367 T CA -0.004 62.067 62.100 -0.049 0.000 1.151 367 T CB 0.077 68.915 68.868 -0.051 0.000 0.946 367 T HN 0.569 8.809 8.240 -0.000 0.000 0.542 368 K N 3.213 123.632 120.400 0.032 0.000 2.326 368 K HA 0.113 4.435 4.320 0.003 0.000 0.275 368 K C 1.006 177.699 176.600 0.156 0.000 1.018 368 K CA -0.434 55.895 56.287 0.070 0.000 0.962 368 K CB 0.746 33.269 32.500 0.038 0.000 0.953 368 K HN 0.722 8.972 8.250 -0.000 0.000 0.475 369 E N 0.693 120.911 120.200 0.031 0.000 2.409 369 E HA 0.079 4.431 4.350 0.003 0.000 0.257 369 E C -0.633 175.880 176.600 -0.144 0.000 1.150 369 E CA -0.672 55.668 56.400 -0.099 0.000 0.942 369 E CB 0.559 30.204 29.700 -0.093 0.000 0.979 369 E HN 0.049 8.409 8.360 -0.000 0.000 0.447 370 V N 2.490 122.107 119.914 -0.495 0.000 2.389 370 V HA 0.144 4.266 4.120 0.003 0.000 0.264 370 V C 0.397 176.321 176.094 -0.282 0.000 1.049 370 V CA -0.197 61.702 62.300 -0.667 0.000 0.932 370 V CB 0.454 31.458 31.823 -1.365 0.000 1.011 370 V HN 0.825 9.015 8.190 -0.000 0.000 0.475 371 T N 4.083 118.569 114.554 -0.113 0.000 2.928 371 T HA 0.697 5.049 4.350 0.003 0.000 0.284 371 T C -0.490 174.183 174.700 -0.045 0.000 1.008 371 T CA -0.789 61.276 62.100 -0.057 0.000 1.057 371 T CB 1.597 70.457 68.868 -0.014 0.000 1.018 371 T HN 0.207 8.447 8.240 -0.000 0.000 0.493 372 I N 2.880 123.433 120.570 -0.029 0.000 2.377 372 I HA 0.385 4.557 4.170 0.003 0.000 0.293 372 I C 0.250 176.369 176.117 0.003 0.000 0.987 372 I CA -1.092 60.199 61.300 -0.014 0.000 1.185 372 I CB 1.168 39.164 38.000 -0.007 0.000 1.341 372 I HN 0.687 8.897 8.210 -0.000 0.000 0.455 373 N N 7.918 126.623 118.700 0.009 0.000 2.445 373 N HA 0.308 5.050 4.740 0.003 0.000 0.264 373 N C -1.531 173.991 175.510 0.020 0.000 1.227 373 N CA -1.329 51.730 53.050 0.015 0.000 0.963 373 N CB 0.714 39.211 38.487 0.017 0.000 1.188 373 N HN 0.358 8.738 8.380 -0.000 0.000 0.491 374 P HA -0.110 4.310 4.420 -0.000 0.000 0.222 374 P C 0.142 177.459 177.300 0.029 0.000 1.147 374 P CA 1.202 64.316 63.100 0.023 0.000 0.790 374 P CB 0.186 31.897 31.700 0.018 0.000 0.780 375 D N -1.102 119.313 120.400 0.027 0.000 2.325 375 D HA -0.026 4.616 4.640 0.003 0.000 0.225 375 D C 0.734 177.062 176.300 0.047 0.000 1.096 375 D CA 0.796 54.815 54.000 0.032 0.000 0.844 375 D CB -1.068 39.743 40.800 0.018 0.000 0.925 375 D HN 0.227 8.597 8.370 -0.000 0.000 0.513 376 T N -3.879 110.704 114.554 0.047 0.000 6.386 376 T HA -0.265 4.086 4.350 0.003 0.000 0.278 376 T C 0.502 175.206 174.700 0.006 0.000 2.163 376 T CA 1.493 63.623 62.100 0.050 0.000 3.541 376 T CB -3.036 65.902 68.868 0.117 0.000 1.383 376 T HN 0.568 8.808 8.240 -0.000 0.000 1.186 377 T N -1.216 113.351 114.554 0.022 0.000 2.810 377 T HA 0.686 5.038 4.350 0.003 0.000 0.277 377 T C 0.796 175.507 174.700 0.019 0.000 0.973 377 T CA -0.288 61.834 62.100 0.036 0.000 0.949 377 T CB 1.351 70.257 68.868 0.063 0.000 1.075 377 T HN 0.627 8.867 8.240 -0.000 0.000 0.537 378 c N 0.145 118.773 118.600 0.048 0.000 2.454 378 c HA 0.902 5.474 4.570 0.003 0.000 0.336 378 c C 1.264 175.399 174.090 0.074 0.000 1.189 378 c CA -0.462 55.898 56.329 0.051 0.000 1.877 378 c CB 0.845 43.407 42.510 0.086 0.000 2.348 378 c HN 1.196 9.426 8.230 -0.000 0.000 0.508 379 G N 0.309 109.152 108.800 0.070 0.000 2.795 379 G HA2 0.477 4.438 3.960 0.003 0.000 0.267 379 G HA3 0.477 4.438 3.960 0.003 0.000 0.267 379 G C -0.038 174.929 174.900 0.111 0.000 1.362 379 G CA -0.203 44.935 45.100 0.063 0.000 1.048 379 G HN 0.755 9.045 8.290 -0.000 0.000 0.547 380 N N -0.018 118.708 118.700 0.044 0.000 2.714 380 N HA -0.151 4.591 4.740 0.003 0.000 0.250 380 N C 0.089 175.481 175.510 -0.196 0.000 1.117 380 N CA 1.324 54.367 53.050 -0.011 0.000 0.719 380 N CB -0.566 37.980 38.487 0.098 0.000 1.081 380 N HN 0.647 9.027 8.380 -0.000 0.000 0.557 381 D N -3.676 116.638 120.400 -0.143 0.000 3.090 381 D HA -0.222 4.419 4.640 0.003 0.000 0.215 381 D C -0.513 175.628 176.300 -0.265 0.000 1.140 381 D CA 1.000 54.878 54.000 -0.204 0.000 0.937 381 D CB -1.423 39.234 40.800 -0.237 0.000 1.108 381 D HN 0.541 8.911 8.370 -0.000 0.000 0.420 382 W N 0.108 121.369 121.300 -0.065 0.000 2.322 382 W HA 0.377 5.039 4.660 0.003 0.000 0.307 382 W C 1.694 178.179 176.519 -0.055 0.000 1.220 382 W CA -0.929 56.386 57.345 -0.050 0.000 1.210 382 W CB 0.803 30.178 29.460 -0.142 0.000 1.223 382 W HN -0.271 7.909 8.180 -0.000 0.000 0.511 383 V N 2.212 122.174 119.914 0.079 0.000 2.488 383 V HA -0.220 3.901 4.120 0.003 0.000 0.246 383 V C 1.231 177.359 176.094 0.056 0.000 1.046 383 V CA 0.454 62.701 62.300 -0.087 0.000 1.053 383 V CB -0.884 30.563 31.823 -0.627 0.000 0.679 383 V HN 0.876 9.066 8.190 -0.000 0.000 0.458 384 c N 1.309 119.972 118.600 0.104 0.000 4.056 384 c HA -0.158 4.414 4.570 0.003 0.000 0.302 384 c C 1.691 175.583 174.090 -0.330 0.000 1.356 384 c CA 0.513 56.852 56.329 0.017 0.000 2.074 384 c CB -2.521 39.990 42.510 0.002 0.000 1.328 384 c HN 0.682 8.912 8.230 -0.000 0.000 0.684 385 E N 0.431 120.302 120.200 -0.548 0.000 2.160 385 E HA -0.192 4.160 4.350 0.003 0.000 0.195 385 E C 1.936 178.222 176.600 -0.524 0.000 0.991 385 E CA 1.720 57.395 56.400 -1.210 0.000 0.810 385 E CB -0.199 28.988 29.700 -0.854 0.000 0.742 385 E HN 0.969 9.329 8.360 -0.000 0.000 0.466 386 H N -0.069 118.873 119.070 -0.213 0.000 2.518 386 H HA 0.080 4.637 4.556 0.003 0.000 0.289 386 H C 1.321 176.748 175.328 0.165 0.000 1.051 386 H CA 0.985 57.053 56.048 0.033 0.000 1.280 386 H CB -0.037 29.655 29.762 -0.117 0.000 1.380 386 H HN 0.098 8.378 8.280 -0.000 0.000 0.566 387 R N -0.590 119.640 120.500 -0.451 0.000 2.312 387 R HA 0.053 4.395 4.340 0.003 0.000 0.205 387 R C -0.143 176.296 176.300 0.232 0.000 0.904 387 R CA -0.421 55.549 56.100 -0.216 0.000 1.052 387 R CB 0.244 30.227 30.300 -0.530 0.000 1.014 387 R HN 0.114 8.384 8.270 -0.000 0.000 0.503 388 W N 1.948 123.274 121.300 0.043 0.000 2.264 388 W HA 0.093 4.755 4.660 0.003 0.000 0.331 388 W C 1.557 178.157 176.519 0.134 0.000 1.364 388 W CA -0.936 56.465 57.345 0.093 0.000 1.253 388 W CB -0.049 29.485 29.460 0.124 0.000 1.215 388 W HN 0.089 8.269 8.180 -0.000 0.000 0.561 389 R N 1.680 122.368 120.500 0.312 0.000 2.113 389 R HA -0.304 4.038 4.340 0.003 0.000 0.244 389 R C 1.748 178.174 176.300 0.209 0.000 1.142 389 R CA 2.513 58.744 56.100 0.219 0.000 0.953 389 R CB 0.032 30.407 30.300 0.126 0.000 0.860 389 R HN 0.494 8.764 8.270 -0.000 0.000 0.438 390 Q N 0.027 119.960 119.800 0.221 0.000 2.124 390 Q HA -0.094 4.248 4.340 0.003 0.000 0.202 390 Q C 2.021 178.172 176.000 0.252 0.000 0.977 390 Q CA 1.680 57.600 55.803 0.195 0.000 0.850 390 Q CB -0.077 28.798 28.738 0.229 0.000 0.901 390 Q HN 0.462 8.732 8.270 -0.000 0.000 0.429 391 I N -0.214 120.544 120.570 0.312 0.000 2.235 391 I HA -0.165 4.006 4.170 0.003 0.000 0.241 391 I C 2.540 178.786 176.117 0.214 0.000 1.085 391 I CA 0.616 62.067 61.300 0.252 0.000 1.378 391 I CB -0.269 37.878 38.000 0.245 0.000 1.076 391 I HN 0.151 8.361 8.210 -0.000 0.000 0.415 392 R N 1.465 122.137 120.500 0.286 0.000 2.103 392 R HA -0.212 4.130 4.340 0.003 0.000 0.242 392 R C 1.814 178.187 176.300 0.121 0.000 1.142 392 R CA 1.960 58.231 56.100 0.284 0.000 0.960 392 R CB -0.454 30.099 30.300 0.422 0.000 0.858 392 R HN 0.343 8.613 8.270 -0.000 0.000 0.439 393 N N -0.000 118.788 118.700 0.147 0.000 2.270 393 N HA -0.080 4.661 4.740 0.003 0.000 0.181 393 N C 1.592 177.184 175.510 0.137 0.000 1.016 393 N CA 1.045 54.175 53.050 0.134 0.000 0.870 393 N CB -0.103 38.465 38.487 0.135 0.000 0.979 393 N HN 0.221 8.601 8.380 -0.000 0.000 0.431 394 M N -0.132 119.536 119.600 0.112 0.000 2.419 394 M HA 0.053 4.534 4.480 0.003 0.000 0.264 394 M C 1.775 178.101 176.300 0.044 0.000 1.082 394 M CA 0.387 55.741 55.300 0.091 0.000 1.119 394 M CB -0.496 32.140 32.600 0.061 0.000 1.398 394 M HN -0.102 8.188 8.290 -0.000 0.000 0.453 395 V N 1.187 121.069 119.914 -0.053 0.000 2.358 395 V HA -0.252 3.870 4.120 0.003 0.000 0.246 395 V C 2.169 178.151 176.094 -0.187 0.000 1.047 395 V CA 1.467 63.638 62.300 -0.214 0.000 1.035 395 V CB -0.692 30.809 31.823 -0.538 0.000 0.658 395 V HN 0.489 8.679 8.190 -0.000 0.000 0.452 396 N N -0.542 118.074 118.700 -0.139 0.000 2.216 396 N HA -0.138 4.603 4.740 0.003 0.000 0.183 396 N C 1.817 177.204 175.510 -0.205 0.000 1.017 396 N CA 1.391 54.354 53.050 -0.145 0.000 0.861 396 N CB -0.257 38.183 38.487 -0.078 0.000 0.986 396 N HN 0.503 8.883 8.380 -0.000 0.000 0.428 397 F N 2.751 122.533 119.950 -0.281 0.000 2.095 397 F HA -0.158 4.371 4.527 0.003 0.000 0.298 397 F C 2.644 178.306 175.800 -0.231 0.000 1.104 397 F CA 1.444 59.241 58.000 -0.338 0.000 1.232 397 F CB -0.239 38.718 39.000 -0.073 0.000 0.987 397 F HN -0.126 8.174 8.300 -0.000 0.000 0.475 398 R N 0.440 121.036 120.500 0.161 0.000 2.091 398 R HA -0.209 4.133 4.340 0.003 0.000 0.238 398 R C 2.040 178.296 176.300 -0.073 0.000 1.136 398 R CA 2.151 58.294 56.100 0.070 0.000 0.959 398 R CB -0.575 29.731 30.300 0.010 0.000 0.856 398 R HN 0.488 8.758 8.270 -0.000 0.000 0.437 399 N N -0.660 117.965 118.700 -0.126 0.000 2.069 399 N HA -0.163 4.579 4.740 0.003 0.000 0.191 399 N C 1.707 177.126 175.510 -0.150 0.000 1.031 399 N CA 1.420 54.392 53.050 -0.130 0.000 0.852 399 N CB -0.009 38.397 38.487 -0.134 0.000 1.018 399 N HN 0.012 8.392 8.380 -0.000 0.000 0.423 400 V N 0.938 120.704 119.914 -0.246 0.000 2.427 400 V HA -0.118 4.003 4.120 0.003 0.000 0.248 400 V C 1.987 177.945 176.094 -0.227 0.000 1.051 400 V CA 1.412 63.553 62.300 -0.265 0.000 1.048 400 V CB -0.244 31.314 31.823 -0.441 0.000 0.666 400 V HN 0.375 8.565 8.190 -0.000 0.000 0.456 401 V N -2.566 117.193 119.914 -0.257 0.000 3.621 401 V HA 0.283 4.404 4.120 0.003 0.000 0.285 401 V C 0.514 176.572 176.094 -0.059 0.000 1.346 401 V CA -0.288 61.911 62.300 -0.168 0.000 1.104 401 V CB -0.318 31.364 31.823 -0.236 0.000 0.913 401 V HN 0.403 8.593 8.190 -0.000 0.000 0.432 402 D N 1.541 121.907 120.400 -0.058 0.000 2.533 402 D HA 0.395 5.037 4.640 0.003 0.000 0.236 402 D C 1.520 177.814 176.300 -0.010 0.000 1.137 402 D CA 2.314 56.301 54.000 -0.023 0.000 0.867 402 D CB 0.626 41.409 40.800 -0.029 0.000 1.170 402 D HN 0.598 8.968 8.370 -0.000 0.000 0.474 403 G N 2.362 111.165 108.800 0.005 0.000 2.234 403 G HA2 -0.273 3.689 3.960 0.003 0.000 0.260 403 G HA3 -0.273 3.689 3.960 0.003 0.000 0.260 403 G C 0.219 175.133 174.900 0.023 0.000 0.987 403 G CA 0.091 45.197 45.100 0.010 0.000 0.625 403 G HN 0.547 8.837 8.290 -0.000 0.000 0.532 404 Q N 1.426 121.245 119.800 0.031 0.000 2.340 404 Q HA 0.412 4.754 4.340 0.003 0.000 0.249 404 Q C -1.872 174.177 176.000 0.082 0.000 0.957 404 Q CA -1.360 54.474 55.803 0.052 0.000 0.882 404 Q CB 0.944 29.712 28.738 0.050 0.000 1.235 404 Q HN 0.411 8.681 8.270 -0.000 0.000 0.439 405 P HA 0.088 4.508 4.420 -0.000 0.000 0.272 405 P C -0.738 176.681 177.300 0.198 0.000 1.240 405 P CA -0.353 62.822 63.100 0.124 0.000 0.791 405 P CB 0.440 32.202 31.700 0.104 0.000 0.978 406 F N 1.887 121.852 119.950 0.025 0.000 2.421 406 F HA 0.384 4.913 4.527 0.003 0.000 0.358 406 F C 0.287 176.160 175.800 0.122 0.000 1.115 406 F CA 0.489 58.509 58.000 0.034 0.000 1.160 406 F CB 0.166 39.095 39.000 -0.119 0.000 1.123 406 F HN 0.388 8.688 8.300 -0.000 0.000 0.508 407 T N 1.644 116.173 114.554 -0.042 0.000 2.778 407 T HA 0.330 4.682 4.350 0.003 0.000 0.293 407 T C -0.353 174.385 174.700 0.064 0.000 1.144 407 T CA -1.076 61.038 62.100 0.023 0.000 1.010 407 T CB 1.364 70.295 68.868 0.104 0.000 1.325 407 T HN 0.513 8.753 8.240 -0.000 0.000 0.515 408 N N 0.522 119.313 118.700 0.151 0.000 2.714 408 N HA -0.133 4.609 4.740 0.003 0.000 0.252 408 N C -0.524 175.146 175.510 0.267 0.000 1.014 408 N CA 0.634 53.828 53.050 0.240 0.000 0.735 408 N CB -0.924 37.763 38.487 0.333 0.000 0.924 408 N HN 0.747 9.127 8.380 -0.000 0.000 0.540 409 W N 1.119 122.438 121.300 0.032 0.000 2.216 409 W HA 0.332 4.994 4.660 0.003 0.000 0.326 409 W C -0.463 176.169 176.519 0.189 0.000 1.319 409 W CA -0.156 57.217 57.345 0.046 0.000 1.213 409 W CB 0.275 29.706 29.460 -0.048 0.000 1.171 409 W HN 0.232 8.412 8.180 -0.000 0.000 0.557 410 Y N 5.300 125.228 120.300 -0.621 0.000 2.524 410 Y HA 0.416 4.968 4.550 0.003 0.000 0.347 410 Y C -1.507 174.026 175.900 -0.612 0.000 1.005 410 Y CA -0.831 57.063 58.100 -0.343 0.000 1.025 410 Y CB 1.515 39.928 38.460 -0.077 0.000 1.275 410 Y HN 0.541 8.821 8.280 -0.000 0.000 0.460 411 D N 1.854 121.392 120.400 -1.436 0.000 2.654 411 D HA 0.185 4.827 4.640 0.003 0.000 0.231 411 D C -1.182 174.606 176.300 -0.853 0.000 1.239 411 D CA -0.791 52.707 54.000 -0.836 0.000 0.790 411 D CB 0.953 41.686 40.800 -0.111 0.000 1.480 411 D HN 0.445 8.815 8.370 -0.000 0.000 0.442 412 N N 1.200 119.739 118.700 -0.268 0.000 2.268 412 N HA 0.188 4.930 4.740 0.003 0.000 0.204 412 N C 1.353 176.912 175.510 0.081 0.000 1.124 412 N CA 0.293 53.371 53.050 0.047 0.000 0.838 412 N CB 0.356 39.044 38.487 0.333 0.000 0.994 412 N HN 1.075 9.455 8.380 -0.000 0.000 0.489 413 G N -1.349 107.468 108.800 0.027 0.000 2.162 413 G HA2 -0.317 3.645 3.960 0.003 0.000 0.260 413 G HA3 -0.317 3.645 3.960 0.003 0.000 0.260 413 G C 0.348 175.275 174.900 0.045 0.000 0.976 413 G CA 0.733 45.872 45.100 0.064 0.000 0.655 413 G HN 0.645 8.935 8.290 -0.000 0.000 0.533 414 S N -1.132 114.590 115.700 0.037 0.000 3.697 414 S HA 0.444 4.916 4.470 0.003 0.000 0.184 414 S C 0.788 175.330 174.600 -0.097 0.000 1.045 414 S CA 0.508 58.708 58.200 -0.000 0.000 1.330 414 S CB 0.356 63.638 63.200 0.137 0.000 1.393 414 S HN 0.208 8.518 8.310 -0.000 0.000 0.855 415 N N 1.517 120.137 118.700 -0.133 0.000 2.365 415 N HA 0.300 5.042 4.740 0.003 0.000 0.257 415 N C -1.330 174.058 175.510 -0.205 0.000 1.287 415 N CA 0.079 53.011 53.050 -0.197 0.000 0.882 415 N CB 1.123 39.469 38.487 -0.235 0.000 1.250 415 N HN 0.451 8.831 8.380 -0.000 0.000 0.507 416 Q N 1.353 121.068 119.800 -0.142 0.000 2.381 416 Q HA 0.444 4.786 4.340 0.003 0.000 0.263 416 Q C -0.492 175.423 176.000 -0.141 0.000 1.030 416 Q CA -0.597 55.112 55.803 -0.157 0.000 0.772 416 Q CB 2.488 31.240 28.738 0.023 0.000 1.232 416 Q HN 0.065 8.335 8.270 -0.000 0.000 0.476 417 V N -1.189 118.583 119.914 -0.236 0.000 3.040 417 V HA 1.054 5.176 4.120 0.003 0.000 0.312 417 V C -1.206 174.695 176.094 -0.321 0.000 1.115 417 V CA -0.831 61.270 62.300 -0.333 0.000 0.998 417 V CB 1.941 33.536 31.823 -0.380 0.000 1.042 417 V HN 0.724 8.915 8.190 -0.000 0.000 0.433 418 A N 2.673 125.224 122.820 -0.448 0.000 2.594 418 A HA 1.057 5.378 4.320 0.003 0.000 0.295 418 A C -1.172 176.112 177.584 -0.500 0.000 1.071 418 A CA -0.338 51.378 52.037 -0.535 0.000 0.685 418 A CB 1.861 20.604 19.000 -0.429 0.000 1.285 418 A HN 2.382 10.532 8.150 -0.000 0.000 0.405 419 F N -1.164 118.308 119.950 -0.797 0.000 2.725 419 F HA 0.779 5.307 4.527 0.003 0.000 0.309 419 F C -0.122 175.294 175.800 -0.640 0.000 1.132 419 F CA -0.336 57.344 58.000 -0.532 0.000 0.957 419 F CB 0.773 39.588 39.000 -0.308 0.000 1.286 419 F HN 1.044 9.344 8.300 -0.000 0.000 0.440 420 G N 0.933 109.750 108.800 0.028 0.000 2.568 420 G HA2 0.684 4.646 3.960 0.003 0.000 0.313 420 G HA3 0.684 4.646 3.960 0.003 0.000 0.313 420 G C -1.407 173.657 174.900 0.274 0.000 1.227 420 G CA -1.285 43.952 45.100 0.228 0.000 0.979 420 G HN 0.603 8.893 8.290 -0.000 0.000 0.486 421 R N 0.610 121.258 120.500 0.247 0.000 2.402 421 R HA 0.460 4.801 4.340 0.003 0.000 0.290 421 R C 0.874 177.249 176.300 0.125 0.000 1.321 421 R CA 0.022 56.247 56.100 0.209 0.000 1.283 421 R CB 0.328 30.751 30.300 0.205 0.000 1.111 421 R HN 1.256 9.526 8.270 -0.000 0.000 0.578 422 G N 3.405 112.280 108.800 0.125 0.000 2.583 422 G HA2 -0.431 3.531 3.960 0.003 0.000 0.292 422 G HA3 -0.431 3.531 3.960 0.003 0.000 0.292 422 G C 0.288 175.239 174.900 0.085 0.000 1.203 422 G CA 0.527 45.681 45.100 0.090 0.000 0.987 422 G HN 0.749 9.039 8.290 -0.000 0.000 0.554 423 N N -0.049 118.687 118.700 0.060 0.000 2.275 423 N HA 0.321 5.063 4.740 0.003 0.000 0.236 423 N C 1.349 176.888 175.510 0.047 0.000 1.154 423 N CA -0.248 52.833 53.050 0.053 0.000 0.866 423 N CB 0.464 38.978 38.487 0.046 0.000 1.093 423 N HN 0.496 8.876 8.380 -0.000 0.000 0.515 424 R N -0.067 120.451 120.500 0.030 0.000 2.373 424 R HA 0.254 4.595 4.340 0.003 0.000 0.221 424 R C 0.189 176.455 176.300 -0.056 0.000 0.893 424 R CA 0.148 56.245 56.100 -0.004 0.000 1.049 424 R CB 1.432 31.704 30.300 -0.047 0.000 1.119 424 R HN 0.233 8.503 8.270 -0.000 0.000 0.535 425 G N 0.403 109.186 108.800 -0.028 0.000 2.632 425 G HA2 0.495 4.457 3.960 0.003 0.000 0.292 425 G HA3 0.495 4.457 3.960 0.003 0.000 0.292 425 G C -2.108 172.930 174.900 0.229 0.000 1.465 425 G CA -0.435 44.634 45.100 -0.052 0.000 0.824 425 G HN 0.008 8.298 8.290 -0.000 0.000 0.509 426 F N 0.418 120.442 119.950 0.123 0.000 2.615 426 F HA 0.784 5.313 4.527 0.003 0.000 0.312 426 F C -1.120 174.614 175.800 -0.109 0.000 1.119 426 F CA -0.895 57.091 58.000 -0.024 0.000 0.979 426 F CB 2.039 40.984 39.000 -0.090 0.000 1.266 426 F HN 0.520 8.820 8.300 -0.000 0.000 0.444 427 I N 5.610 125.628 120.570 -0.921 0.000 2.686 427 I HA 0.740 4.912 4.170 0.003 0.000 0.295 427 I C -1.784 173.649 176.117 -1.141 0.000 1.114 427 I CA -0.755 59.993 61.300 -0.920 0.000 1.038 427 I CB 1.946 39.361 38.000 -0.974 0.000 1.238 427 I HN 0.362 8.572 8.210 -0.000 0.000 0.420 428 V N 6.969 126.287 119.914 -0.994 0.000 2.588 428 V HA 0.536 4.658 4.120 0.003 0.000 0.304 428 V C -1.037 174.550 176.094 -0.845 0.000 1.042 428 V CA -0.517 61.253 62.300 -0.883 0.000 0.877 428 V CB 1.741 33.016 31.823 -0.913 0.000 0.996 428 V HN 0.469 8.659 8.190 -0.000 0.000 0.425 429 F N 2.495 122.170 119.950 -0.458 0.000 2.551 429 F HA 0.593 5.122 4.527 0.003 0.000 0.316 429 F C 0.133 175.681 175.800 -0.421 0.000 1.089 429 F CA -0.638 57.165 58.000 -0.328 0.000 0.915 429 F CB 2.039 40.872 39.000 -0.279 0.000 1.186 429 F HN 0.451 8.751 8.300 -0.000 0.000 0.456 430 N N 1.882 120.519 118.700 -0.105 0.000 2.617 430 N HA 0.204 4.945 4.740 0.003 0.000 0.263 430 N C -0.917 174.516 175.510 -0.128 0.000 1.074 430 N CA -0.251 52.696 53.050 -0.171 0.000 0.841 430 N CB 0.525 38.938 38.487 -0.124 0.000 1.221 430 N HN 0.553 8.933 8.380 -0.000 0.000 0.529 431 N N 1.777 120.366 118.700 -0.186 0.000 2.275 431 N HA 0.183 4.925 4.740 0.003 0.000 0.236 431 N C -0.996 174.361 175.510 -0.255 0.000 1.154 431 N CA -0.163 52.775 53.050 -0.186 0.000 0.866 431 N CB 0.351 38.721 38.487 -0.196 0.000 1.093 431 N HN 0.495 8.875 8.380 -0.000 0.000 0.515 432 D N -0.687 119.477 120.400 -0.392 0.000 2.437 432 D HA 0.177 4.818 4.640 0.003 0.000 0.259 432 D C -0.090 175.908 176.300 -0.503 0.000 1.118 432 D CA -0.155 53.443 54.000 -0.669 0.000 1.017 432 D CB 0.871 40.845 40.800 -1.375 0.000 1.120 432 D HN 0.058 8.428 8.370 -0.000 0.000 0.541 433 D N 0.375 120.531 120.400 -0.408 0.000 2.434 433 D HA 0.143 4.784 4.640 0.003 0.000 0.232 433 D C -0.208 176.251 176.300 0.266 0.000 1.166 433 D CA -0.027 53.997 54.000 0.040 0.000 0.830 433 D CB 0.006 40.936 40.800 0.216 0.000 0.960 433 D HN 0.297 8.667 8.370 -0.000 0.000 0.497 434 W N -1.407 119.934 121.300 0.069 0.000 3.074 434 W HA 0.415 5.077 4.660 0.003 0.000 0.332 434 W C -0.445 176.137 176.519 0.105 0.000 1.253 434 W CA -1.066 56.324 57.345 0.075 0.000 1.180 434 W CB -0.171 29.330 29.460 0.067 0.000 1.445 434 W HN -0.437 7.743 8.180 -0.000 0.000 0.573 435 T N 2.537 117.268 114.554 0.295 0.000 2.946 435 T HA 0.123 4.474 4.350 0.003 0.000 0.311 435 T C -1.065 173.801 174.700 0.277 0.000 1.063 435 T CA 0.450 62.682 62.100 0.219 0.000 1.139 435 T CB 0.009 68.989 68.868 0.187 0.000 0.994 435 T HN 0.379 8.619 8.240 -0.000 0.000 0.547 436 F N 2.702 122.695 119.950 0.072 0.000 2.411 436 F HA 0.545 5.074 4.527 0.003 0.000 0.352 436 F C 0.034 175.879 175.800 0.076 0.000 1.123 436 F CA -0.502 57.538 58.000 0.067 0.000 1.044 436 F CB 1.215 40.215 39.000 0.000 0.000 1.135 436 F HN 0.418 8.718 8.300 -0.000 0.000 0.461 437 S N 7.583 122.980 115.700 -0.506 0.000 2.673 437 S HA 0.707 5.179 4.470 0.003 0.000 0.256 437 S C -1.934 172.340 174.600 -0.544 0.000 1.141 437 S CA -0.455 57.538 58.200 -0.344 0.000 1.109 437 S CB 0.426 63.648 63.200 0.037 0.000 1.101 437 S HN 0.766 9.076 8.310 -0.000 0.000 0.471 438 L N 3.396 124.092 121.223 -0.879 0.000 2.582 438 L HA 0.631 4.973 4.340 0.003 0.000 0.257 438 L C -0.613 175.950 176.870 -0.512 0.000 0.974 438 L CA -0.017 54.470 54.840 -0.589 0.000 0.851 438 L CB 2.293 43.902 42.059 -0.749 0.000 1.424 438 L HN 0.501 8.731 8.230 -0.000 0.000 0.412 439 T N 4.231 118.694 114.554 -0.150 0.000 2.771 439 T HA 0.666 5.018 4.350 0.003 0.000 0.291 439 T C -0.340 174.339 174.700 -0.035 0.000 0.954 439 T CA -0.109 61.981 62.100 -0.016 0.000 1.045 439 T CB 0.231 69.155 68.868 0.092 0.000 0.917 439 T HN 0.369 8.609 8.240 -0.000 0.000 0.484 440 L N 2.507 123.747 121.223 0.028 0.000 2.319 440 L HA 0.570 4.912 4.340 0.003 0.000 0.267 440 L C -0.029 176.802 176.870 -0.065 0.000 1.011 440 L CA -1.303 53.545 54.840 0.013 0.000 0.818 440 L CB 1.789 43.923 42.059 0.126 0.000 1.316 440 L HN 0.382 8.612 8.230 -0.000 0.000 0.432 441 Q N 0.379 120.137 119.800 -0.070 0.000 2.349 441 Q HA 0.176 4.517 4.340 0.003 0.000 0.254 441 Q C 0.550 176.384 176.000 -0.276 0.000 0.980 441 Q CA 0.015 55.755 55.803 -0.106 0.000 0.924 441 Q CB 1.317 30.048 28.738 -0.012 0.000 1.209 441 Q HN 0.707 8.977 8.270 -0.000 0.000 0.445 442 T N 0.253 114.547 114.554 -0.434 0.000 3.040 442 T HA 0.254 4.606 4.350 0.003 0.000 0.252 442 T C 1.276 175.815 174.700 -0.269 0.000 1.064 442 T CA 0.595 62.238 62.100 -0.762 0.000 1.110 442 T CB -0.035 68.332 68.868 -0.836 0.000 0.921 442 T HN 0.964 9.204 8.240 -0.000 0.000 0.480 443 G N 1.184 109.909 108.800 -0.124 0.000 2.179 443 G HA2 -0.190 3.771 3.960 0.003 0.000 0.260 443 G HA3 -0.190 3.771 3.960 0.003 0.000 0.260 443 G C -0.121 174.767 174.900 -0.019 0.000 0.977 443 G CA 0.316 45.404 45.100 -0.019 0.000 0.641 443 G HN 0.653 8.943 8.290 -0.000 0.000 0.533 444 L N 2.043 123.219 121.223 -0.078 0.000 2.322 444 L HA 0.535 4.877 4.340 0.003 0.000 0.279 444 L C -1.530 175.349 176.870 0.015 0.000 1.036 444 L CA -2.416 52.393 54.840 -0.051 0.000 0.807 444 L CB 1.455 43.377 42.059 -0.229 0.000 1.226 444 L HN -0.089 8.141 8.230 -0.000 0.000 0.433 445 P HA 0.086 4.506 4.420 -0.000 0.000 0.269 445 P C -0.659 176.751 177.300 0.183 0.000 1.215 445 P CA -0.428 62.742 63.100 0.117 0.000 0.780 445 P CB 0.623 32.388 31.700 0.108 0.000 0.898 446 A N 1.501 124.392 122.820 0.118 0.000 2.466 446 A HA 0.525 4.847 4.320 0.003 0.000 0.238 446 A C 0.835 178.500 177.584 0.135 0.000 1.074 446 A CA 1.038 53.150 52.037 0.125 0.000 0.774 446 A CB -0.961 18.077 19.000 0.063 0.000 1.015 446 A HN 0.909 9.059 8.150 -0.000 0.000 0.498 447 G N -0.520 108.370 108.800 0.150 0.000 2.369 447 G HA2 0.415 4.377 3.960 0.003 0.000 0.307 447 G HA3 0.415 4.377 3.960 0.003 0.000 0.307 447 G C -0.690 174.252 174.900 0.070 0.000 1.327 447 G CA -0.257 44.857 45.100 0.024 0.000 0.963 447 G HN 1.035 9.325 8.290 -0.000 0.000 0.590 448 T N 1.085 115.585 114.554 -0.090 0.000 2.744 448 T HA 0.612 4.964 4.350 0.003 0.000 0.291 448 T C -1.086 173.459 174.700 -0.258 0.000 0.957 448 T CA 0.227 62.242 62.100 -0.141 0.000 1.002 448 T CB 0.598 69.393 68.868 -0.122 0.000 0.919 448 T HN 0.388 8.628 8.240 -0.000 0.000 0.468 449 Y N 0.806 120.968 120.300 -0.232 0.000 2.393 449 Y HA 0.403 4.955 4.550 0.003 0.000 0.341 449 Y C 0.489 176.269 175.900 -0.199 0.000 0.988 449 Y CA -1.231 56.761 58.100 -0.179 0.000 1.078 449 Y CB 0.954 39.335 38.460 -0.131 0.000 1.203 449 Y HN 0.603 8.883 8.280 -0.000 0.000 0.453 450 c N 2.295 120.870 118.600 -0.042 0.000 2.527 450 c HA 0.172 4.744 4.570 0.003 0.000 0.396 450 c C 0.431 174.494 174.090 -0.045 0.000 1.289 450 c CA -0.763 55.525 56.329 -0.069 0.000 2.047 450 c CB -0.432 42.032 42.510 -0.077 0.000 2.568 450 c HN 0.787 9.017 8.230 -0.000 0.000 0.573 451 D N 1.383 121.754 120.400 -0.049 0.000 2.383 451 D HA 0.189 4.831 4.640 0.003 0.000 0.252 451 D C 0.883 177.148 176.300 -0.057 0.000 1.166 451 D CA -0.314 53.660 54.000 -0.044 0.000 0.879 451 D CB 0.989 41.758 40.800 -0.052 0.000 1.164 451 D HN 0.442 8.812 8.370 -0.000 0.000 0.462 452 V N 2.396 122.283 119.914 -0.044 0.000 3.649 452 V HA 0.091 4.213 4.120 0.003 0.000 0.275 452 V C 1.359 177.420 176.094 -0.055 0.000 1.281 452 V CA 0.074 62.367 62.300 -0.012 0.000 1.143 452 V CB -0.595 31.279 31.823 0.084 0.000 0.892 452 V HN 0.516 8.706 8.190 -0.000 0.000 0.441 453 I N 2.143 122.615 120.570 -0.163 0.000 2.385 453 I HA -0.014 4.158 4.170 0.003 0.000 0.244 453 I C 2.757 178.759 176.117 -0.191 0.000 1.089 453 I CA 1.966 63.091 61.300 -0.292 0.000 1.410 453 I CB -1.133 36.449 38.000 -0.697 0.000 1.117 453 I HN 0.574 8.784 8.210 -0.000 0.000 0.429 454 S N -0.121 115.481 115.700 -0.162 0.000 2.489 454 S HA 0.230 4.702 4.470 0.003 0.000 0.228 454 S C 1.041 175.607 174.600 -0.056 0.000 0.995 454 S CA 0.471 58.611 58.200 -0.100 0.000 0.934 454 S CB -0.126 63.023 63.200 -0.085 0.000 0.771 454 S HN 0.462 8.772 8.310 -0.000 0.000 0.522 455 G N -0.273 108.498 108.800 -0.048 0.000 2.753 455 G HA2 0.547 4.509 3.960 0.003 0.000 0.303 455 G HA3 0.547 4.509 3.960 0.003 0.000 0.303 455 G C -2.214 172.681 174.900 -0.008 0.000 1.242 455 G CA -0.589 44.498 45.100 -0.022 0.000 0.810 455 G HN 0.188 8.478 8.290 -0.000 0.000 0.515 456 D N -0.398 120.001 120.400 -0.003 0.000 2.531 456 D HA 0.404 5.046 4.640 0.003 0.000 0.244 456 D C -0.918 175.375 176.300 -0.012 0.000 1.090 456 D CA -0.497 53.507 54.000 0.006 0.000 0.989 456 D CB 2.735 43.548 40.800 0.022 0.000 1.433 456 D HN 0.369 8.739 8.370 -0.000 0.000 0.492 457 K N 1.417 121.810 120.400 -0.011 0.000 2.213 457 K HA 0.419 4.741 4.320 0.003 0.000 0.270 457 K C -1.044 175.548 176.600 -0.012 0.000 1.002 457 K CA -0.471 55.800 56.287 -0.027 0.000 0.868 457 K CB 0.647 33.120 32.500 -0.044 0.000 1.093 457 K HN 0.290 8.540 8.250 -0.000 0.000 0.454 458 I N 6.146 126.707 120.570 -0.015 0.000 2.623 458 I HA 0.054 4.226 4.170 0.003 0.000 0.275 458 I C -0.643 175.465 176.117 -0.014 0.000 1.108 458 I CA -0.908 60.387 61.300 -0.008 0.000 1.120 458 I CB 0.473 38.473 38.000 -0.001 0.000 1.249 458 I HN 0.846 9.056 8.210 -0.000 0.000 0.500 459 N N 4.063 122.753 118.700 -0.016 0.000 2.696 459 N HA -0.276 4.466 4.740 0.003 0.000 0.306 459 N C 0.820 176.317 175.510 -0.023 0.000 1.240 459 N CA 1.348 54.386 53.050 -0.020 0.000 0.704 459 N CB -0.585 37.894 38.487 -0.013 0.000 1.027 459 N HN 1.039 9.419 8.380 -0.000 0.000 0.544 460 G N 0.777 109.558 108.800 -0.032 0.000 2.253 460 G HA2 -0.337 3.624 3.960 0.003 0.000 0.251 460 G HA3 -0.337 3.624 3.960 0.003 0.000 0.251 460 G C 0.064 174.943 174.900 -0.034 0.000 0.998 460 G CA 0.711 45.791 45.100 -0.033 0.000 0.621 460 G HN 1.001 9.291 8.290 -0.000 0.000 0.524 461 N N -1.653 117.028 118.700 -0.033 0.000 2.825 461 N HA 0.641 5.383 4.740 0.003 0.000 0.253 461 N C -0.830 174.658 175.510 -0.036 0.000 1.426 461 N CA 0.184 53.215 53.050 -0.032 0.000 0.851 461 N CB 1.305 39.781 38.487 -0.019 0.000 1.470 461 N HN 0.341 8.721 8.380 -0.000 0.000 0.517 462 c N 0.178 118.755 118.600 -0.038 0.000 2.376 462 c HA 0.541 5.113 4.570 0.003 0.000 0.335 462 c C 1.621 175.696 174.090 -0.025 0.000 1.229 462 c CA -0.512 55.793 56.329 -0.040 0.000 1.867 462 c CB 0.801 43.276 42.510 -0.058 0.000 2.319 462 c HN 0.857 9.087 8.230 -0.000 0.000 0.515 463 T N -1.356 113.187 114.554 -0.020 0.000 3.069 463 T HA 0.368 4.720 4.350 0.003 0.000 0.252 463 T C 0.727 175.418 174.700 -0.014 0.000 1.053 463 T CA 0.518 62.612 62.100 -0.011 0.000 0.964 463 T CB 0.139 69.004 68.868 -0.004 0.000 1.005 463 T HN 0.892 9.132 8.240 -0.000 0.000 0.532 464 G N 1.140 109.926 108.800 -0.023 0.000 3.264 464 G HA2 0.594 4.555 3.960 0.003 0.000 0.168 464 G HA3 0.594 4.555 3.960 0.003 0.000 0.168 464 G C -0.726 174.156 174.900 -0.031 0.000 1.145 464 G CA -0.964 44.120 45.100 -0.027 0.000 0.855 464 G HN 0.233 8.523 8.290 -0.000 0.000 0.629 465 I N 1.035 121.583 120.570 -0.037 0.000 2.754 465 I HA 0.179 4.350 4.170 0.003 0.000 0.285 465 I C 0.147 176.218 176.117 -0.078 0.000 1.166 465 I CA 0.413 61.690 61.300 -0.039 0.000 1.417 465 I CB 0.718 38.702 38.000 -0.028 0.000 1.382 465 I HN 0.296 8.506 8.210 -0.000 0.000 0.588 466 K N 6.070 126.397 120.400 -0.122 0.000 2.323 466 K HA 0.564 4.886 4.320 0.003 0.000 0.259 466 K C -0.924 175.404 176.600 -0.453 0.000 0.947 466 K CA -0.739 55.372 56.287 -0.294 0.000 0.819 466 K CB 2.322 34.596 32.500 -0.375 0.000 1.109 466 K HN 0.309 8.559 8.250 -0.000 0.000 0.429 467 I N 3.675 123.989 120.570 -0.427 0.000 2.378 467 I HA 0.242 4.414 4.170 0.003 0.000 0.291 467 I C -0.706 175.143 176.117 -0.446 0.000 0.992 467 I CA -0.844 60.227 61.300 -0.382 0.000 1.154 467 I CB 0.900 38.770 38.000 -0.217 0.000 1.315 467 I HN 0.516 8.726 8.210 -0.000 0.000 0.448 468 Y N 5.135 125.390 120.300 -0.075 0.000 2.385 468 Y HA 0.409 4.961 4.550 0.003 0.000 0.341 468 Y C 0.313 176.176 175.900 -0.062 0.000 0.965 468 Y CA -0.900 57.184 58.100 -0.027 0.000 1.180 468 Y CB 1.182 39.616 38.460 -0.043 0.000 1.139 468 Y HN 0.179 8.459 8.280 -0.000 0.000 0.502 469 V N 4.041 124.023 119.914 0.113 0.000 2.407 469 V HA 0.298 4.420 4.120 0.003 0.000 0.278 469 V C 0.195 176.327 176.094 0.063 0.000 1.037 469 V CA -0.797 61.518 62.300 0.026 0.000 0.900 469 V CB 1.118 32.930 31.823 -0.018 0.000 0.983 469 V HN 0.896 9.086 8.190 -0.000 0.000 0.459 470 S N 1.946 117.656 115.700 0.017 0.000 2.632 470 S HA 0.153 4.625 4.470 0.003 0.000 0.267 470 S C 0.958 175.567 174.600 0.015 0.000 1.276 470 S CA -0.032 58.179 58.200 0.018 0.000 0.998 470 S CB 0.876 64.075 63.200 -0.001 0.000 0.953 470 S HN 0.918 9.228 8.310 -0.000 0.000 0.547 471 D N -0.251 120.159 120.400 0.017 0.000 2.315 471 D HA -0.214 4.427 4.640 0.003 0.000 0.211 471 D C 0.778 177.082 176.300 0.007 0.000 0.977 471 D CA 1.377 55.387 54.000 0.016 0.000 0.894 471 D CB -0.542 40.265 40.800 0.012 0.000 0.910 471 D HN 0.774 9.144 8.370 -0.000 0.000 0.490 472 D N -1.568 118.831 120.400 -0.001 0.000 2.325 472 D HA 0.170 4.812 4.640 0.003 0.000 0.225 472 D C 1.653 177.943 176.300 -0.017 0.000 1.096 472 D CA 0.124 54.121 54.000 -0.005 0.000 0.844 472 D CB -0.057 40.740 40.800 -0.005 0.000 0.925 472 D HN 0.241 8.611 8.370 -0.000 0.000 0.513 473 G N 0.179 108.965 108.800 -0.023 0.000 2.168 473 G HA2 -0.349 3.613 3.960 0.003 0.000 0.257 473 G HA3 -0.349 3.613 3.960 0.003 0.000 0.257 473 G C 0.090 174.930 174.900 -0.100 0.000 0.997 473 G CA 0.317 45.384 45.100 -0.055 0.000 0.708 473 G HN 0.470 8.760 8.290 -0.000 0.000 0.520 474 K N 0.060 120.416 120.400 -0.073 0.000 2.110 474 K HA 0.774 5.096 4.320 0.003 0.000 0.263 474 K C 0.204 176.746 176.600 -0.097 0.000 0.975 474 K CA 0.150 56.388 56.287 -0.083 0.000 0.895 474 K CB 1.747 34.221 32.500 -0.043 0.000 1.060 474 K HN 0.682 8.932 8.250 -0.000 0.000 0.448 475 A N 1.610 124.355 122.820 -0.126 0.000 2.549 475 A HA 0.349 4.671 4.320 0.003 0.000 0.297 475 A C -1.884 175.539 177.584 -0.268 0.000 1.061 475 A CA -0.671 51.223 52.037 -0.239 0.000 0.690 475 A CB 1.032 19.777 19.000 -0.424 0.000 1.287 475 A HN 0.841 8.991 8.150 -0.000 0.000 0.402 476 H N 0.253 119.100 119.070 -0.371 0.000 2.489 476 H HA 0.703 5.260 4.556 0.003 0.000 0.322 476 H C -1.581 173.485 175.328 -0.437 0.000 1.091 476 H CA -0.087 55.808 56.048 -0.254 0.000 1.291 476 H CB 0.525 30.203 29.762 -0.141 0.000 1.436 476 H HN 0.428 8.708 8.280 -0.000 0.000 0.480 477 F N 2.276 121.939 119.950 -0.478 0.000 2.520 477 F HA 0.453 4.982 4.527 0.003 0.000 0.322 477 F C -0.197 175.502 175.800 -0.167 0.000 1.103 477 F CA -0.623 57.298 58.000 -0.131 0.000 0.926 477 F CB 2.204 41.262 39.000 0.098 0.000 1.154 477 F HN 0.398 8.698 8.300 -0.000 0.000 0.453 478 S N 4.010 119.848 115.700 0.230 0.000 2.779 478 S HA 0.692 5.164 4.470 0.003 0.000 0.293 478 S C -0.889 173.845 174.600 0.224 0.000 1.150 478 S CA -0.447 57.880 58.200 0.212 0.000 1.057 478 S CB 0.773 64.098 63.200 0.208 0.000 1.021 478 S HN 0.427 8.737 8.310 -0.000 0.000 0.485 479 I N 2.411 123.137 120.570 0.261 0.000 2.447 479 I HA 0.363 4.534 4.170 0.003 0.000 0.287 479 I C 0.183 176.390 176.117 0.150 0.000 1.023 479 I CA -0.517 60.889 61.300 0.178 0.000 1.083 479 I CB 2.038 40.120 38.000 0.137 0.000 1.245 479 I HN 0.527 8.737 8.210 -0.000 0.000 0.434 480 S N 4.684 120.447 115.700 0.105 0.000 2.565 480 S HA 0.105 4.576 4.470 0.003 0.000 0.276 480 S C 1.335 175.973 174.600 0.064 0.000 1.326 480 S CA -0.603 57.651 58.200 0.090 0.000 1.045 480 S CB 0.588 63.833 63.200 0.076 0.000 0.918 480 S HN 0.752 9.062 8.310 -0.000 0.000 0.505 481 N N 2.913 121.645 118.700 0.054 0.000 2.573 481 N HA -0.111 4.631 4.740 0.003 0.000 0.187 481 N C 1.147 176.675 175.510 0.031 0.000 1.107 481 N CA 1.049 54.109 53.050 0.016 0.000 0.918 481 N CB -0.420 38.064 38.487 -0.005 0.000 0.966 481 N HN 0.603 8.983 8.380 -0.000 0.000 0.448 482 S N -1.319 114.408 115.700 0.045 0.000 2.540 482 S HA 0.454 4.926 4.470 0.003 0.000 0.218 482 S C 0.861 175.484 174.600 0.038 0.000 0.977 482 S CA -0.371 57.853 58.200 0.041 0.000 0.918 482 S CB -0.023 63.204 63.200 0.045 0.000 0.806 482 S HN 0.475 8.785 8.310 -0.000 0.000 0.496 483 A N 1.753 124.598 122.820 0.041 0.000 2.507 483 A HA 0.252 4.574 4.320 0.003 0.000 0.235 483 A C 1.240 178.846 177.584 0.037 0.000 1.070 483 A CA -0.092 51.967 52.037 0.036 0.000 0.768 483 A CB 0.041 19.064 19.000 0.037 0.000 1.011 483 A HN 0.501 8.651 8.150 -0.000 0.000 0.502 484 E N 0.234 120.450 120.200 0.026 0.000 2.051 484 E HA -0.142 4.210 4.350 0.003 0.000 0.192 484 E C -0.447 176.188 176.600 0.059 0.000 0.991 484 E CA 1.266 57.683 56.400 0.028 0.000 0.799 484 E CB 0.077 29.780 29.700 0.005 0.000 0.748 484 E HN 0.671 9.031 8.360 -0.000 0.000 0.449 485 D N 0.488 120.917 120.400 0.048 0.000 2.446 485 D HA 0.124 4.766 4.640 0.003 0.000 0.251 485 D C -2.241 174.117 176.300 0.096 0.000 1.137 485 D CA -1.437 52.621 54.000 0.097 0.000 0.890 485 D CB 1.449 42.212 40.800 -0.062 0.000 1.071 485 D HN 0.064 8.434 8.370 -0.000 0.000 0.528 486 P HA 0.114 4.534 4.420 -0.000 0.000 0.246 486 P C -0.825 176.600 177.300 0.208 0.000 1.686 486 P CA -0.224 62.964 63.100 0.147 0.000 0.867 486 P CB -0.805 30.953 31.700 0.097 0.000 1.733 487 F N -1.433 118.425 119.950 -0.153 0.000 2.678 487 F HA 0.658 5.187 4.527 0.003 0.000 0.308 487 F C -1.678 173.942 175.800 -0.300 0.000 1.118 487 F CA -2.202 55.583 58.000 -0.358 0.000 0.959 487 F CB 0.731 39.396 39.000 -0.559 0.000 1.305 487 F HN -0.303 7.997 8.300 -0.000 0.000 0.443 488 I N 2.168 122.513 120.570 -0.375 0.000 2.608 488 I HA 0.815 4.987 4.170 0.003 0.000 0.295 488 I C -0.867 175.051 176.117 -0.332 0.000 1.049 488 I CA -1.189 59.928 61.300 -0.304 0.000 1.063 488 I CB 2.157 40.129 38.000 -0.048 0.000 1.248 488 I HN 1.028 9.238 8.210 -0.000 0.000 0.424 489 A N 7.288 129.978 122.820 -0.216 0.000 2.408 489 A HA 0.876 5.197 4.320 0.003 0.000 0.295 489 A C -0.920 176.730 177.584 0.109 0.000 1.040 489 A CA -0.451 51.523 52.037 -0.103 0.000 0.707 489 A CB 1.201 20.072 19.000 -0.214 0.000 1.235 489 A HN 0.704 8.854 8.150 -0.000 0.000 0.418 490 I N 0.108 120.815 120.570 0.228 0.000 2.785 490 I HA 0.963 5.135 4.170 0.003 0.000 0.302 490 I C -0.553 175.688 176.117 0.207 0.000 1.069 490 I CA -0.979 60.407 61.300 0.144 0.000 1.045 490 I CB 2.393 40.416 38.000 0.040 0.000 1.236 490 I HN 0.927 9.137 8.210 -0.000 0.000 0.429 491 H N 2.315 121.478 119.070 0.155 0.000 2.990 491 H HA 0.721 5.279 4.556 0.003 0.000 0.336 491 H C 0.354 175.770 175.328 0.148 0.000 1.306 491 H CA -0.404 55.641 56.048 -0.005 0.000 1.118 491 H CB 1.137 30.718 29.762 -0.302 0.000 1.856 491 H HN 0.670 8.950 8.280 -0.000 0.000 0.538 492 A N 0.257 123.234 122.820 0.262 0.000 1.958 492 A HA -0.216 4.106 4.320 0.003 0.000 0.221 492 A C 1.510 179.178 177.584 0.139 0.000 1.178 492 A CA 2.038 54.197 52.037 0.204 0.000 0.642 492 A CB -0.658 18.407 19.000 0.109 0.000 0.816 492 A HN 0.742 8.892 8.150 -0.000 0.000 0.453 493 E N -0.165 120.195 120.200 0.267 0.000 2.489 493 E HA -0.005 4.346 4.350 0.003 0.000 0.193 493 E C 1.572 178.169 176.600 -0.005 0.000 1.057 493 E CA 0.833 57.324 56.400 0.152 0.000 0.866 493 E CB -0.038 29.799 29.700 0.229 0.000 0.916 493 E HN 0.747 9.107 8.360 -0.000 0.000 0.500 494 S N -0.149 115.412 115.700 -0.233 0.000 2.540 494 S HA 0.118 4.590 4.470 0.003 0.000 0.218 494 S C 0.781 175.267 174.600 -0.190 0.000 0.977 494 S CA -0.372 57.660 58.200 -0.279 0.000 0.918 494 S CB 0.216 63.121 63.200 -0.492 0.000 0.806 494 S HN -0.051 8.259 8.310 -0.000 0.000 0.496 495 K N 1.719 121.965 120.400 -0.257 0.000 2.298 495 K HA 0.350 4.671 4.320 0.003 0.000 0.280 495 K C -0.131 176.266 176.600 -0.339 0.000 1.032 495 K CA -0.485 55.464 56.287 -0.564 0.000 0.958 495 K CB 0.487 32.516 32.500 -0.785 0.000 0.978 495 K HN 0.323 8.573 8.250 -0.000 0.000 0.472 496 L N 0.000 121.028 121.223 -0.325 0.000 2.949 496 L HA 0.000 4.342 4.340 0.003 0.000 0.249 496 L CA 0.000 54.726 54.840 -0.190 0.000 0.813 496 L CB 0.000 41.971 42.059 -0.146 0.000 0.961 496 L HN 0.000 8.230 8.230 -0.000 0.000 0.502