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 3nlj_1_A DATA FIRST_RESID 299 DATA SEQUENCE RFLKVKNWET DVVLTDTLHL KSTLETGCTE HICMGSIVLP XXXXXXXXXX DATA SEQUENCE XTKDQLFPLA KEFLDQYYSS IKRFGSKAHM DRLEEVNKEI ESTSTYQLKD DATA SEQUENCE TELIYGAKHA WRNASRCVGR IQWSKLQVFD ARDCTTAHGM FNYICNHVKY DATA SEQUENCE ATNKGNLRSA ITIFPQRTDG KHDFRVWNSQ LIRYAGYKQP DGSTLGDPAN DATA SEQUENCE VQFTEICIQQ GWKAPRGRFD VLPLLLQANG NDPELFQIPP ELVLEVPIRH DATA SEQUENCE PKFDWFKDLG LKWYGLPAVS NMLLEIGGLE FSACPFSGWY MGTEIGVRNY DATA SEQUENCE CDNSRYNILE EVAKKMDLDM RKTSSLWKDQ ALVEINIAVL YSFQSDKVTI DATA SEQUENCE VDHHSATESF IKHMENEYRC RGGCPADWVW IVPPMSGSIT PVFHQEMLNY DATA SEQUENCE RLTPSFEAQP DPWNTHVW 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 299 R HA 0.000 4.340 4.340 -0.000 0.000 0.208 299 R C 0.000 176.647 176.300 0.578 0.000 0.893 299 R CA 0.000 56.267 56.100 0.278 0.000 0.921 299 R CB 0.000 30.390 30.300 0.150 0.000 0.687 300 F N 2.715 122.729 119.950 0.107 0.000 2.361 300 F HA 0.494 4.713 4.527 -0.512 0.000 0.364 300 F C -0.066 175.783 175.800 0.081 0.000 1.117 300 F CA -0.862 57.211 58.000 0.122 0.000 1.071 300 F CB 1.136 40.172 39.000 0.059 0.000 1.188 300 F HN -0.080 8.220 8.300 -0.000 0.000 0.464 301 L N 3.852 125.191 121.223 0.194 0.000 2.322 301 L HA 0.498 4.531 4.340 -0.513 0.000 0.279 301 L C 0.035 176.941 176.870 0.060 0.000 1.036 301 L CA -0.825 54.043 54.840 0.046 0.000 0.807 301 L CB 1.624 43.592 42.059 -0.152 0.000 1.226 301 L HN 0.415 8.645 8.230 -0.000 0.000 0.433 302 K N 1.994 122.418 120.400 0.039 0.000 2.206 302 K HA 0.523 4.536 4.320 -0.513 0.000 0.264 302 K C -0.968 175.627 176.600 -0.007 0.000 0.967 302 K CA -0.644 55.652 56.287 0.014 0.000 0.844 302 K CB 2.133 34.634 32.500 0.001 0.000 1.099 302 K HN 0.426 8.676 8.250 -0.000 0.000 0.441 303 V N 0.336 120.217 119.914 -0.055 0.000 2.435 303 V HA 0.500 4.313 4.120 -0.513 0.000 0.290 303 V C -0.425 175.587 176.094 -0.137 0.000 1.030 303 V CA -0.880 61.375 62.300 -0.075 0.000 0.881 303 V CB 1.251 33.010 31.823 -0.106 0.000 0.983 303 V HN 0.684 8.874 8.190 -0.000 0.000 0.445 304 K N 3.702 124.027 120.400 -0.125 0.000 2.207 304 K HA 0.421 4.433 4.320 -0.513 0.000 0.255 304 K C -0.558 175.909 176.600 -0.222 0.000 0.941 304 K CA -0.675 55.447 56.287 -0.276 0.000 0.825 304 K CB 1.439 33.619 32.500 -0.534 0.000 1.119 304 K HN 0.883 9.133 8.250 -0.000 0.000 0.430 305 N N 3.771 122.344 118.700 -0.213 0.000 2.422 305 N HA 0.087 4.520 4.740 -0.513 0.000 0.266 305 N C -0.296 175.144 175.510 -0.116 0.000 1.007 305 N CA -0.294 52.728 53.050 -0.046 0.000 0.941 305 N CB 0.516 39.006 38.487 0.006 0.000 1.115 305 N HN 0.671 9.051 8.380 -0.000 0.000 0.492 306 W N 1.982 123.358 121.300 0.128 0.000 2.905 306 W HA 0.171 4.523 4.660 -0.513 0.000 0.251 306 W C 2.009 178.587 176.519 0.098 0.000 1.305 306 W CA -0.170 57.247 57.345 0.120 0.000 1.465 306 W CB 0.406 29.959 29.460 0.154 0.000 1.122 306 W HN 0.663 8.843 8.180 -0.000 0.000 0.659 307 E N -0.244 120.084 120.200 0.215 0.000 2.099 307 E HA -0.108 3.934 4.350 -0.513 0.000 0.191 307 E C 1.867 178.478 176.600 0.019 0.000 0.962 307 E CA 1.701 58.130 56.400 0.047 0.000 0.826 307 E CB 0.076 29.720 29.700 -0.093 0.000 0.788 307 E HN 0.186 8.546 8.360 -0.000 0.000 0.461 308 T N -2.192 112.368 114.554 0.010 0.000 3.040 308 T HA 0.099 4.142 4.350 -0.513 0.000 0.250 308 T C 0.339 175.008 174.700 -0.051 0.000 1.058 308 T CA 0.460 62.549 62.100 -0.018 0.000 0.988 308 T CB 0.267 69.125 68.868 -0.015 0.000 0.993 308 T HN 0.032 8.272 8.240 -0.000 0.000 0.519 309 D N 0.050 120.396 120.400 -0.090 0.000 3.006 309 D HA -0.131 4.201 4.640 -0.513 0.000 0.208 309 D C -0.045 176.162 176.300 -0.157 0.000 1.116 309 D CA 0.493 54.399 54.000 -0.156 0.000 0.998 309 D CB -1.944 38.790 40.800 -0.110 0.000 1.124 309 D HN 0.437 8.807 8.370 -0.000 0.000 0.413 310 V N 0.834 120.674 119.914 -0.123 0.000 2.557 310 V HA 0.078 3.890 4.120 -0.513 0.000 0.301 310 V C 0.840 176.836 176.094 -0.164 0.000 1.026 310 V CA 0.232 62.460 62.300 -0.120 0.000 1.137 310 V CB 1.359 33.126 31.823 -0.093 0.000 0.917 310 V HN -0.012 8.178 8.190 -0.000 0.000 0.484 311 V N 7.474 127.297 119.914 -0.152 0.000 2.378 311 V HA 0.463 4.275 4.120 -0.513 0.000 0.288 311 V C -0.117 175.884 176.094 -0.155 0.000 1.016 311 V CA -0.481 61.721 62.300 -0.163 0.000 0.840 311 V CB 1.419 33.158 31.823 -0.140 0.000 0.994 311 V HN 0.619 8.809 8.190 -0.000 0.000 0.431 312 L N 3.578 124.666 121.223 -0.226 0.000 2.344 312 L HA 0.701 4.734 4.340 -0.513 0.000 0.272 312 L C 0.261 177.050 176.870 -0.135 0.000 1.035 312 L CA -0.360 54.321 54.840 -0.264 0.000 0.807 312 L CB 1.938 43.587 42.059 -0.682 0.000 1.237 312 L HN 0.498 8.728 8.230 -0.000 0.000 0.442 313 T N 0.141 114.711 114.554 0.027 0.000 2.770 313 T HA 0.201 4.243 4.350 -0.513 0.000 0.283 313 T C -0.761 174.078 174.700 0.231 0.000 0.988 313 T CA -0.478 61.682 62.100 0.101 0.000 0.957 313 T CB 1.189 70.097 68.868 0.067 0.000 0.930 313 T HN 0.450 8.690 8.240 -0.000 0.000 0.443 314 D N 2.065 122.609 120.400 0.240 0.000 2.225 314 D HA 0.267 4.600 4.640 -0.513 0.000 0.248 314 D C 0.762 177.061 176.300 -0.001 0.000 1.096 314 D CA -0.228 53.887 54.000 0.192 0.000 0.863 314 D CB 1.602 42.556 40.800 0.256 0.000 1.156 314 D HN 0.651 9.021 8.370 -0.000 0.000 0.450 315 T N 0.730 115.189 114.554 -0.158 0.000 2.969 315 T HA -0.023 4.019 4.350 -0.513 0.000 0.258 315 T C 1.761 176.269 174.700 -0.321 0.000 0.962 315 T CA -0.273 61.605 62.100 -0.370 0.000 0.903 315 T CB 0.019 68.514 68.868 -0.623 0.000 1.177 315 T HN 0.230 8.470 8.240 -0.000 0.000 0.511 316 L N 3.090 124.187 121.223 -0.211 0.000 2.265 316 L HA -0.051 3.982 4.340 -0.513 0.000 0.215 316 L C 2.525 179.214 176.870 -0.303 0.000 1.117 316 L CA 1.783 56.511 54.840 -0.186 0.000 0.782 316 L CB -0.770 41.245 42.059 -0.074 0.000 0.914 316 L HN 0.590 8.820 8.230 -0.000 0.000 0.441 317 H N -1.434 117.272 119.070 -0.608 0.000 2.491 317 H HA -0.090 4.159 4.556 -0.513 0.000 0.290 317 H C 1.897 176.947 175.328 -0.463 0.000 1.050 317 H CA 1.363 56.797 56.048 -1.022 0.000 1.309 317 H CB -0.616 28.439 29.762 -1.178 0.000 1.392 317 H HN 0.433 8.713 8.280 -0.000 0.000 0.554 318 L N 0.739 121.448 121.223 -0.857 0.000 2.275 318 L HA -0.065 3.968 4.340 -0.513 0.000 0.215 318 L C 1.828 178.542 176.870 -0.259 0.000 1.119 318 L CA 1.049 55.582 54.840 -0.512 0.000 0.790 318 L CB -0.222 41.574 42.059 -0.439 0.000 0.919 318 L HN 0.151 8.381 8.230 -0.000 0.000 0.443 319 K N 0.061 120.323 120.400 -0.229 0.000 2.504 319 K HA 0.068 4.081 4.320 -0.513 0.000 0.199 319 K C 0.759 177.326 176.600 -0.054 0.000 1.028 319 K CA -0.097 56.121 56.287 -0.115 0.000 1.164 319 K CB 0.110 32.553 32.500 -0.094 0.000 0.877 319 K HN 0.138 8.388 8.250 -0.000 0.000 0.508 320 S N -0.008 115.650 115.700 -0.070 0.000 2.545 320 S HA 0.105 4.267 4.470 -0.513 0.000 0.275 320 S C 0.777 175.392 174.600 0.026 0.000 1.299 320 S CA -0.317 57.901 58.200 0.030 0.000 1.048 320 S CB 1.600 64.835 63.200 0.058 0.000 0.938 320 S HN 0.114 8.424 8.310 -0.000 0.000 0.496 321 T N 4.023 118.607 114.554 0.049 0.000 3.085 321 T HA 0.337 4.380 4.350 -0.513 0.000 0.241 321 T C 0.604 175.326 174.700 0.037 0.000 0.988 321 T CA 0.019 62.139 62.100 0.034 0.000 1.117 321 T CB -0.337 68.549 68.868 0.030 0.000 0.978 321 T HN 0.620 8.860 8.240 -0.000 0.000 0.454 322 L N 1.828 123.078 121.223 0.045 0.000 2.476 322 L HA 0.428 4.460 4.340 -0.513 0.000 0.255 322 L C 0.220 177.117 176.870 0.044 0.000 1.218 322 L CA -0.263 54.600 54.840 0.038 0.000 0.819 322 L CB 0.279 42.356 42.059 0.030 0.000 1.119 322 L HN 0.165 8.395 8.230 -0.000 0.000 0.485 323 E N -1.021 119.200 120.200 0.035 0.000 2.179 323 E HA 0.168 4.211 4.350 -0.513 0.000 0.275 323 E C 0.352 176.974 176.600 0.037 0.000 0.945 323 E CA -0.137 56.285 56.400 0.037 0.000 0.792 323 E CB 1.709 31.427 29.700 0.030 0.000 1.125 323 E HN 0.705 9.065 8.360 -0.000 0.000 0.397 324 T N -0.326 114.254 114.554 0.044 0.000 2.937 324 T HA 0.160 4.202 4.350 -0.513 0.000 0.260 324 T C 1.394 176.113 174.700 0.032 0.000 1.051 324 T CA 0.695 62.820 62.100 0.042 0.000 1.141 324 T CB 0.091 68.993 68.868 0.057 0.000 0.879 324 T HN 0.726 8.966 8.240 -0.000 0.000 0.459 325 G N 0.131 108.950 108.800 0.033 0.000 2.428 325 G HA2 -0.166 3.486 3.960 -0.513 0.000 0.199 325 G HA3 -0.166 3.486 3.960 -0.513 0.000 0.199 325 G C 0.293 175.214 174.900 0.036 0.000 1.005 325 G CA -0.285 44.834 45.100 0.032 0.000 0.671 325 G HN 0.742 9.032 8.290 -0.000 0.000 0.485 326 C N 2.047 121.369 119.300 0.036 0.000 2.520 326 C HA 0.848 5.000 4.460 -0.513 0.000 0.376 326 C C 1.162 176.170 174.990 0.031 0.000 1.268 326 C CA 0.674 59.713 59.018 0.034 0.000 2.414 326 C CB 0.826 28.585 27.740 0.033 0.000 2.521 326 C HN 0.965 9.195 8.230 -0.000 0.000 0.618 327 T N -1.787 112.784 114.554 0.028 0.000 2.693 327 T HA 0.365 4.408 4.350 -0.513 0.000 0.278 327 T C 0.564 175.247 174.700 -0.028 0.000 0.994 327 T CA -0.573 61.536 62.100 0.014 0.000 1.033 327 T CB 0.817 69.713 68.868 0.048 0.000 1.342 327 T HN 0.661 8.901 8.240 -0.000 0.000 0.538 328 E N -0.120 120.017 120.200 -0.104 0.000 2.204 328 E HA -0.155 3.887 4.350 -0.513 0.000 0.195 328 E C 1.633 178.069 176.600 -0.274 0.000 0.990 328 E CA 1.283 57.546 56.400 -0.229 0.000 0.821 328 E CB -0.208 29.265 29.700 -0.378 0.000 0.750 328 E HN 0.559 8.919 8.360 -0.000 0.000 0.477 329 H N -0.790 118.286 119.070 0.010 0.000 2.553 329 H HA 0.332 4.580 4.556 -0.513 0.000 0.276 329 H C 0.416 175.748 175.328 0.007 0.000 0.979 329 H CA 0.275 56.328 56.048 0.008 0.000 1.268 329 H CB 0.969 30.736 29.762 0.008 0.000 1.450 329 H HN 0.080 8.360 8.280 -0.000 0.000 0.527 330 I N 0.800 121.436 120.570 0.111 0.000 2.534 330 I HA 0.178 4.040 4.170 -0.513 0.000 0.288 330 I C -0.982 175.161 176.117 0.044 0.000 1.077 330 I CA -0.669 60.673 61.300 0.072 0.000 1.051 330 I CB 1.813 39.856 38.000 0.072 0.000 1.234 330 I HN 0.042 8.252 8.210 -0.000 0.000 0.425 331 C N 7.876 127.196 119.300 0.032 0.000 2.285 331 C HA 0.508 4.660 4.460 -0.513 0.000 0.335 331 C C 0.867 175.877 174.990 0.032 0.000 1.267 331 C CA -0.478 58.556 59.018 0.026 0.000 1.762 331 C CB 0.226 27.973 27.740 0.012 0.000 2.365 331 C HN 0.863 9.093 8.230 -0.000 0.000 0.527 332 M N 4.896 124.519 119.600 0.039 0.000 2.576 332 M HA 0.189 4.362 4.480 -0.513 0.000 0.322 332 M C 1.895 178.231 176.300 0.059 0.000 1.184 332 M CA 0.110 55.438 55.300 0.047 0.000 0.967 332 M CB 0.035 32.662 32.600 0.045 0.000 1.372 332 M HN 1.007 9.297 8.290 -0.000 0.000 0.509 333 G N 1.499 110.334 108.800 0.058 0.000 2.550 333 G HA2 -0.273 3.379 3.960 -0.513 0.000 0.222 333 G HA3 -0.273 3.379 3.960 -0.513 0.000 0.222 333 G C 1.489 176.462 174.900 0.122 0.000 1.113 333 G CA 1.726 46.873 45.100 0.079 0.000 0.748 333 G HN 0.587 8.877 8.290 -0.000 0.000 0.585 334 S N -0.341 115.424 115.700 0.109 0.000 2.575 334 S HA 0.346 4.509 4.470 -0.513 0.000 0.215 334 S C 0.720 175.408 174.600 0.146 0.000 0.966 334 S CA -0.599 57.685 58.200 0.140 0.000 0.911 334 S CB 0.045 63.308 63.200 0.105 0.000 0.780 334 S HN 0.082 8.392 8.310 -0.000 0.000 0.514 335 I N 2.489 123.134 120.570 0.124 0.000 2.441 335 I HA 0.182 4.044 4.170 -0.513 0.000 0.287 335 I C 1.589 177.798 176.117 0.152 0.000 1.049 335 I CA -0.281 61.088 61.300 0.116 0.000 1.381 335 I CB 0.962 39.009 38.000 0.078 0.000 1.409 335 I HN 0.005 8.215 8.210 -0.000 0.000 0.523 336 V N 6.994 127.014 119.914 0.176 0.000 2.427 336 V HA -0.136 3.676 4.120 -0.513 0.000 0.248 336 V C 1.131 177.301 176.094 0.127 0.000 1.051 336 V CA 1.461 63.902 62.300 0.234 0.000 1.048 336 V CB -0.341 31.630 31.823 0.247 0.000 0.666 336 V HN 0.547 8.737 8.190 -0.000 0.000 0.456 337 L N 1.222 122.495 121.223 0.084 0.000 2.495 337 L HA 0.393 4.426 4.340 -0.513 0.000 0.248 337 L C -2.120 174.771 176.870 0.034 0.000 1.229 337 L CA -1.270 53.596 54.840 0.043 0.000 0.942 337 L CB 0.798 42.880 42.059 0.039 0.000 1.242 337 L HN 0.244 8.474 8.230 -0.000 0.000 0.484 351 K N 0.346 120.768 120.400 0.037 0.000 2.057 351 K HA -0.057 3.955 4.320 -0.513 0.000 0.206 351 K C 1.085 177.723 176.600 0.065 0.000 1.050 351 K CA 1.869 58.181 56.287 0.042 0.000 0.935 351 K CB -0.226 32.282 32.500 0.015 0.000 0.715 351 K HN 0.464 8.714 8.250 -0.000 0.000 0.439 352 D N 0.863 121.296 120.400 0.056 0.000 2.183 352 D HA -0.104 4.229 4.640 -0.513 0.000 0.203 352 D C 1.900 178.250 176.300 0.084 0.000 0.969 352 D CA 0.920 54.963 54.000 0.072 0.000 0.842 352 D CB 0.002 40.831 40.800 0.048 0.000 0.957 352 D HN 0.208 8.578 8.370 -0.000 0.000 0.484 353 Q N -0.327 119.513 119.800 0.066 0.000 2.119 353 Q HA -0.062 3.970 4.340 -0.513 0.000 0.201 353 Q C 1.911 177.957 176.000 0.077 0.000 0.972 353 Q CA 0.591 56.430 55.803 0.059 0.000 0.847 353 Q CB -0.020 28.743 28.738 0.043 0.000 0.903 353 Q HN 0.243 8.513 8.270 -0.000 0.000 0.433 354 L N -0.256 121.030 121.223 0.105 0.000 2.131 354 L HA -0.042 3.990 4.340 -0.513 0.000 0.206 354 L C 1.928 178.898 176.870 0.167 0.000 1.087 354 L CA 1.298 56.221 54.840 0.137 0.000 0.767 354 L CB -0.433 41.723 42.059 0.160 0.000 0.917 354 L HN 0.069 8.299 8.230 -0.000 0.000 0.441 355 F N 1.912 121.862 119.950 0.000 0.000 2.146 355 F HA 0.008 4.227 4.527 -0.513 0.000 0.298 355 F C -0.601 175.192 175.800 -0.013 0.000 1.096 355 F CA 0.831 58.810 58.000 -0.035 0.000 1.275 355 F CB -1.700 37.273 39.000 -0.046 0.000 1.008 355 F HN 0.162 8.462 8.300 -0.000 0.000 0.480 356 P HA -0.187 4.233 4.420 -0.000 0.000 0.216 356 P C 2.258 179.483 177.300 -0.124 0.000 1.150 356 P CA 1.667 64.648 63.100 -0.198 0.000 0.837 356 P CB -0.184 31.479 31.700 -0.062 0.000 0.786 357 L N -0.477 120.730 121.223 -0.026 0.000 1.994 357 L HA -0.161 3.871 4.340 -0.513 0.000 0.208 357 L C 2.799 179.717 176.870 0.081 0.000 1.071 357 L CA 1.708 56.572 54.840 0.040 0.000 0.745 357 L CB -1.373 40.727 42.059 0.067 0.000 0.892 357 L HN -0.055 8.175 8.230 -0.000 0.000 0.431 358 A N 0.261 123.119 122.820 0.062 0.000 1.873 358 A HA -0.320 3.693 4.320 -0.513 0.000 0.218 358 A C 2.381 179.974 177.584 0.013 0.000 1.193 358 A CA 2.429 54.507 52.037 0.067 0.000 0.629 358 A CB -0.600 18.294 19.000 -0.178 0.000 0.826 358 A HN 0.360 8.510 8.150 -0.000 0.000 0.447 359 K N -0.451 119.801 120.400 -0.247 0.000 2.002 359 K HA -0.225 3.788 4.320 -0.513 0.000 0.209 359 K C 2.193 178.763 176.600 -0.050 0.000 1.048 359 K CA 1.661 57.791 56.287 -0.262 0.000 0.930 359 K CB -0.273 31.898 32.500 -0.548 0.000 0.714 359 K HN 0.589 8.839 8.250 -0.000 0.000 0.438 360 E N -0.021 120.165 120.200 -0.025 0.000 2.108 360 E HA -0.267 3.776 4.350 -0.513 0.000 0.203 360 E C 1.900 178.576 176.600 0.125 0.000 1.022 360 E CA 1.773 58.205 56.400 0.052 0.000 0.823 360 E CB -0.276 29.456 29.700 0.053 0.000 0.744 360 E HN 0.413 8.773 8.360 -0.000 0.000 0.456 361 F N 1.091 121.067 119.950 0.043 0.000 2.128 361 F HA -0.063 4.157 4.527 -0.511 0.000 0.295 361 F C 2.139 178.000 175.800 0.101 0.000 1.100 361 F CA 1.198 59.249 58.000 0.084 0.000 1.260 361 F CB -0.335 38.731 39.000 0.111 0.000 1.009 361 F HN -0.026 8.274 8.300 -0.000 0.000 0.476 362 L N 0.006 121.194 121.223 -0.058 0.000 2.201 362 L HA -0.156 3.876 4.340 -0.513 0.000 0.212 362 L C 1.941 178.817 176.870 0.011 0.000 1.105 362 L CA 0.966 55.774 54.840 -0.054 0.000 0.775 362 L CB -0.782 41.392 42.059 0.192 0.000 0.913 362 L HN 0.091 8.321 8.230 -0.000 0.000 0.440 363 D N 0.074 120.503 120.400 0.048 0.000 2.097 363 D HA -0.206 4.126 4.640 -0.513 0.000 0.197 363 D C 2.309 178.629 176.300 0.033 0.000 0.984 363 D CA 1.386 55.459 54.000 0.120 0.000 0.826 363 D CB -0.121 40.825 40.800 0.242 0.000 0.973 363 D HN 0.495 8.865 8.370 -0.000 0.000 0.460 364 Q N -0.588 119.168 119.800 -0.073 0.000 2.119 364 Q HA -0.205 3.828 4.340 -0.513 0.000 0.201 364 Q C 2.169 177.975 176.000 -0.324 0.000 0.972 364 Q CA 0.954 56.682 55.803 -0.125 0.000 0.847 364 Q CB -0.739 27.968 28.738 -0.051 0.000 0.903 364 Q HN 0.379 8.649 8.270 -0.000 0.000 0.433 365 Y N 1.074 120.914 120.300 -0.766 0.000 2.070 365 Y HA -0.291 3.952 4.550 -0.512 0.000 0.280 365 Y C 1.682 177.133 175.900 -0.748 0.000 1.148 365 Y CA 1.666 59.070 58.100 -1.159 0.000 1.125 365 Y CB -0.671 36.972 38.460 -1.362 0.000 0.975 365 Y HN 0.071 8.351 8.280 -0.000 0.000 0.492 366 Y N -0.536 119.305 120.300 -0.765 0.000 2.421 366 Y HA -0.172 4.071 4.550 -0.512 0.000 0.292 366 Y C 3.022 178.658 175.900 -0.440 0.000 1.136 366 Y CA 1.556 59.211 58.100 -0.742 0.000 1.255 366 Y CB -0.517 37.408 38.460 -0.891 0.000 0.991 366 Y HN 0.268 8.548 8.280 -0.000 0.000 0.552 367 S N -0.665 114.948 115.700 -0.146 0.000 2.387 367 S HA -0.173 3.989 4.470 -0.513 0.000 0.226 367 S C 2.341 176.853 174.600 -0.146 0.000 1.026 367 S CA 1.284 59.455 58.200 -0.048 0.000 0.972 367 S CB -0.571 62.603 63.200 -0.044 0.000 0.814 367 S HN 0.561 8.871 8.310 -0.000 0.000 0.477 368 S N 2.029 117.581 115.700 -0.245 0.000 2.402 368 S HA -0.052 4.110 4.470 -0.513 0.000 0.229 368 S C 1.664 176.153 174.600 -0.184 0.000 1.021 368 S CA 1.001 59.112 58.200 -0.148 0.000 0.974 368 S CB -0.968 62.214 63.200 -0.030 0.000 0.800 368 S HN 0.818 9.128 8.310 -0.000 0.000 0.484 369 I N -2.073 118.275 120.570 -0.370 0.000 3.806 369 I HA 0.422 4.284 4.170 -0.513 0.000 0.321 369 I C 0.151 176.164 176.117 -0.172 0.000 1.315 369 I CA -0.523 60.597 61.300 -0.299 0.000 1.148 369 I CB -0.571 37.136 38.000 -0.487 0.000 1.028 369 I HN 0.012 8.222 8.210 -0.000 0.000 0.415 370 K N 1.329 121.657 120.400 -0.119 0.000 3.071 370 K HA -0.218 3.794 4.320 -0.513 0.000 0.265 370 K C 0.459 177.053 176.600 -0.010 0.000 1.060 370 K CA 0.709 56.968 56.287 -0.046 0.000 0.767 370 K CB -1.340 31.140 32.500 -0.033 0.000 1.241 370 K HN 0.549 8.799 8.250 -0.000 0.000 0.486 371 R N 0.213 120.712 120.500 -0.001 0.000 2.659 371 R HA 0.192 4.224 4.340 -0.513 0.000 0.418 371 R C -0.486 175.864 176.300 0.084 0.000 1.076 371 R CA -0.450 55.684 56.100 0.056 0.000 1.093 371 R CB 0.340 30.695 30.300 0.092 0.000 1.400 371 R HN 0.184 8.454 8.270 -0.000 0.000 0.583 372 F N 0.286 120.206 119.950 -0.049 0.000 2.541 372 F HA 0.264 4.484 4.527 -0.513 0.000 0.378 372 F C 1.399 177.253 175.800 0.090 0.000 1.068 372 F CA 1.768 59.749 58.000 -0.032 0.000 1.199 372 F CB 0.763 39.728 39.000 -0.059 0.000 1.091 372 F HN 0.410 8.710 8.300 -0.000 0.000 0.555 373 G N 3.004 111.677 108.800 -0.211 0.000 2.195 373 G HA2 -0.300 3.353 3.960 -0.513 0.000 0.246 373 G HA3 -0.300 3.353 3.960 -0.513 0.000 0.246 373 G C 0.373 175.209 174.900 -0.107 0.000 0.984 373 G CA 0.200 45.182 45.100 -0.195 0.000 0.633 373 G HN 1.122 9.412 8.290 -0.000 0.000 0.525 374 S N -0.251 115.420 115.700 -0.048 0.000 2.587 374 S HA 0.422 4.584 4.470 -0.513 0.000 0.260 374 S C 1.315 175.852 174.600 -0.105 0.000 1.353 374 S CA 0.759 58.931 58.200 -0.047 0.000 0.995 374 S CB 1.516 64.714 63.200 -0.003 0.000 0.912 374 S HN 0.446 8.756 8.310 -0.000 0.000 0.568 375 K N 0.617 120.970 120.400 -0.079 0.000 2.057 375 K HA -0.071 3.941 4.320 -0.513 0.000 0.206 375 K C 2.430 178.965 176.600 -0.110 0.000 1.050 375 K CA 1.118 57.348 56.287 -0.095 0.000 0.935 375 K CB -0.883 31.582 32.500 -0.058 0.000 0.715 375 K HN 0.754 9.004 8.250 -0.000 0.000 0.439 376 A N 0.844 123.626 122.820 -0.064 0.000 1.927 376 A HA -0.286 3.726 4.320 -0.513 0.000 0.220 376 A C 2.006 179.439 177.584 -0.252 0.000 1.185 376 A CA 2.025 54.040 52.037 -0.037 0.000 0.639 376 A CB -1.079 17.984 19.000 0.105 0.000 0.820 376 A HN 0.607 8.757 8.150 -0.000 0.000 0.451 377 H N -1.586 117.070 119.070 -0.691 0.000 2.267 377 H HA -0.154 4.094 4.556 -0.513 0.000 0.297 377 H C 2.117 177.055 175.328 -0.650 0.000 1.080 377 H CA 1.664 56.965 56.048 -1.246 0.000 1.278 377 H CB -0.108 29.079 29.762 -0.957 0.000 1.365 377 H HN 0.335 8.615 8.280 -0.000 0.000 0.489 378 M N 1.041 120.340 119.600 -0.502 0.000 2.108 378 M HA -0.166 4.006 4.480 -0.513 0.000 0.261 378 M C 1.723 177.873 176.300 -0.250 0.000 1.066 378 M CA 1.236 56.279 55.300 -0.429 0.000 1.107 378 M CB -0.895 31.521 32.600 -0.307 0.000 1.356 378 M HN 0.365 8.655 8.290 -0.000 0.000 0.406 379 D N -0.510 119.781 120.400 -0.181 0.000 2.117 379 D HA -0.169 4.164 4.640 -0.513 0.000 0.197 379 D C 2.104 178.368 176.300 -0.061 0.000 0.987 379 D CA 1.201 55.144 54.000 -0.096 0.000 0.829 379 D CB -0.295 40.471 40.800 -0.056 0.000 0.961 379 D HN 0.273 8.643 8.370 -0.000 0.000 0.460 380 R N 0.272 120.734 120.500 -0.062 0.000 2.075 380 R HA -0.061 3.972 4.340 -0.513 0.000 0.232 380 R C 2.090 178.407 176.300 0.028 0.000 1.126 380 R CA 0.720 56.840 56.100 0.034 0.000 0.963 380 R CB -0.705 29.683 30.300 0.145 0.000 0.858 380 R HN 0.048 8.318 8.270 -0.000 0.000 0.435 381 L N 0.969 122.171 121.223 -0.034 0.000 2.079 381 L HA -0.108 3.925 4.340 -0.513 0.000 0.210 381 L C 2.120 179.029 176.870 0.065 0.000 1.081 381 L CA 1.997 56.846 54.840 0.014 0.000 0.752 381 L CB -0.602 41.388 42.059 -0.116 0.000 0.896 381 L HN 0.312 8.542 8.230 -0.000 0.000 0.433 382 E N -0.575 119.616 120.200 -0.015 0.000 2.072 382 E HA -0.234 3.809 4.350 -0.513 0.000 0.190 382 E C 2.162 178.735 176.600 -0.044 0.000 0.982 382 E CA 1.265 57.642 56.400 -0.038 0.000 0.803 382 E CB -0.090 29.575 29.700 -0.057 0.000 0.755 382 E HN 0.530 8.890 8.360 -0.000 0.000 0.453 383 E N -0.510 119.681 120.200 -0.015 0.000 2.077 383 E HA -0.165 3.878 4.350 -0.513 0.000 0.193 383 E C 1.910 178.509 176.600 -0.001 0.000 0.989 383 E CA 1.444 57.845 56.400 0.001 0.000 0.800 383 E CB 0.090 29.809 29.700 0.033 0.000 0.746 383 E HN 0.187 8.547 8.360 -0.000 0.000 0.452 384 V N 1.315 121.231 119.914 0.003 0.000 2.379 384 V HA -0.218 3.594 4.120 -0.513 0.000 0.245 384 V C 2.231 178.253 176.094 -0.121 0.000 1.044 384 V CA 1.904 64.169 62.300 -0.057 0.000 1.036 384 V CB -0.789 30.947 31.823 -0.146 0.000 0.664 384 V HN 0.341 8.531 8.190 -0.000 0.000 0.453 385 N N 0.510 119.115 118.700 -0.159 0.000 2.104 385 N HA -0.199 4.234 4.740 -0.513 0.000 0.190 385 N C 1.777 177.089 175.510 -0.329 0.000 1.024 385 N CA 1.587 54.324 53.050 -0.522 0.000 0.853 385 N CB -0.168 37.910 38.487 -0.681 0.000 1.008 385 N HN 0.424 8.804 8.380 -0.000 0.000 0.424 386 K N -0.191 120.100 120.400 -0.183 0.000 2.288 386 K HA -0.106 3.906 4.320 -0.513 0.000 0.201 386 K C 1.709 178.265 176.600 -0.074 0.000 1.048 386 K CA 0.854 57.069 56.287 -0.120 0.000 0.956 386 K CB 0.018 32.471 32.500 -0.078 0.000 0.746 386 K HN 0.398 8.648 8.250 -0.000 0.000 0.461 387 E N 1.060 121.233 120.200 -0.045 0.000 2.122 387 E HA -0.065 3.978 4.350 -0.513 0.000 0.190 387 E C 1.862 178.473 176.600 0.018 0.000 0.977 387 E CA 0.390 56.798 56.400 0.014 0.000 0.820 387 E CB 0.155 29.904 29.700 0.081 0.000 0.770 387 E HN 0.179 8.539 8.360 -0.000 0.000 0.462 388 I N 1.368 121.930 120.570 -0.014 0.000 2.163 388 I HA -0.228 3.634 4.170 -0.513 0.000 0.240 388 I C 2.349 178.444 176.117 -0.037 0.000 1.081 388 I CA 0.992 62.291 61.300 -0.000 0.000 1.353 388 I CB -0.241 37.742 38.000 -0.029 0.000 1.054 388 I HN 0.114 8.324 8.210 -0.000 0.000 0.407 389 E N 0.069 120.212 120.200 -0.096 0.000 2.160 389 E HA -0.221 3.821 4.350 -0.513 0.000 0.195 389 E C 2.210 178.780 176.600 -0.049 0.000 0.991 389 E CA 1.447 57.794 56.400 -0.088 0.000 0.810 389 E CB -0.104 29.520 29.700 -0.126 0.000 0.742 389 E HN 0.325 8.685 8.360 -0.000 0.000 0.466 390 S N -0.900 114.779 115.700 -0.036 0.000 2.499 390 S HA -0.024 4.138 4.470 -0.513 0.000 0.225 390 S C 1.822 176.418 174.600 -0.007 0.000 1.050 390 S CA 1.053 59.240 58.200 -0.021 0.000 0.928 390 S CB 0.278 63.466 63.200 -0.020 0.000 0.803 390 S HN 0.405 8.715 8.310 -0.000 0.000 0.506 391 T N -1.701 112.855 114.554 0.003 0.000 2.971 391 T HA 0.239 4.281 4.350 -0.513 0.000 0.252 391 T C 1.017 175.724 174.700 0.012 0.000 1.022 391 T CA 1.213 63.319 62.100 0.011 0.000 0.980 391 T CB 0.122 69.005 68.868 0.024 0.000 1.044 391 T HN 0.911 9.151 8.240 -0.000 0.000 0.501 392 S N -1.048 114.662 115.700 0.017 0.000 2.596 392 S HA -0.170 3.992 4.470 -0.513 0.000 0.260 392 S C 0.243 174.871 174.600 0.048 0.000 1.282 392 S CA 1.277 59.490 58.200 0.022 0.000 1.357 392 S CB -2.539 60.664 63.200 0.006 0.000 1.674 392 S HN 1.183 9.493 8.310 -0.000 0.000 0.641 393 T N 0.012 114.609 114.554 0.072 0.000 2.711 393 T HA 0.672 4.715 4.350 -0.513 0.000 0.302 393 T C -1.579 173.246 174.700 0.210 0.000 1.373 393 T CA -0.074 62.096 62.100 0.116 0.000 1.000 393 T CB 1.417 70.290 68.868 0.008 0.000 1.483 393 T HN 1.337 9.577 8.240 -0.000 0.000 0.499 394 Y N -0.406 119.897 120.300 0.006 0.000 2.677 394 Y HA 0.857 5.100 4.550 -0.511 0.000 0.334 394 Y C -1.217 174.698 175.900 0.025 0.000 1.154 394 Y CA -1.230 56.885 58.100 0.025 0.000 1.070 394 Y CB 1.167 39.660 38.460 0.056 0.000 1.294 394 Y HN 0.351 8.631 8.280 -0.000 0.000 0.475 395 Q N 2.039 121.842 119.800 0.004 0.000 2.337 395 Q HA 0.474 4.507 4.340 -0.513 0.000 0.266 395 Q C -1.124 174.881 176.000 0.008 0.000 1.023 395 Q CA -0.781 54.982 55.803 -0.067 0.000 0.829 395 Q CB 2.926 31.677 28.738 0.021 0.000 1.306 395 Q HN 0.786 9.056 8.270 -0.000 0.000 0.449 396 L N 2.018 123.219 121.223 -0.037 0.000 2.371 396 L HA 0.278 4.310 4.340 -0.513 0.000 0.272 396 L C 0.751 177.649 176.870 0.045 0.000 1.124 396 L CA -0.575 54.293 54.840 0.047 0.000 0.816 396 L CB 0.466 42.536 42.059 0.017 0.000 1.129 396 L HN 0.200 8.430 8.230 -0.000 0.000 0.448 397 K N 1.597 122.028 120.400 0.051 0.000 2.319 397 K HA 0.018 4.031 4.320 -0.513 0.000 0.265 397 K C 0.393 176.981 176.600 -0.020 0.000 1.000 397 K CA -0.311 55.986 56.287 0.017 0.000 0.943 397 K CB 0.715 33.221 32.500 0.010 0.000 0.950 397 K HN 0.478 8.728 8.250 -0.000 0.000 0.485 398 D N 0.874 121.264 120.400 -0.015 0.000 2.133 398 D HA -0.190 4.143 4.640 -0.513 0.000 0.192 398 D C 1.749 178.029 176.300 -0.033 0.000 1.001 398 D CA 2.332 56.315 54.000 -0.029 0.000 0.844 398 D CB -0.403 40.387 40.800 -0.016 0.000 0.944 398 D HN 0.754 9.124 8.370 -0.000 0.000 0.447 399 T N -1.285 113.251 114.554 -0.030 0.000 2.788 399 T HA -0.142 3.900 4.350 -0.513 0.000 0.268 399 T C 1.774 176.416 174.700 -0.096 0.000 1.044 399 T CA 1.236 63.325 62.100 -0.020 0.000 1.139 399 T CB -0.329 68.552 68.868 0.023 0.000 0.867 399 T HN 0.235 8.475 8.240 -0.000 0.000 0.454 400 E N 0.600 120.663 120.200 -0.228 0.000 2.152 400 E HA 0.097 4.139 4.350 -0.513 0.000 0.192 400 E C 2.060 178.710 176.600 0.083 0.000 0.983 400 E CA 0.651 56.924 56.400 -0.211 0.000 0.818 400 E CB -0.218 29.408 29.700 -0.122 0.000 0.758 400 E HN 0.352 8.712 8.360 -0.000 0.000 0.467 401 L N 0.956 122.169 121.223 -0.018 0.000 2.056 401 L HA -0.127 3.905 4.340 -0.513 0.000 0.207 401 L C 2.019 178.858 176.870 -0.050 0.000 1.078 401 L CA 1.397 56.182 54.840 -0.092 0.000 0.749 401 L CB -0.064 41.903 42.059 -0.154 0.000 0.901 401 L HN 0.091 8.321 8.230 -0.000 0.000 0.433 402 I N -1.649 118.924 120.570 0.004 0.000 2.202 402 I HA -0.333 3.530 4.170 -0.513 0.000 0.242 402 I C 2.378 178.580 176.117 0.143 0.000 1.091 402 I CA 1.702 63.021 61.300 0.032 0.000 1.368 402 I CB -0.516 37.502 38.000 0.031 0.000 1.058 402 I HN 0.330 8.540 8.210 -0.000 0.000 0.410 403 Y N 1.750 122.121 120.300 0.120 0.000 2.165 403 Y HA -0.245 3.998 4.550 -0.513 0.000 0.286 403 Y C 2.387 178.476 175.900 0.315 0.000 1.155 403 Y CA 1.802 60.062 58.100 0.267 0.000 1.164 403 Y CB -0.656 37.953 38.460 0.248 0.000 0.978 403 Y HN 0.098 8.378 8.280 -0.000 0.000 0.513 404 G N -0.274 108.735 108.800 0.347 0.000 2.421 404 G HA2 -0.252 3.400 3.960 -0.513 0.000 0.216 404 G HA3 -0.252 3.400 3.960 -0.513 0.000 0.216 404 G C 1.798 176.669 174.900 -0.048 0.000 1.171 404 G CA 0.949 46.140 45.100 0.152 0.000 0.775 404 G HN 0.612 8.902 8.290 -0.000 0.000 0.543 405 A N 0.876 123.652 122.820 -0.074 0.000 1.877 405 A HA -0.023 3.990 4.320 -0.513 0.000 0.216 405 A C 2.307 179.915 177.584 0.041 0.000 1.186 405 A CA 2.010 53.992 52.037 -0.092 0.000 0.620 405 A CB -0.399 18.553 19.000 -0.080 0.000 0.822 405 A HN 0.362 8.512 8.150 -0.000 0.000 0.443 406 K N -1.485 118.982 120.400 0.112 0.000 2.057 406 K HA -0.183 3.830 4.320 -0.513 0.000 0.207 406 K C 1.993 178.646 176.600 0.088 0.000 1.049 406 K CA 1.824 58.251 56.287 0.232 0.000 0.931 406 K CB -0.317 32.341 32.500 0.263 0.000 0.714 406 K HN 0.664 8.914 8.250 -0.000 0.000 0.440 407 H N -0.106 118.881 119.070 -0.138 0.000 2.428 407 H HA 0.022 4.270 4.556 -0.513 0.000 0.296 407 H C 1.912 177.110 175.328 -0.218 0.000 1.062 407 H CA 1.241 57.097 56.048 -0.319 0.000 1.350 407 H CB -0.017 29.452 29.762 -0.488 0.000 1.403 407 H HN 0.259 8.539 8.280 -0.000 0.000 0.533 408 A N 0.445 123.188 122.820 -0.127 0.000 1.908 408 A HA -0.225 3.787 4.320 -0.513 0.000 0.218 408 A C 2.041 179.632 177.584 0.012 0.000 1.181 408 A CA 1.569 53.429 52.037 -0.295 0.000 0.627 408 A CB -1.015 17.437 19.000 -0.914 0.000 0.818 408 A HN 0.627 8.777 8.150 -0.000 0.000 0.445 409 W N 0.814 122.115 121.300 0.001 0.000 2.355 409 W HA -0.121 4.233 4.660 -0.509 0.000 0.309 409 W C 2.354 178.837 176.519 -0.060 0.000 1.206 409 W CA 1.527 58.917 57.345 0.076 0.000 1.284 409 W CB -0.692 28.806 29.460 0.063 0.000 1.145 409 W HN 0.359 8.539 8.180 -0.000 0.000 0.502 410 R N 0.185 120.584 120.500 -0.169 0.000 2.127 410 R HA -0.176 3.857 4.340 -0.513 0.000 0.238 410 R C 1.467 177.592 176.300 -0.291 0.000 1.134 410 R CA 1.714 57.480 56.100 -0.556 0.000 0.975 410 R CB -0.438 29.119 30.300 -1.239 0.000 0.865 410 R HN 0.110 8.380 8.270 -0.000 0.000 0.447 411 N N 0.043 118.648 118.700 -0.159 0.000 2.336 411 N HA 0.032 4.464 4.740 -0.513 0.000 0.189 411 N C -0.434 175.051 175.510 -0.041 0.000 1.113 411 N CA 0.459 53.446 53.050 -0.105 0.000 0.858 411 N CB 0.661 39.098 38.487 -0.083 0.000 0.970 411 N HN 0.118 8.498 8.380 -0.000 0.000 0.471 412 A N 1.149 124.000 122.820 0.051 0.000 2.475 412 A HA 0.173 4.185 4.320 -0.513 0.000 0.293 412 A C 1.389 178.981 177.584 0.013 0.000 1.252 412 A CA -0.221 51.861 52.037 0.074 0.000 0.920 412 A CB -0.157 18.952 19.000 0.182 0.000 1.125 412 A HN 0.263 8.413 8.150 -0.000 0.000 0.528 413 S N 2.639 118.303 115.700 -0.060 0.000 2.507 413 S HA -0.111 4.051 4.470 -0.513 0.000 0.235 413 S C 1.401 175.955 174.600 -0.077 0.000 0.988 413 S CA 0.908 59.060 58.200 -0.080 0.000 0.944 413 S CB -0.167 62.949 63.200 -0.140 0.000 0.762 413 S HN 0.754 9.064 8.310 -0.000 0.000 0.526 414 R N -0.457 119.977 120.500 -0.109 0.000 2.334 414 R HA 0.281 4.313 4.340 -0.513 0.000 0.216 414 R C 0.043 176.343 176.300 0.000 0.000 0.905 414 R CA -0.024 56.016 56.100 -0.101 0.000 1.064 414 R CB 0.027 30.115 30.300 -0.353 0.000 1.046 414 R HN 0.418 8.688 8.270 -0.000 0.000 0.508 415 C N 0.659 119.960 119.300 0.001 0.000 2.265 415 C HA 0.225 4.378 4.460 -0.513 0.000 0.332 415 C C 1.941 176.895 174.990 -0.061 0.000 1.248 415 C CA -0.675 58.370 59.018 0.045 0.000 1.727 415 C CB 0.459 28.307 27.740 0.180 0.000 2.348 415 C HN 0.272 8.502 8.230 -0.000 0.000 0.519 416 V N 6.025 125.859 119.914 -0.134 0.000 3.041 416 V HA 0.124 3.936 4.120 -0.513 0.000 0.260 416 V C 1.947 178.049 176.094 0.013 0.000 1.105 416 V CA 2.454 64.578 62.300 -0.294 0.000 1.125 416 V CB -0.186 31.520 31.823 -0.195 0.000 0.730 416 V HN 1.079 9.269 8.190 -0.000 0.000 0.479 417 G N -0.911 107.938 108.800 0.083 0.000 2.985 417 G HA2 -0.040 3.612 3.960 -0.513 0.000 0.209 417 G HA3 -0.040 3.612 3.960 -0.513 0.000 0.209 417 G C 1.421 176.354 174.900 0.055 0.000 1.165 417 G CA -0.195 44.971 45.100 0.110 0.000 0.776 417 G HN 0.446 8.736 8.290 -0.000 0.000 0.541 418 R N -0.154 120.327 120.500 -0.031 0.000 2.293 418 R HA 0.097 4.129 4.340 -0.513 0.000 0.219 418 R C 2.108 177.891 176.300 -0.862 0.000 1.091 418 R CA 0.198 56.012 56.100 -0.477 0.000 1.004 418 R CB -0.280 29.850 30.300 -0.284 0.000 0.865 418 R HN 0.437 8.707 8.270 -0.000 0.000 0.469 419 I N 1.064 121.207 120.570 -0.712 0.000 2.502 419 I HA -0.315 3.547 4.170 -0.513 0.000 0.258 419 I C 1.448 177.362 176.117 -0.337 0.000 1.172 419 I CA 1.441 62.461 61.300 -0.467 0.000 1.430 419 I CB 0.132 38.092 38.000 -0.067 0.000 1.086 419 I HN 0.229 8.439 8.210 -0.000 0.000 0.440 420 Q N 0.384 119.935 119.800 -0.415 0.000 2.425 420 Q HA -0.111 3.921 4.340 -0.513 0.000 0.204 420 Q C 1.680 177.179 176.000 -0.835 0.000 0.933 420 Q CA 0.645 56.206 55.803 -0.405 0.000 0.939 420 Q CB -0.222 28.451 28.738 -0.108 0.000 1.044 420 Q HN 0.813 9.083 8.270 -0.000 0.000 0.513 421 W N 1.239 121.792 121.300 -1.245 0.000 2.308 421 W HA -0.236 4.116 4.660 -0.514 0.000 0.301 421 W C 1.335 177.489 176.519 -0.607 0.000 1.220 421 W CA 1.585 58.029 57.345 -1.501 0.000 1.240 421 W CB -1.254 27.534 29.460 -1.120 0.000 1.142 421 W HN 0.169 8.349 8.180 -0.000 0.000 0.521 422 S N 0.984 115.829 115.700 -1.424 0.000 2.522 422 S HA -0.024 4.139 4.470 -0.513 0.000 0.227 422 S C 1.280 175.602 174.600 -0.464 0.000 0.986 422 S CA 0.470 57.953 58.200 -1.195 0.000 0.929 422 S CB -0.366 61.914 63.200 -1.533 0.000 0.769 422 S HN 0.162 8.472 8.310 -0.000 0.000 0.529 423 K N 1.417 121.654 120.400 -0.273 0.000 2.500 423 K HA 0.311 4.323 4.320 -0.513 0.000 0.206 423 K C -0.067 176.584 176.600 0.084 0.000 1.034 423 K CA -0.427 55.822 56.287 -0.064 0.000 1.179 423 K CB -0.536 31.958 32.500 -0.010 0.000 0.884 423 K HN 0.351 8.601 8.250 -0.000 0.000 0.493 424 L N 2.566 123.887 121.223 0.163 0.000 2.584 424 L HA -0.048 3.985 4.340 -0.513 0.000 0.272 424 L C 0.178 177.039 176.870 -0.015 0.000 1.195 424 L CA 0.453 55.397 54.840 0.174 0.000 0.920 424 L CB 0.301 42.524 42.059 0.273 0.000 1.173 424 L HN 0.118 8.348 8.230 -0.000 0.000 0.489 425 Q N 3.801 123.543 119.800 -0.097 0.000 2.295 425 Q HA 0.404 4.436 4.340 -0.513 0.000 0.259 425 Q C -1.334 174.329 176.000 -0.561 0.000 0.976 425 Q CA -0.121 55.474 55.803 -0.346 0.000 0.923 425 Q CB 1.034 29.530 28.738 -0.402 0.000 1.185 425 Q HN 0.511 8.781 8.270 -0.000 0.000 0.410 426 V N 6.073 125.655 119.914 -0.553 0.000 2.370 426 V HA 0.418 4.230 4.120 -0.513 0.000 0.283 426 V C -0.751 174.966 176.094 -0.628 0.000 1.023 426 V CA -0.562 61.459 62.300 -0.464 0.000 0.857 426 V CB 0.555 32.230 31.823 -0.246 0.000 0.985 426 V HN 0.641 8.831 8.190 -0.000 0.000 0.443 427 F N 2.577 122.399 119.950 -0.213 0.000 2.361 427 F HA 0.353 4.576 4.527 -0.506 0.000 0.364 427 F C 0.568 176.199 175.800 -0.282 0.000 1.120 427 F CA -1.108 56.762 58.000 -0.217 0.000 1.102 427 F CB 0.944 39.830 39.000 -0.190 0.000 1.183 427 F HN 0.420 8.720 8.300 -0.000 0.000 0.476 428 D N 3.419 123.788 120.400 -0.052 0.000 2.383 428 D HA 0.253 4.585 4.640 -0.513 0.000 0.245 428 D C 0.398 176.530 176.300 -0.281 0.000 1.263 428 D CA 0.218 54.117 54.000 -0.167 0.000 0.936 428 D CB 0.865 41.611 40.800 -0.090 0.000 1.053 428 D HN 0.617 8.987 8.370 -0.000 0.000 0.507 429 A N 4.516 126.983 122.820 -0.588 0.000 2.577 429 A HA 0.129 4.141 4.320 -0.513 0.000 0.280 429 A C 1.700 178.978 177.584 -0.510 0.000 1.331 429 A CA -0.369 51.076 52.037 -0.987 0.000 0.935 429 A CB -0.056 17.812 19.000 -1.887 0.000 1.082 429 A HN 0.511 8.661 8.150 -0.000 0.000 0.525 430 R N 0.543 120.880 120.500 -0.272 0.000 2.328 430 R HA -0.100 3.933 4.340 -0.513 0.000 0.207 430 R C 0.689 176.946 176.300 -0.073 0.000 1.056 430 R CA 1.232 57.249 56.100 -0.138 0.000 1.016 430 R CB 0.022 30.292 30.300 -0.051 0.000 0.872 430 R HN 0.686 8.956 8.270 -0.000 0.000 0.471 431 D N -0.868 119.517 120.400 -0.025 0.000 2.349 431 D HA -0.049 4.284 4.640 -0.513 0.000 0.214 431 D C 0.300 176.674 176.300 0.122 0.000 1.063 431 D CA -0.297 53.741 54.000 0.063 0.000 0.847 431 D CB -0.494 40.366 40.800 0.101 0.000 0.933 431 D HN -0.009 8.361 8.370 -0.000 0.000 0.513 432 C N 1.358 120.719 119.300 0.103 0.000 2.662 432 C HA 0.424 4.577 4.460 -0.513 0.000 0.420 432 C C 1.913 177.031 174.990 0.214 0.000 1.314 432 C CA 0.856 60.008 59.018 0.224 0.000 1.963 432 C CB 0.081 27.983 27.740 0.271 0.000 2.686 432 C HN 0.577 8.807 8.230 -0.000 0.000 0.609 433 T N 0.314 115.052 114.554 0.306 0.000 2.966 433 T HA 0.242 4.284 4.350 -0.513 0.000 0.254 433 T C 0.442 175.351 174.700 0.347 0.000 0.961 433 T CA 0.663 62.980 62.100 0.363 0.000 0.915 433 T CB -0.156 68.854 68.868 0.236 0.000 1.186 433 T HN 0.868 9.108 8.240 -0.000 0.000 0.505 434 T N -1.572 113.160 114.554 0.296 0.000 2.888 434 T HA 0.817 4.859 4.350 -0.513 0.000 0.288 434 T C 1.396 176.227 174.700 0.219 0.000 1.063 434 T CA -0.185 62.053 62.100 0.229 0.000 1.010 434 T CB 1.443 70.439 68.868 0.215 0.000 1.214 434 T HN 0.125 8.365 8.240 -0.000 0.000 0.533 435 A N -0.462 122.472 122.820 0.190 0.000 2.016 435 A HA 0.082 4.094 4.320 -0.513 0.000 0.217 435 A C 1.984 179.571 177.584 0.005 0.000 1.162 435 A CA 1.276 53.398 52.037 0.141 0.000 0.662 435 A CB -1.314 17.827 19.000 0.235 0.000 0.812 435 A HN 0.994 9.144 8.150 -0.000 0.000 0.450 436 H N -0.595 118.550 119.070 0.125 0.000 2.357 436 H HA 0.009 5.314 4.556 1.248 0.000 0.301 436 H C 2.401 177.732 175.328 0.005 0.000 1.082 436 H CA 1.592 57.652 56.048 0.020 0.000 1.342 436 H CB -0.211 29.659 29.762 0.179 0.000 1.389 436 H HN 0.470 8.750 8.280 -0.000 0.000 0.511 437 G N 0.270 109.196 108.800 0.209 0.000 2.476 437 G HA2 -0.325 3.327 3.960 -0.513 0.000 0.218 437 G HA3 -0.325 3.327 3.960 -0.513 0.000 0.218 437 G C 1.633 176.690 174.900 0.262 0.000 1.164 437 G CA 1.254 46.481 45.100 0.212 0.000 0.768 437 G HN 0.304 8.594 8.290 -0.000 0.000 0.560 438 M N -0.665 119.030 119.600 0.158 0.000 2.149 438 M HA 0.042 4.215 4.480 -0.513 0.000 0.261 438 M C 2.288 178.597 176.300 0.014 0.000 1.064 438 M CA 1.212 56.522 55.300 0.016 0.000 1.102 438 M CB -0.322 32.082 32.600 -0.327 0.000 1.369 438 M HN 0.332 8.622 8.290 -0.000 0.000 0.408 439 F N 0.980 120.706 119.950 -0.373 0.000 2.146 439 F HA -0.265 4.028 4.527 -0.389 0.000 0.298 439 F C 2.141 177.827 175.800 -0.191 0.000 1.096 439 F CA 1.713 59.417 58.000 -0.493 0.000 1.275 439 F CB -0.190 38.105 39.000 -1.174 0.000 1.008 439 F HN 0.161 8.461 8.300 -0.000 0.000 0.480 440 N N -0.087 118.446 118.700 -0.279 0.000 2.025 440 N HA -0.283 4.150 4.740 -0.513 0.000 0.194 440 N C 1.835 177.191 175.510 -0.256 0.000 1.044 440 N CA 2.255 55.110 53.050 -0.324 0.000 0.851 440 N CB -0.945 37.419 38.487 -0.205 0.000 1.036 440 N HN 0.484 8.864 8.380 -0.000 0.000 0.422 441 Y N 0.392 120.637 120.300 -0.092 0.000 2.151 441 Y HA -0.169 4.069 4.550 -0.520 0.000 0.284 441 Y C 2.264 178.134 175.900 -0.049 0.000 1.166 441 Y CA 1.243 59.317 58.100 -0.043 0.000 1.163 441 Y CB -0.119 38.436 38.460 0.159 0.000 0.974 441 Y HN 0.159 8.439 8.280 -0.000 0.000 0.511 442 I N -1.613 119.042 120.570 0.142 0.000 2.286 442 I HA -0.327 3.535 4.170 -0.513 0.000 0.245 442 I C 2.250 178.311 176.117 -0.094 0.000 1.104 442 I CA 0.813 62.139 61.300 0.043 0.000 1.397 442 I CB -0.447 37.571 38.000 0.031 0.000 1.072 442 I HN 0.306 8.516 8.210 -0.000 0.000 0.417 443 C N 0.762 119.885 119.300 -0.295 0.000 2.422 443 C HA -0.116 4.037 4.460 -0.513 0.000 0.279 443 C C 2.544 177.441 174.990 -0.155 0.000 1.305 443 C CA 0.752 59.591 59.018 -0.298 0.000 1.757 443 C CB -1.436 25.989 27.740 -0.526 0.000 1.962 443 C HN 0.543 8.773 8.230 -0.000 0.000 0.499 444 N N -0.182 118.417 118.700 -0.168 0.000 2.270 444 N HA -0.105 4.328 4.740 -0.513 0.000 0.181 444 N C 1.454 176.900 175.510 -0.107 0.000 1.016 444 N CA 1.186 54.135 53.050 -0.169 0.000 0.870 444 N CB -0.675 37.647 38.487 -0.276 0.000 0.979 444 N HN 0.777 9.157 8.380 -0.000 0.000 0.431 445 H N 0.082 119.052 119.070 -0.167 0.000 2.307 445 H HA 0.023 4.272 4.556 -0.511 0.000 0.303 445 H C 1.828 177.207 175.328 0.085 0.000 1.073 445 H CA 1.356 57.381 56.048 -0.038 0.000 1.338 445 H CB 0.041 29.823 29.762 0.033 0.000 1.389 445 H HN -0.137 8.143 8.280 -0.000 0.000 0.503 446 V N 1.353 121.439 119.914 0.285 0.000 2.250 446 V HA -0.346 3.467 4.120 -0.513 0.000 0.250 446 V C 2.539 178.726 176.094 0.155 0.000 1.060 446 V CA 2.469 64.880 62.300 0.184 0.000 1.030 446 V CB -0.643 31.205 31.823 0.042 0.000 0.643 446 V HN 0.463 8.653 8.190 -0.000 0.000 0.445 447 K N -1.079 119.380 120.400 0.098 0.000 2.057 447 K HA -0.243 3.769 4.320 -0.513 0.000 0.207 447 K C 2.271 178.936 176.600 0.108 0.000 1.049 447 K CA 2.003 58.334 56.287 0.074 0.000 0.931 447 K CB -0.390 32.128 32.500 0.030 0.000 0.714 447 K HN 0.551 8.801 8.250 -0.000 0.000 0.440 448 Y N 0.683 121.002 120.300 0.032 0.000 2.145 448 Y HA -0.191 4.051 4.550 -0.514 0.000 0.286 448 Y C 1.974 177.932 175.900 0.098 0.000 1.145 448 Y CA 1.791 59.932 58.100 0.068 0.000 1.148 448 Y CB -0.415 38.113 38.460 0.114 0.000 0.981 448 Y HN 0.163 8.443 8.280 -0.000 0.000 0.507 449 A N -0.518 122.446 122.820 0.240 0.000 1.873 449 A HA -0.136 3.877 4.320 -0.513 0.000 0.215 449 A C 2.200 179.829 177.584 0.075 0.000 1.186 449 A CA 2.141 54.278 52.037 0.167 0.000 0.616 449 A CB -1.349 17.826 19.000 0.293 0.000 0.823 449 A HN 0.515 8.665 8.150 -0.000 0.000 0.442 450 T N -0.111 114.500 114.554 0.094 0.000 2.652 450 T HA -0.170 3.873 4.350 -0.513 0.000 0.267 450 T C 1.087 175.792 174.700 0.009 0.000 1.039 450 T CA 1.581 63.723 62.100 0.070 0.000 1.153 450 T CB -0.462 68.449 68.868 0.072 0.000 0.863 450 T HN 0.640 8.880 8.240 -0.000 0.000 0.428 451 N N 0.913 119.593 118.700 -0.033 0.000 2.738 451 N HA -0.207 4.225 4.740 -0.513 0.000 0.249 451 N C -0.249 175.235 175.510 -0.044 0.000 1.047 451 N CA 0.759 53.764 53.050 -0.075 0.000 0.707 451 N CB -1.570 36.830 38.487 -0.145 0.000 0.937 451 N HN 0.627 9.007 8.380 -0.000 0.000 0.545 452 K N -2.338 118.049 120.400 -0.022 0.000 3.048 452 K HA -0.248 3.764 4.320 -0.513 0.000 0.274 452 K C 1.063 177.649 176.600 -0.022 0.000 1.098 452 K CA 1.164 57.440 56.287 -0.018 0.000 0.807 452 K CB -1.736 30.750 32.500 -0.023 0.000 1.217 452 K HN 0.982 9.232 8.250 -0.000 0.000 0.477 453 G N 0.623 109.416 108.800 -0.013 0.000 2.316 453 G HA2 -0.271 3.382 3.960 -0.513 0.000 0.203 453 G HA3 -0.271 3.382 3.960 -0.513 0.000 0.203 453 G C -0.193 174.695 174.900 -0.020 0.000 0.999 453 G CA 0.037 45.130 45.100 -0.012 0.000 0.649 453 G HN 0.415 8.705 8.290 -0.000 0.000 0.489 454 N N 1.683 120.358 118.700 -0.042 0.000 3.083 454 N HA 0.406 4.839 4.740 -0.513 0.000 0.260 454 N C 0.534 176.007 175.510 -0.062 0.000 1.163 454 N CA -0.453 52.553 53.050 -0.074 0.000 1.060 454 N CB -0.146 38.294 38.487 -0.079 0.000 1.345 454 N HN 0.316 8.696 8.380 -0.000 0.000 0.515 455 L N 2.027 123.237 121.223 -0.021 0.000 2.485 455 L HA 0.144 4.176 4.340 -0.513 0.000 0.275 455 L C 0.570 177.545 176.870 0.175 0.000 1.207 455 L CA 0.422 55.324 54.840 0.104 0.000 0.855 455 L CB 0.288 42.498 42.059 0.252 0.000 1.114 455 L HN 0.346 8.576 8.230 -0.000 0.000 0.485 456 R N 1.446 122.049 120.500 0.172 0.000 2.502 456 R HA 0.252 4.285 4.340 -0.513 0.000 0.300 456 R C -0.389 176.054 176.300 0.240 0.000 0.984 456 R CA -0.497 55.721 56.100 0.196 0.000 0.882 456 R CB 2.087 32.355 30.300 -0.053 0.000 1.180 456 R HN 0.778 9.048 8.270 -0.000 0.000 0.444 457 S N 2.033 117.884 115.700 0.252 0.000 2.563 457 S HA 0.539 4.701 4.470 -0.513 0.000 0.284 457 S C 0.047 174.691 174.600 0.073 0.000 1.331 457 S CA -0.067 58.180 58.200 0.078 0.000 1.047 457 S CB 1.156 64.364 63.200 0.013 0.000 0.859 457 S HN 0.757 9.067 8.310 -0.000 0.000 0.514 458 A N 2.656 125.457 122.820 -0.031 0.000 2.590 458 A HA 0.712 4.724 4.320 -0.513 0.000 0.294 458 A C -1.186 176.351 177.584 -0.077 0.000 1.046 458 A CA -0.718 51.242 52.037 -0.128 0.000 0.684 458 A CB 0.754 19.664 19.000 -0.151 0.000 1.279 458 A HN 1.424 9.574 8.150 -0.000 0.000 0.415 459 I N 0.345 120.864 120.570 -0.086 0.000 2.802 459 I HA 0.736 4.598 4.170 -0.513 0.000 0.298 459 I C -1.128 175.064 176.117 0.125 0.000 1.176 459 I CA -0.161 61.229 61.300 0.149 0.000 1.025 459 I CB 2.468 40.525 38.000 0.094 0.000 1.243 459 I HN 0.640 8.850 8.210 -0.000 0.000 0.424 460 T N 7.499 122.178 114.554 0.208 0.000 2.812 460 T HA 0.594 4.637 4.350 -0.513 0.000 0.282 460 T C -0.585 173.912 174.700 -0.339 0.000 0.990 460 T CA -0.241 61.841 62.100 -0.030 0.000 0.960 460 T CB 1.115 69.986 68.868 0.005 0.000 0.948 460 T HN 0.307 8.547 8.240 -0.000 0.000 0.438 461 I N 3.975 124.237 120.570 -0.514 0.000 2.382 461 I HA 0.416 4.279 4.170 -0.513 0.000 0.285 461 I C -0.562 175.207 176.117 -0.579 0.000 1.007 461 I CA -0.698 60.335 61.300 -0.445 0.000 1.142 461 I CB 0.756 38.489 38.000 -0.445 0.000 1.289 461 I HN 0.467 8.677 8.210 -0.000 0.000 0.453 462 F N 6.433 126.292 119.950 -0.150 0.000 2.375 462 F HA 0.435 4.661 4.527 -0.501 0.000 0.313 462 F C -1.847 173.814 175.800 -0.233 0.000 1.176 462 F CA -2.252 55.568 58.000 -0.300 0.000 1.142 462 F CB -0.231 38.593 39.000 -0.292 0.000 1.275 462 F HN 0.210 8.510 8.300 -0.000 0.000 0.544 463 P HA -0.003 4.417 4.420 -0.000 0.000 0.267 463 P C -1.024 176.286 177.300 0.017 0.000 1.200 463 P CA -0.246 62.756 63.100 -0.163 0.000 0.772 463 P CB 0.268 31.786 31.700 -0.304 0.000 0.855 464 Q N 2.622 122.376 119.800 -0.078 0.000 2.394 464 Q HA 0.168 4.201 4.340 -0.513 0.000 0.248 464 Q C 0.087 175.993 176.000 -0.157 0.000 0.992 464 Q CA -0.623 54.936 55.803 -0.407 0.000 0.888 464 Q CB 0.745 28.930 28.738 -0.922 0.000 1.257 464 Q HN 0.303 8.573 8.270 -0.000 0.000 0.462 465 R N 0.744 121.148 120.500 -0.159 0.000 2.638 465 R HA -0.037 3.996 4.340 -0.513 0.000 0.268 465 R C 0.140 176.400 176.300 -0.067 0.000 1.006 465 R CA 1.245 57.315 56.100 -0.049 0.000 1.088 465 R CB 0.451 30.717 30.300 -0.056 0.000 0.950 465 R HN 0.977 9.247 8.270 -0.000 0.000 0.419 466 T N -0.308 114.238 114.554 -0.013 0.000 3.422 466 T HA 0.017 4.059 4.350 -0.513 0.000 0.192 466 T C 0.765 175.443 174.700 -0.036 0.000 0.857 466 T CA 0.237 62.311 62.100 -0.044 0.000 1.400 466 T CB -0.312 68.511 68.868 -0.075 0.000 1.864 466 T HN 0.712 8.952 8.240 -0.000 0.000 0.415 467 D N 0.639 121.018 120.400 -0.036 0.000 2.340 467 D HA 0.355 4.687 4.640 -0.513 0.000 0.217 467 D C 1.520 177.847 176.300 0.044 0.000 1.081 467 D CA 0.446 54.444 54.000 -0.004 0.000 0.842 467 D CB -0.395 40.394 40.800 -0.019 0.000 0.934 467 D HN 0.932 9.302 8.370 -0.000 0.000 0.511 468 G N 0.597 109.433 108.800 0.060 0.000 2.179 468 G HA2 -0.365 3.287 3.960 -0.513 0.000 0.260 468 G HA3 -0.365 3.287 3.960 -0.513 0.000 0.260 468 G C 0.812 175.760 174.900 0.079 0.000 0.977 468 G CA 0.382 45.516 45.100 0.056 0.000 0.641 468 G HN 0.454 8.744 8.290 -0.000 0.000 0.533 469 K N -0.010 120.485 120.400 0.158 0.000 2.514 469 K HA 0.315 4.327 4.320 -0.513 0.000 0.207 469 K C 0.544 177.162 176.600 0.030 0.000 1.035 469 K CA -0.249 56.105 56.287 0.111 0.000 1.113 469 K CB 0.320 32.880 32.500 0.100 0.000 0.846 469 K HN 0.588 8.838 8.250 -0.000 0.000 0.491 470 H N -0.120 118.941 119.070 -0.014 0.000 2.904 470 H HA 0.107 4.356 4.556 -0.512 0.000 0.242 470 H C -0.845 174.447 175.328 -0.060 0.000 1.193 470 H CA -0.596 55.424 56.048 -0.046 0.000 0.946 470 H CB 0.762 30.522 29.762 -0.003 0.000 2.135 470 H HN 0.096 8.376 8.280 -0.000 0.000 0.652 471 D N 1.014 121.443 120.400 0.049 0.000 2.424 471 D HA 0.039 4.371 4.640 -0.513 0.000 0.244 471 D C 0.009 176.301 176.300 -0.014 0.000 1.134 471 D CA 0.592 54.639 54.000 0.079 0.000 0.881 471 D CB 0.526 41.361 40.800 0.060 0.000 1.191 471 D HN 0.058 8.428 8.370 -0.000 0.000 0.445 472 F N 2.544 122.535 119.950 0.068 0.000 2.394 472 F HA 0.412 4.625 4.527 -0.523 0.000 0.340 472 F C 1.028 176.863 175.800 0.059 0.000 1.105 472 F CA -0.273 57.755 58.000 0.048 0.000 1.124 472 F CB 0.818 39.856 39.000 0.063 0.000 1.145 472 F HN -0.128 8.172 8.300 -0.000 0.000 0.505 473 R N 1.650 122.270 120.500 0.200 0.000 2.698 473 R HA 0.577 4.610 4.340 -0.513 0.000 0.275 473 R C -1.727 174.707 176.300 0.224 0.000 1.001 473 R CA -1.000 55.218 56.100 0.197 0.000 0.896 473 R CB 2.074 32.486 30.300 0.186 0.000 1.218 473 R HN 0.367 8.637 8.270 -0.000 0.000 0.462 474 V N 2.704 122.738 119.914 0.200 0.000 2.347 474 V HA 0.179 3.991 4.120 -0.513 0.000 0.280 474 V C 0.387 176.673 176.094 0.320 0.000 1.021 474 V CA -0.581 61.848 62.300 0.214 0.000 0.847 474 V CB 1.261 33.145 31.823 0.101 0.000 0.990 474 V HN 0.738 8.928 8.190 -0.000 0.000 0.444 475 W N 2.131 123.500 121.300 0.115 0.000 2.402 475 W HA -0.021 4.346 4.660 -0.487 0.000 0.286 475 W C 1.086 177.707 176.519 0.171 0.000 1.221 475 W CA -0.178 57.332 57.345 0.275 0.000 1.257 475 W CB -0.731 29.009 29.460 0.467 0.000 1.120 475 W HN 0.550 8.730 8.180 -0.000 0.000 0.551 476 N N 0.279 119.062 118.700 0.139 0.000 2.395 476 N HA -0.020 4.413 4.740 -0.513 0.000 0.246 476 N C 1.239 176.588 175.510 -0.268 0.000 1.246 476 N CA 0.983 53.758 53.050 -0.458 0.000 0.879 476 N CB 0.434 38.760 38.487 -0.268 0.000 1.098 476 N HN -0.075 8.305 8.380 -0.000 0.000 0.444 477 S N 0.510 116.010 115.700 -0.333 0.000 2.436 477 S HA -0.031 4.132 4.470 -0.513 0.000 0.228 477 S C 0.301 174.792 174.600 -0.181 0.000 1.014 477 S CA 0.554 58.646 58.200 -0.180 0.000 0.950 477 S CB -0.011 63.123 63.200 -0.111 0.000 0.784 477 S HN 0.656 8.966 8.310 -0.000 0.000 0.504 478 Q N -0.518 119.153 119.800 -0.214 0.000 2.451 478 Q HA 0.531 4.563 4.340 -0.513 0.000 0.281 478 Q C 0.232 176.084 176.000 -0.247 0.000 1.099 478 Q CA -0.586 55.084 55.803 -0.220 0.000 0.806 478 Q CB 1.871 30.514 28.738 -0.159 0.000 1.419 478 Q HN 0.078 8.348 8.270 -0.000 0.000 0.427 479 L N 0.417 121.491 121.223 -0.248 0.000 2.131 479 L HA 0.012 4.044 4.340 -0.513 0.000 0.210 479 L C 0.551 177.256 176.870 -0.275 0.000 1.092 479 L CA 1.250 55.959 54.840 -0.218 0.000 0.759 479 L CB -0.020 41.912 42.059 -0.211 0.000 0.903 479 L HN 0.476 8.706 8.230 -0.000 0.000 0.435 480 I N 0.159 120.473 120.570 -0.428 0.000 2.448 480 I HA 0.327 4.189 4.170 -0.513 0.000 0.281 480 I C -0.346 175.154 176.117 -1.028 0.000 1.027 480 I CA -0.278 60.602 61.300 -0.700 0.000 1.111 480 I CB 1.211 38.723 38.000 -0.813 0.000 1.236 480 I HN 0.074 8.284 8.210 -0.000 0.000 0.452 481 R N 4.204 124.284 120.500 -0.698 0.000 2.799 481 R HA 0.566 4.598 4.340 -0.513 0.000 0.270 481 R C -1.559 174.514 176.300 -0.378 0.000 1.010 481 R CA -1.037 54.742 56.100 -0.536 0.000 0.916 481 R CB 2.613 32.784 30.300 -0.214 0.000 1.228 481 R HN 0.346 8.616 8.270 -0.000 0.000 0.469 482 Y N 0.145 120.490 120.300 0.074 0.000 2.334 482 Y HA 0.436 4.679 4.550 -0.512 0.000 0.328 482 Y C 0.695 176.678 175.900 0.138 0.000 1.130 482 Y CA -0.852 57.352 58.100 0.172 0.000 1.163 482 Y CB 1.713 40.381 38.460 0.346 0.000 1.207 482 Y HN 0.621 8.901 8.280 -0.000 0.000 0.471 483 A N 1.839 124.844 122.820 0.308 0.000 2.445 483 A HA 0.522 4.534 4.320 -0.513 0.000 0.242 483 A C 0.444 177.958 177.584 -0.117 0.000 1.075 483 A CA 0.204 52.260 52.037 0.031 0.000 0.777 483 A CB -0.174 18.831 19.000 0.009 0.000 1.013 483 A HN 0.894 9.044 8.150 -0.000 0.000 0.493 484 G N 0.497 109.128 108.800 -0.282 0.000 2.487 484 G HA2 0.569 4.221 3.960 -0.513 0.000 0.314 484 G HA3 0.569 4.221 3.960 -0.513 0.000 0.314 484 G C -1.203 173.494 174.900 -0.339 0.000 1.267 484 G CA -0.250 44.730 45.100 -0.201 0.000 0.937 484 G HN 0.536 8.826 8.290 -0.000 0.000 0.481 485 Y N 1.031 121.358 120.300 0.045 0.000 2.350 485 Y HA 0.419 4.661 4.550 -0.514 0.000 0.338 485 Y C 0.576 176.482 175.900 0.009 0.000 0.961 485 Y CA -0.976 57.144 58.100 0.033 0.000 1.100 485 Y CB 2.340 40.817 38.460 0.028 0.000 1.179 485 Y HN 0.298 8.578 8.280 -0.000 0.000 0.454 486 K N 3.557 124.041 120.400 0.140 0.000 2.349 486 K HA 0.190 4.202 4.320 -0.513 0.000 0.288 486 K C -0.355 176.289 176.600 0.074 0.000 1.058 486 K CA -0.426 55.909 56.287 0.081 0.000 0.953 486 K CB 0.563 33.092 32.500 0.049 0.000 0.997 486 K HN 0.590 8.840 8.250 -0.000 0.000 0.477 487 Q N 2.830 122.661 119.800 0.050 0.000 2.222 487 Q HA 0.156 4.189 4.340 -0.513 0.000 0.252 487 Q C -1.744 174.263 176.000 0.013 0.000 0.926 487 Q CA -1.903 53.915 55.803 0.026 0.000 0.899 487 Q CB 1.208 29.956 28.738 0.015 0.000 1.250 487 Q HN 0.372 8.642 8.270 -0.000 0.000 0.441 488 P HA -0.154 4.266 4.420 -0.000 0.000 0.223 488 P C 0.553 177.852 177.300 -0.003 0.000 1.144 488 P CA 1.112 64.211 63.100 -0.002 0.000 0.783 488 P CB 0.361 32.056 31.700 -0.009 0.000 0.771 489 D N -1.671 118.727 120.400 -0.003 0.000 2.219 489 D HA -0.047 4.286 4.640 -0.513 0.000 0.205 489 D C 1.722 178.023 176.300 0.001 0.000 0.970 489 D CA 1.776 55.774 54.000 -0.003 0.000 0.851 489 D CB -0.378 40.419 40.800 -0.005 0.000 0.943 489 D HN 0.164 8.534 8.370 -0.000 0.000 0.488 490 G N -0.930 107.873 108.800 0.005 0.000 2.284 490 G HA2 -0.258 3.394 3.960 -0.513 0.000 0.216 490 G HA3 -0.258 3.394 3.960 -0.513 0.000 0.216 490 G C 0.624 175.530 174.900 0.010 0.000 1.009 490 G CA 0.535 45.639 45.100 0.007 0.000 0.625 490 G HN 0.612 8.902 8.290 -0.000 0.000 0.501 491 S N -0.122 115.584 115.700 0.009 0.000 2.607 491 S HA 0.763 4.925 4.470 -0.513 0.000 0.272 491 S C 0.029 174.638 174.600 0.014 0.000 1.166 491 S CA 0.669 58.874 58.200 0.009 0.000 1.021 491 S CB 1.560 64.763 63.200 0.006 0.000 1.113 491 S HN 0.825 9.135 8.310 -0.000 0.000 0.531 492 T N 1.004 115.564 114.554 0.010 0.000 2.841 492 T HA 0.552 4.595 4.350 -0.513 0.000 0.283 492 T C -1.013 173.699 174.700 0.019 0.000 1.000 492 T CA -0.506 61.605 62.100 0.018 0.000 0.977 492 T CB 1.252 70.117 68.868 -0.004 0.000 0.979 492 T HN 0.501 8.741 8.240 -0.000 0.000 0.446 493 L N 3.276 124.543 121.223 0.074 0.000 2.275 493 L HA 0.654 4.687 4.340 -0.513 0.000 0.288 493 L C 0.920 177.870 176.870 0.134 0.000 1.046 493 L CA 1.257 56.151 54.840 0.090 0.000 0.805 493 L CB -0.019 42.093 42.059 0.089 0.000 1.193 493 L HN 1.052 9.282 8.230 -0.000 0.000 0.426 494 G N 3.858 112.666 108.800 0.013 0.000 2.509 494 G HA2 -0.259 3.394 3.960 -0.513 0.000 0.256 494 G HA3 -0.259 3.394 3.960 -0.513 0.000 0.256 494 G C -0.485 174.166 174.900 -0.415 0.000 1.152 494 G CA 0.078 45.161 45.100 -0.028 0.000 0.951 494 G HN 0.711 9.001 8.290 -0.000 0.000 0.559 495 D N 2.023 122.297 120.400 -0.211 0.000 2.396 495 D HA 0.548 4.880 4.640 -0.513 0.000 0.225 495 D C -1.054 175.170 176.300 -0.127 0.000 1.121 495 D CA -1.885 51.930 54.000 -0.308 0.000 0.853 495 D CB 1.407 42.329 40.800 0.203 0.000 1.043 495 D HN -0.016 8.354 8.370 -0.000 0.000 0.500 496 P HA -0.087 4.333 4.420 -0.000 0.000 0.221 496 P C 0.856 178.162 177.300 0.010 0.000 1.145 496 P CA 0.782 63.850 63.100 -0.053 0.000 0.795 496 P CB 0.248 31.919 31.700 -0.049 0.000 0.775 497 A N -0.754 122.091 122.820 0.043 0.000 2.209 497 A HA -0.082 3.931 4.320 -0.513 0.000 0.212 497 A C 1.455 179.095 177.584 0.093 0.000 1.158 497 A CA 1.146 53.234 52.037 0.085 0.000 0.742 497 A CB -0.746 18.328 19.000 0.123 0.000 0.790 497 A HN 0.152 8.302 8.150 -0.000 0.000 0.472 498 N N -0.769 117.978 118.700 0.077 0.000 2.238 498 N HA 0.142 4.574 4.740 -0.513 0.000 0.235 498 N C 1.052 176.591 175.510 0.049 0.000 1.209 498 N CA 0.162 53.266 53.050 0.091 0.000 0.879 498 N CB 0.718 39.266 38.487 0.101 0.000 1.136 498 N HN 0.156 8.536 8.380 -0.000 0.000 0.517 499 V N 1.212 121.136 119.914 0.016 0.000 2.220 499 V HA -0.309 3.503 4.120 -0.513 0.000 0.246 499 V C 2.598 178.670 176.094 -0.037 0.000 1.049 499 V CA 1.942 64.228 62.300 -0.023 0.000 1.003 499 V CB -0.528 31.293 31.823 -0.002 0.000 0.634 499 V HN 0.335 8.525 8.190 -0.000 0.000 0.444 500 Q N -0.996 118.792 119.800 -0.019 0.000 2.096 500 Q HA -0.299 3.733 4.340 -0.513 0.000 0.208 500 Q C 2.070 177.931 176.000 -0.232 0.000 0.993 500 Q CA 2.718 58.464 55.803 -0.095 0.000 0.862 500 Q CB -0.281 28.445 28.738 -0.020 0.000 0.915 500 Q HN 0.659 8.929 8.270 -0.000 0.000 0.416 501 F N 0.089 119.850 119.950 -0.314 0.000 2.187 501 F HA -0.099 4.116 4.527 -0.519 0.000 0.295 501 F C 2.109 177.767 175.800 -0.237 0.000 1.091 501 F CA 1.703 59.485 58.000 -0.364 0.000 1.308 501 F CB -0.385 38.487 39.000 -0.213 0.000 1.030 501 F HN 0.003 8.303 8.300 -0.000 0.000 0.487 502 T N -0.055 114.412 114.554 -0.144 0.000 2.720 502 T HA -0.228 3.815 4.350 -0.513 0.000 0.268 502 T C 1.708 176.307 174.700 -0.169 0.000 1.037 502 T CA 1.817 63.799 62.100 -0.197 0.000 1.144 502 T CB -0.388 68.360 68.868 -0.201 0.000 0.864 502 T HN 0.320 8.560 8.240 -0.000 0.000 0.444 503 E N 0.484 120.592 120.200 -0.153 0.000 2.070 503 E HA -0.119 3.924 4.350 -0.513 0.000 0.197 503 E C 2.115 178.616 176.600 -0.166 0.000 1.004 503 E CA 1.162 57.493 56.400 -0.116 0.000 0.805 503 E CB -0.318 29.317 29.700 -0.108 0.000 0.744 503 E HN 0.472 8.832 8.360 -0.000 0.000 0.451 504 I N 0.239 120.640 120.570 -0.282 0.000 2.179 504 I HA -0.359 3.503 4.170 -0.513 0.000 0.242 504 I C 2.376 178.322 176.117 -0.286 0.000 1.088 504 I CA 0.764 61.893 61.300 -0.285 0.000 1.357 504 I CB -0.236 37.538 38.000 -0.375 0.000 1.051 504 I HN 0.317 8.527 8.210 -0.000 0.000 0.409 505 C N 0.731 119.772 119.300 -0.431 0.000 2.413 505 C HA -0.169 3.984 4.460 -0.513 0.000 0.276 505 C C 2.711 177.667 174.990 -0.057 0.000 1.236 505 C CA 0.668 59.481 59.018 -0.343 0.000 1.735 505 C CB -0.894 26.528 27.740 -0.530 0.000 2.031 505 C HN 0.438 8.668 8.230 -0.000 0.000 0.474 506 I N 0.225 120.820 120.570 0.042 0.000 2.286 506 I HA -0.262 3.601 4.170 -0.513 0.000 0.248 506 I C 2.755 178.870 176.117 -0.003 0.000 1.115 506 I CA 1.439 62.801 61.300 0.105 0.000 1.392 506 I CB -0.640 37.429 38.000 0.114 0.000 1.065 506 I HN 0.469 8.679 8.210 -0.000 0.000 0.418 507 Q N 0.399 120.161 119.800 -0.063 0.000 2.096 507 Q HA -0.251 3.782 4.340 -0.513 0.000 0.204 507 Q C 2.092 178.025 176.000 -0.113 0.000 0.982 507 Q CA 1.430 57.174 55.803 -0.099 0.000 0.850 507 Q CB 0.111 28.769 28.738 -0.134 0.000 0.901 507 Q HN 0.434 8.704 8.270 -0.000 0.000 0.422 508 Q N -1.464 118.267 119.800 -0.114 0.000 2.472 508 Q HA 0.050 4.082 4.340 -0.513 0.000 0.208 508 Q C 0.585 176.536 176.000 -0.081 0.000 0.958 508 Q CA 1.036 56.770 55.803 -0.115 0.000 0.932 508 Q CB 1.104 29.757 28.738 -0.141 0.000 1.007 508 Q HN 0.549 8.819 8.270 -0.000 0.000 0.508 509 G N 0.336 109.115 108.800 -0.034 0.000 2.186 509 G HA2 -0.168 3.484 3.960 -0.513 0.000 0.130 509 G HA3 -0.168 3.484 3.960 -0.513 0.000 0.130 509 G C -0.977 173.958 174.900 0.058 0.000 1.031 509 G CA -0.373 44.720 45.100 -0.012 0.000 0.697 509 G HN 0.230 8.521 8.290 -0.000 0.000 0.494 510 W N 2.353 123.586 121.300 -0.111 0.000 2.338 510 W HA 0.691 5.039 4.660 -0.521 0.000 0.307 510 W C 0.288 176.779 176.519 -0.047 0.000 1.167 510 W CA -1.411 55.881 57.345 -0.089 0.000 1.208 510 W CB 0.692 30.094 29.460 -0.097 0.000 1.228 510 W HN 0.081 8.261 8.180 -0.000 0.000 0.499 511 K N 5.653 125.785 120.400 -0.446 0.000 2.315 511 K HA 0.410 4.423 4.320 -0.513 0.000 0.291 511 K C 0.112 176.007 176.600 -1.175 0.000 1.074 511 K CA -0.208 55.742 56.287 -0.560 0.000 0.936 511 K CB 0.384 32.687 32.500 -0.329 0.000 1.049 511 K HN 0.487 8.737 8.250 -0.000 0.000 0.471 512 A N 4.858 127.061 122.820 -1.028 0.000 2.366 512 A HA 0.276 4.288 4.320 -0.513 0.000 0.272 512 A C -1.645 175.603 177.584 -0.561 0.000 1.135 512 A CA -1.337 50.000 52.037 -1.166 0.000 0.804 512 A CB 0.300 19.076 19.000 -0.374 0.000 1.064 512 A HN 0.514 8.664 8.150 -0.000 0.000 0.499 513 P HA -0.032 4.388 4.420 -0.000 0.000 0.226 513 P C 0.061 177.212 177.300 -0.248 0.000 1.153 513 P CA 0.284 63.258 63.100 -0.210 0.000 0.777 513 P CB 0.049 31.717 31.700 -0.054 0.000 0.794 514 R N -1.465 118.790 120.500 -0.408 0.000 3.336 514 R HA -0.117 3.916 4.340 -0.513 0.000 0.260 514 R C 0.698 176.674 176.300 -0.540 0.000 1.032 514 R CA 0.281 55.855 56.100 -0.877 0.000 0.693 514 R CB -2.230 27.680 30.300 -0.649 0.000 1.134 514 R HN 0.356 8.626 8.270 -0.000 0.000 0.433 515 G N -0.887 107.758 108.800 -0.258 0.000 2.938 515 G HA2 0.415 4.067 3.960 -0.513 0.000 0.258 515 G HA3 0.415 4.067 3.960 -0.513 0.000 0.258 515 G C 0.193 175.115 174.900 0.036 0.000 1.356 515 G CA -0.477 44.579 45.100 -0.074 0.000 1.052 515 G HN 0.174 8.464 8.290 -0.000 0.000 0.550 516 R N -1.633 118.857 120.500 -0.015 0.000 2.112 516 R HA 0.206 4.238 4.340 -0.513 0.000 0.216 516 R C 0.214 176.246 176.300 -0.446 0.000 1.080 516 R CA 0.583 56.557 56.100 -0.210 0.000 0.996 516 R CB -0.013 30.078 30.300 -0.348 0.000 0.902 516 R HN 0.374 8.644 8.270 -0.000 0.000 0.449 517 F N 1.441 121.398 119.950 0.012 0.000 2.739 517 F HA 0.286 4.504 4.527 -0.515 0.000 0.345 517 F C -0.864 175.003 175.800 0.111 0.000 1.373 517 F CA -1.032 56.778 58.000 -0.317 0.000 1.160 517 F CB 0.760 39.411 39.000 -0.582 0.000 1.137 517 F HN -0.236 8.064 8.300 -0.000 0.000 0.524 518 D N 1.556 122.217 120.400 0.436 0.000 2.348 518 D HA 0.142 4.475 4.640 -0.513 0.000 0.253 518 D C 0.127 176.773 176.300 0.577 0.000 1.161 518 D CA 0.246 54.553 54.000 0.512 0.000 0.876 518 D CB 2.258 43.415 40.800 0.594 0.000 1.160 518 D HN -0.048 8.322 8.370 -0.000 0.000 0.459 519 V N 4.194 124.373 119.914 0.443 0.000 2.455 519 V HA 0.080 3.892 4.120 -0.513 0.000 0.273 519 V C 0.970 177.132 176.094 0.114 0.000 1.045 519 V CA -0.555 61.877 62.300 0.221 0.000 0.976 519 V CB 0.592 32.493 31.823 0.131 0.000 0.993 519 V HN 0.356 8.546 8.190 -0.000 0.000 0.475 520 L N 8.309 129.500 121.223 -0.054 0.000 2.483 520 L HA 0.230 4.262 4.340 -0.513 0.000 0.275 520 L C -1.673 175.019 176.870 -0.298 0.000 1.220 520 L CA -1.122 53.557 54.840 -0.268 0.000 0.833 520 L CB 0.536 42.515 42.059 -0.132 0.000 1.102 520 L HN 0.472 8.702 8.230 -0.000 0.000 0.490 521 P HA 0.194 4.614 4.420 -0.000 0.000 0.277 521 P C -0.910 176.293 177.300 -0.162 0.000 1.240 521 P CA -0.454 62.410 63.100 -0.395 0.000 0.798 521 P CB 0.948 32.204 31.700 -0.741 0.000 0.979 522 L N 2.162 123.366 121.223 -0.033 0.000 2.395 522 L HA 0.326 4.359 4.340 -0.513 0.000 0.269 522 L C 0.657 177.563 176.870 0.060 0.000 1.133 522 L CA -0.554 54.335 54.840 0.081 0.000 0.812 522 L CB 0.258 42.411 42.059 0.156 0.000 1.125 522 L HN 0.253 8.483 8.230 -0.000 0.000 0.452 523 L N 4.592 125.884 121.223 0.114 0.000 2.318 523 L HA 0.460 4.492 4.340 -0.513 0.000 0.277 523 L C -0.916 175.917 176.870 -0.061 0.000 1.008 523 L CA -0.313 54.492 54.840 -0.060 0.000 0.846 523 L CB 1.164 43.147 42.059 -0.127 0.000 1.220 523 L HN 0.459 8.689 8.230 -0.000 0.000 0.423 524 L N 4.309 125.501 121.223 -0.051 0.000 2.298 524 L HA 0.450 4.483 4.340 -0.513 0.000 0.284 524 L C -0.165 176.633 176.870 -0.120 0.000 1.013 524 L CA -0.362 54.466 54.840 -0.020 0.000 0.824 524 L CB 1.655 43.745 42.059 0.052 0.000 1.221 524 L HN 0.568 8.798 8.230 -0.000 0.000 0.418 525 Q N 3.257 122.998 119.800 -0.098 0.000 2.360 525 Q HA 0.620 4.653 4.340 -0.513 0.000 0.254 525 Q C -0.872 175.020 176.000 -0.181 0.000 0.975 525 Q CA -0.520 55.198 55.803 -0.143 0.000 0.912 525 Q CB 1.587 30.334 28.738 0.014 0.000 1.212 525 Q HN 0.772 9.042 8.270 -0.000 0.000 0.452 526 A N 4.337 126.991 122.820 -0.278 0.000 2.305 526 A HA 0.311 4.323 4.320 -0.513 0.000 0.322 526 A C 0.234 177.323 177.584 -0.825 0.000 1.187 526 A CA -0.361 51.308 52.037 -0.613 0.000 0.825 526 A CB 0.516 19.433 19.000 -0.138 0.000 1.164 526 A HN 1.142 9.292 8.150 -0.000 0.000 0.498 527 N N 0.725 118.446 118.700 -1.631 0.000 2.721 527 N HA -0.242 4.190 4.740 -0.513 0.000 0.249 527 N C 0.923 176.180 175.510 -0.421 0.000 1.072 527 N CA 1.066 53.661 53.050 -0.759 0.000 0.710 527 N CB -0.667 37.654 38.487 -0.277 0.000 0.993 527 N HN 2.130 10.510 8.380 -0.000 0.000 0.547 528 G N -1.207 107.355 108.800 -0.395 0.000 2.179 528 G HA2 -0.331 3.321 3.960 -0.513 0.000 0.257 528 G HA3 -0.331 3.321 3.960 -0.513 0.000 0.257 528 G C 0.260 175.071 174.900 -0.149 0.000 1.010 528 G CA 0.645 45.620 45.100 -0.209 0.000 0.736 528 G HN 0.587 8.877 8.290 -0.000 0.000 0.513 529 N N 0.271 118.849 118.700 -0.203 0.000 2.431 529 N HA 0.347 4.779 4.740 -0.513 0.000 0.289 529 N C -0.108 175.298 175.510 -0.172 0.000 1.277 529 N CA -0.461 52.514 53.050 -0.125 0.000 0.972 529 N CB 0.290 38.704 38.487 -0.122 0.000 1.143 529 N HN 0.110 8.489 8.380 -0.000 0.000 0.578 530 D N 1.073 121.402 120.400 -0.118 0.000 2.304 530 D HA 0.256 4.588 4.640 -0.513 0.000 0.250 530 D C -1.962 174.156 176.300 -0.304 0.000 1.107 530 D CA -0.831 53.053 54.000 -0.194 0.000 0.885 530 D CB 0.573 41.412 40.800 0.065 0.000 1.192 530 D HN 0.239 8.609 8.370 -0.000 0.000 0.436 531 P HA 0.172 4.592 4.420 -0.000 0.000 0.274 531 P C -0.604 176.466 177.300 -0.382 0.000 1.231 531 P CA -0.279 62.478 63.100 -0.571 0.000 0.790 531 P CB 1.370 32.347 31.700 -1.205 0.000 0.951 532 E N 0.729 120.747 120.200 -0.303 0.000 2.263 532 E HA 0.506 4.549 4.350 -0.513 0.000 0.264 532 E C -0.522 175.767 176.600 -0.518 0.000 0.923 532 E CA -1.074 55.101 56.400 -0.374 0.000 0.802 532 E CB 1.556 31.022 29.700 -0.391 0.000 1.228 532 E HN 0.329 8.689 8.360 -0.000 0.000 0.417 533 L N 1.955 122.778 121.223 -0.667 0.000 2.334 533 L HA 0.504 4.537 4.340 -0.513 0.000 0.277 533 L C -0.959 175.250 176.870 -1.102 0.000 1.075 533 L CA -0.313 54.151 54.840 -0.628 0.000 0.804 533 L CB 0.322 42.149 42.059 -0.386 0.000 1.174 533 L HN 0.489 8.719 8.230 -0.000 0.000 0.438 534 F N 0.577 120.301 119.950 -0.376 0.000 2.591 534 F HA 0.311 3.703 4.527 -1.891 0.000 0.309 534 F C -0.069 175.497 175.800 -0.390 0.000 1.098 534 F CA -0.689 56.958 58.000 -0.589 0.000 0.937 534 F CB 1.960 40.304 39.000 -1.095 0.000 1.250 534 F HN 0.341 8.641 8.300 -0.000 0.000 0.447 535 Q N 3.178 122.900 119.800 -0.131 0.000 2.303 535 Q HA 0.542 4.574 4.340 -0.513 0.000 0.257 535 Q C -0.714 175.399 176.000 0.188 0.000 0.941 535 Q CA -0.587 55.238 55.803 0.036 0.000 0.931 535 Q CB 0.993 29.794 28.738 0.104 0.000 1.215 535 Q HN 0.659 8.929 8.270 -0.000 0.000 0.437 536 I N 6.894 127.623 120.570 0.265 0.000 2.752 536 I HA 0.000 3.863 4.170 -0.513 0.000 0.289 536 I C -1.896 174.365 176.117 0.240 0.000 1.197 536 I CA -1.438 60.062 61.300 0.332 0.000 1.432 536 I CB 0.294 38.389 38.000 0.159 0.000 1.359 536 I HN 0.533 8.743 8.210 -0.000 0.000 0.571 537 P HA -0.004 4.416 4.420 -0.000 0.000 0.261 537 P C -1.966 175.401 177.300 0.112 0.000 1.183 537 P CA -0.765 62.431 63.100 0.159 0.000 0.761 537 P CB 0.145 31.917 31.700 0.120 0.000 0.785 538 P HA -0.219 4.201 4.420 -0.000 0.000 0.216 538 P C 1.291 178.634 177.300 0.072 0.000 1.150 538 P CA 1.444 64.600 63.100 0.093 0.000 0.843 538 P CB -0.216 31.541 31.700 0.095 0.000 0.787 539 E N -0.042 120.197 120.200 0.064 0.000 2.515 539 E HA -0.109 3.933 4.350 -0.513 0.000 0.201 539 E C 1.519 178.143 176.600 0.041 0.000 1.071 539 E CA 0.822 57.251 56.400 0.048 0.000 0.880 539 E CB -0.958 28.767 29.700 0.041 0.000 0.828 539 E HN 0.328 8.688 8.360 -0.000 0.000 0.540 540 L N 0.596 121.846 121.223 0.045 0.000 2.463 540 L HA 0.134 4.166 4.340 -0.513 0.000 0.219 540 L C 0.673 177.566 176.870 0.038 0.000 1.088 540 L CA 0.029 54.890 54.840 0.035 0.000 0.849 540 L CB 0.514 42.588 42.059 0.024 0.000 1.012 540 L HN -0.101 8.129 8.230 -0.000 0.000 0.468 541 V N 2.800 122.740 119.914 0.043 0.000 2.299 541 V HA 0.075 3.887 4.120 -0.513 0.000 0.255 541 V C 0.200 176.327 176.094 0.056 0.000 1.100 541 V CA -0.513 61.812 62.300 0.041 0.000 0.938 541 V CB 0.668 32.510 31.823 0.031 0.000 1.139 541 V HN 0.100 8.290 8.190 -0.000 0.000 0.490 542 L N 5.357 126.614 121.223 0.057 0.000 2.500 542 L HA 0.311 4.344 4.340 -0.513 0.000 0.272 542 L C 0.174 177.080 176.870 0.061 0.000 1.149 542 L CA 0.838 55.705 54.840 0.044 0.000 0.897 542 L CB -0.095 41.984 42.059 0.033 0.000 1.178 542 L HN 0.630 8.860 8.230 -0.000 0.000 0.473 543 E N 3.453 123.676 120.200 0.038 0.000 2.227 543 E HA 0.569 4.611 4.350 -0.513 0.000 0.268 543 E C -1.338 175.229 176.600 -0.055 0.000 0.907 543 E CA -1.018 55.408 56.400 0.044 0.000 0.786 543 E CB 2.356 32.115 29.700 0.099 0.000 1.191 543 E HN 0.447 8.807 8.360 -0.000 0.000 0.411 544 V N 3.899 123.747 119.914 -0.109 0.000 2.357 544 V HA 0.296 4.109 4.120 -0.513 0.000 0.284 544 V C -2.230 173.828 176.094 -0.060 0.000 1.018 544 V CA -2.028 60.156 62.300 -0.194 0.000 0.841 544 V CB 1.104 32.588 31.823 -0.564 0.000 0.991 544 V HN 0.561 8.751 8.190 -0.000 0.000 0.437 545 P HA 0.216 4.636 4.420 -0.000 0.000 0.268 545 P C -0.772 176.571 177.300 0.072 0.000 1.205 545 P CA -0.032 63.070 63.100 0.003 0.000 0.771 545 P CB 0.857 32.560 31.700 0.006 0.000 0.858 546 I N 4.408 125.061 120.570 0.139 0.000 2.307 546 I HA 0.321 4.183 4.170 -0.513 0.000 0.289 546 I C 1.118 177.453 176.117 0.363 0.000 1.021 546 I CA -0.423 61.039 61.300 0.271 0.000 1.224 546 I CB 0.410 38.649 38.000 0.397 0.000 1.376 546 I HN 0.423 8.633 8.210 -0.000 0.000 0.470 547 R N 5.191 125.871 120.500 0.300 0.000 2.912 547 R HA 0.569 4.602 4.340 -0.513 0.000 0.262 547 R C -1.282 175.115 176.300 0.162 0.000 1.057 547 R CA -0.670 55.610 56.100 0.299 0.000 0.981 547 R CB 2.318 32.763 30.300 0.242 0.000 1.201 547 R HN 0.568 8.838 8.270 -0.000 0.000 0.484 548 H N 0.976 119.985 119.070 -0.101 0.000 2.637 548 H HA 0.331 4.579 4.556 -0.513 0.000 0.363 548 H C -1.935 173.075 175.328 -0.530 0.000 1.131 548 H CA -2.048 53.773 56.048 -0.380 0.000 1.183 548 H CB 2.720 32.181 29.762 -0.501 0.000 1.637 548 H HN 0.329 8.609 8.280 -0.000 0.000 0.531 549 P HA -0.036 4.384 4.420 -0.000 0.000 0.223 549 P C 0.818 177.845 177.300 -0.455 0.000 1.151 549 P CA 0.932 63.423 63.100 -1.016 0.000 0.787 549 P CB 0.921 31.909 31.700 -1.187 0.000 0.788 550 K N -0.896 119.349 120.400 -0.257 0.000 2.225 550 K HA 0.146 4.158 4.320 -0.513 0.000 0.204 550 K C 0.742 177.143 176.600 -0.331 0.000 1.047 550 K CA 0.301 56.385 56.287 -0.337 0.000 0.970 550 K CB -0.062 32.063 32.500 -0.625 0.000 0.939 550 K HN 0.148 8.398 8.250 -0.000 0.000 0.472 551 F N 2.739 122.528 119.950 -0.268 0.000 2.434 551 F HA -0.001 4.219 4.527 -0.513 0.000 0.358 551 F C 1.368 176.827 175.800 -0.568 0.000 1.136 551 F CA -0.731 56.830 58.000 -0.732 0.000 1.157 551 F CB 0.667 38.750 39.000 -1.527 0.000 1.167 551 F HN 0.087 8.387 8.300 -0.000 0.000 0.539 552 D N 5.122 125.423 120.400 -0.165 0.000 2.133 552 D HA -0.246 4.087 4.640 -0.513 0.000 0.192 552 D C 2.037 178.350 176.300 0.021 0.000 1.001 552 D CA 1.847 55.831 54.000 -0.026 0.000 0.844 552 D CB -0.047 40.799 40.800 0.077 0.000 0.944 552 D HN 0.670 9.040 8.370 -0.000 0.000 0.447 553 W N -0.399 120.995 121.300 0.157 0.000 2.425 553 W HA -0.094 4.258 4.660 -0.513 0.000 0.277 553 W C 1.945 178.534 176.519 0.116 0.000 1.231 553 W CA -0.275 57.127 57.345 0.094 0.000 1.248 553 W CB -1.548 27.925 29.460 0.022 0.000 1.117 553 W HN -0.089 8.091 8.180 -0.000 0.000 0.568 554 F N 3.873 123.723 119.950 -0.167 0.000 2.063 554 F HA -0.379 3.840 4.527 -0.513 0.000 0.298 554 F C 2.742 178.616 175.800 0.123 0.000 1.105 554 F CA 3.735 61.727 58.000 -0.014 0.000 1.215 554 F CB -0.405 38.486 39.000 -0.182 0.000 0.972 554 F HN -0.113 8.187 8.300 -0.000 0.000 0.483 555 K N -0.695 119.863 120.400 0.263 0.000 2.144 555 K HA -0.258 3.755 4.320 -0.513 0.000 0.209 555 K C 1.285 177.937 176.600 0.088 0.000 1.047 555 K CA 2.040 58.431 56.287 0.173 0.000 0.927 555 K CB -0.886 31.705 32.500 0.152 0.000 0.716 555 K HN 0.224 8.474 8.250 -0.000 0.000 0.454 556 D N 0.934 121.394 120.400 0.100 0.000 2.390 556 D HA -0.015 4.317 4.640 -0.513 0.000 0.235 556 D C 1.416 177.726 176.300 0.016 0.000 1.040 556 D CA 0.532 54.574 54.000 0.069 0.000 0.923 556 D CB 0.002 40.861 40.800 0.098 0.000 0.886 556 D HN 0.301 8.671 8.370 -0.000 0.000 0.532 557 L N -0.693 120.497 121.223 -0.055 0.000 2.554 557 L HA 0.101 4.133 4.340 -0.513 0.000 0.226 557 L C 1.598 178.444 176.870 -0.041 0.000 1.137 557 L CA 0.359 55.130 54.840 -0.116 0.000 0.863 557 L CB -0.093 41.772 42.059 -0.324 0.000 0.985 557 L HN 0.118 8.348 8.230 -0.000 0.000 0.451 558 G N 0.670 109.469 108.800 -0.002 0.000 2.153 558 G HA2 -0.285 3.367 3.960 -0.513 0.000 0.252 558 G HA3 -0.285 3.367 3.960 -0.513 0.000 0.252 558 G C 0.179 175.098 174.900 0.032 0.000 0.994 558 G CA -0.096 45.036 45.100 0.054 0.000 0.698 558 G HN 0.244 8.534 8.290 -0.000 0.000 0.521 559 L N 0.106 121.292 121.223 -0.063 0.000 2.397 559 L HA 0.601 4.633 4.340 -0.513 0.000 0.271 559 L C 0.786 177.493 176.870 -0.271 0.000 1.148 559 L CA -0.066 54.658 54.840 -0.194 0.000 0.825 559 L CB 1.031 42.976 42.059 -0.190 0.000 1.117 559 L HN 0.464 8.694 8.230 -0.000 0.000 0.456 560 K N 2.078 122.110 120.400 -0.613 0.000 2.512 560 K HA 0.548 4.560 4.320 -0.513 0.000 0.263 560 K C -1.814 174.821 176.600 0.059 0.000 0.966 560 K CA -1.016 55.092 56.287 -0.297 0.000 0.851 560 K CB 2.552 34.818 32.500 -0.391 0.000 1.395 560 K HN 0.543 8.793 8.250 -0.000 0.000 0.440 561 W N 2.500 123.801 121.300 0.003 0.000 3.083 561 W HA 0.349 4.705 4.660 -0.507 0.000 0.333 561 W C -1.282 175.334 176.519 0.163 0.000 1.217 561 W CA -0.908 56.514 57.345 0.128 0.000 1.170 561 W CB 1.897 31.364 29.460 0.013 0.000 1.437 561 W HN 0.723 8.903 8.180 -0.000 0.000 0.557 562 Y N 0.343 120.581 120.300 -0.103 0.000 2.301 562 Y HA 0.570 4.816 4.550 -0.506 0.000 0.325 562 Y C 0.926 177.027 175.900 0.335 0.000 1.203 562 Y CA -0.177 57.921 58.100 -0.004 0.000 1.255 562 Y CB 0.480 38.801 38.460 -0.233 0.000 1.232 562 Y HN 0.448 8.728 8.280 -0.000 0.000 0.501 563 G N 1.954 110.992 108.800 0.397 0.000 2.430 563 G HA2 -0.059 3.593 3.960 -0.513 0.000 0.216 563 G HA3 -0.059 3.593 3.960 -0.513 0.000 0.216 563 G C -0.189 175.044 174.900 0.556 0.000 1.146 563 G CA 0.101 45.493 45.100 0.487 0.000 0.793 563 G HN 0.579 8.869 8.290 -0.000 0.000 0.537 564 L N 2.748 124.246 121.223 0.458 0.000 2.264 564 L HA 0.467 4.499 4.340 -0.513 0.000 0.287 564 L C -2.292 174.709 176.870 0.217 0.000 1.039 564 L CA -2.494 52.514 54.840 0.279 0.000 0.829 564 L CB 1.602 43.772 42.059 0.186 0.000 1.211 564 L HN -0.154 8.076 8.230 -0.000 0.000 0.427 565 P HA 0.329 4.749 4.420 -0.000 0.000 0.287 565 P C -1.386 175.803 177.300 -0.184 0.000 1.281 565 P CA -0.356 62.598 63.100 -0.244 0.000 0.781 565 P CB 1.523 32.717 31.700 -0.843 0.000 0.903 566 A N 4.117 126.825 122.820 -0.187 0.000 2.651 566 A HA 0.383 4.396 4.320 -0.513 0.000 0.290 566 A C -0.476 176.857 177.584 -0.417 0.000 1.185 566 A CA -0.605 51.258 52.037 -0.290 0.000 0.746 566 A CB 0.650 19.513 19.000 -0.228 0.000 1.213 566 A HN 0.290 8.440 8.150 -0.000 0.000 0.429 567 V N 2.801 122.288 119.914 -0.711 0.000 2.508 567 V HA 0.292 4.105 4.120 -0.513 0.000 0.281 567 V C 1.251 176.917 176.094 -0.713 0.000 1.041 567 V CA 1.201 63.045 62.300 -0.760 0.000 1.016 567 V CB 1.136 32.377 31.823 -0.971 0.000 0.984 567 V HN 1.114 9.304 8.190 -0.000 0.000 0.478 568 S N 1.909 117.390 115.700 -0.367 0.000 2.733 568 S HA 0.045 4.208 4.470 -0.513 0.000 0.247 568 S C 0.800 175.351 174.600 -0.083 0.000 1.043 568 S CA 0.066 58.145 58.200 -0.200 0.000 1.066 568 S CB -0.371 62.741 63.200 -0.148 0.000 1.045 568 S HN 0.894 9.204 8.310 -0.000 0.000 0.586 569 N N 0.499 119.141 118.700 -0.097 0.000 2.235 569 N HA 0.290 4.722 4.740 -0.513 0.000 0.209 569 N C 0.281 175.796 175.510 0.008 0.000 1.122 569 N CA -0.447 52.576 53.050 -0.045 0.000 0.845 569 N CB 0.090 38.532 38.487 -0.074 0.000 1.004 569 N HN 0.300 8.680 8.380 -0.000 0.000 0.499 570 M N 1.095 120.737 119.600 0.071 0.000 2.494 570 M HA 0.364 4.537 4.480 -0.513 0.000 0.300 570 M C -0.737 175.695 176.300 0.220 0.000 1.189 570 M CA -0.869 54.531 55.300 0.166 0.000 0.982 570 M CB 2.201 34.961 32.600 0.267 0.000 1.534 570 M HN 0.091 8.381 8.290 -0.000 0.000 0.488 571 L N 2.270 123.624 121.223 0.219 0.000 2.333 571 L HA 0.523 4.556 4.340 -0.513 0.000 0.280 571 L C -1.533 175.462 176.870 0.208 0.000 1.004 571 L CA -0.939 54.017 54.840 0.192 0.000 0.820 571 L CB 1.360 43.479 42.059 0.099 0.000 1.247 571 L HN 0.552 8.782 8.230 -0.000 0.000 0.416 572 L N 4.763 126.111 121.223 0.209 0.000 2.264 572 L HA 0.426 4.459 4.340 -0.513 0.000 0.289 572 L C -0.399 176.512 176.870 0.068 0.000 1.044 572 L CA 0.290 55.149 54.840 0.032 0.000 0.807 572 L CB 1.316 43.392 42.059 0.027 0.000 1.192 572 L HN 0.701 8.931 8.230 -0.000 0.000 0.425 573 E N 5.500 125.664 120.200 -0.060 0.000 2.092 573 E HA 0.446 4.488 4.350 -0.513 0.000 0.271 573 E C -1.308 175.235 176.600 -0.095 0.000 0.919 573 E CA -0.360 56.017 56.400 -0.039 0.000 0.760 573 E CB 0.728 30.398 29.700 -0.050 0.000 1.106 573 E HN 0.679 9.039 8.360 -0.000 0.000 0.408 574 I N 3.797 124.328 120.570 -0.064 0.000 2.382 574 I HA 0.335 4.198 4.170 -0.513 0.000 0.286 574 I C 0.829 176.737 176.117 -0.347 0.000 1.002 574 I CA -0.545 60.579 61.300 -0.293 0.000 1.135 574 I CB 1.858 39.652 38.000 -0.344 0.000 1.288 574 I HN 0.837 9.047 8.210 -0.000 0.000 0.448 575 G N 4.478 113.054 108.800 -0.373 0.000 2.366 575 G HA2 -0.129 3.524 3.960 -0.513 0.000 0.299 575 G HA3 -0.129 3.524 3.960 -0.513 0.000 0.299 575 G C 1.041 175.991 174.900 0.083 0.000 1.020 575 G CA 0.668 45.725 45.100 -0.072 0.000 1.026 575 G HN 1.483 9.773 8.290 -0.000 0.000 0.512 576 G N -2.035 106.778 108.800 0.022 0.000 2.189 576 G HA2 -0.267 3.385 3.960 -0.513 0.000 0.267 576 G HA3 -0.267 3.385 3.960 -0.513 0.000 0.267 576 G C 0.514 175.399 174.900 -0.025 0.000 0.975 576 G CA 0.795 45.915 45.100 0.033 0.000 0.644 576 G HN 1.407 9.697 8.290 -0.000 0.000 0.537 577 L N 0.588 121.746 121.223 -0.108 0.000 2.334 577 L HA 0.600 4.633 4.340 -0.513 0.000 0.277 577 L C 0.300 176.964 176.870 -0.343 0.000 1.075 577 L CA -0.660 54.006 54.840 -0.290 0.000 0.804 577 L CB 1.151 42.916 42.059 -0.491 0.000 1.174 577 L HN 0.171 8.401 8.230 -0.000 0.000 0.438 578 E N 2.698 122.645 120.200 -0.422 0.000 2.176 578 E HA 0.412 4.454 4.350 -0.513 0.000 0.267 578 E C -1.510 174.833 176.600 -0.430 0.000 0.893 578 E CA -0.421 55.812 56.400 -0.278 0.000 0.761 578 E CB 1.778 31.399 29.700 -0.132 0.000 1.133 578 E HN 0.282 8.642 8.360 -0.000 0.000 0.409 579 F N 1.743 121.679 119.950 -0.023 0.000 2.325 579 F HA 0.115 4.332 4.527 -0.516 0.000 0.369 579 F C 1.291 177.134 175.800 0.071 0.000 1.095 579 F CA -0.483 57.525 58.000 0.013 0.000 1.082 579 F CB 1.418 40.404 39.000 -0.023 0.000 1.289 579 F HN 0.442 8.742 8.300 -0.000 0.000 0.462 580 S N 1.187 117.016 115.700 0.215 0.000 2.501 580 S HA 0.376 4.538 4.470 -0.513 0.000 0.220 580 S C 0.743 175.472 174.600 0.214 0.000 0.997 580 S CA 0.105 58.411 58.200 0.177 0.000 0.919 580 S CB 0.269 63.545 63.200 0.127 0.000 0.778 580 S HN 0.463 8.773 8.310 -0.000 0.000 0.523 581 A N 1.315 124.311 122.820 0.294 0.000 2.285 581 A HA 0.611 4.624 4.320 -0.513 0.000 0.310 581 A C -0.000 177.823 177.584 0.399 0.000 1.266 581 A CA -0.686 51.552 52.037 0.334 0.000 0.832 581 A CB 0.104 19.324 19.000 0.368 0.000 1.163 581 A HN 1.032 9.182 8.150 -0.000 0.000 0.499 582 C N 0.641 120.134 119.300 0.321 0.000 3.319 582 C HA 0.473 4.625 4.460 -0.513 0.000 0.200 582 C C -3.007 172.152 174.990 0.283 0.000 1.332 582 C CA -1.908 57.277 59.018 0.279 0.000 1.170 582 C CB -0.543 27.378 27.740 0.301 0.000 1.855 582 C HN 0.535 8.765 8.230 -0.000 0.000 0.593 583 P HA 0.351 4.771 4.420 -0.000 0.000 0.265 583 P C -0.520 176.845 177.300 0.108 0.000 1.193 583 P CA 0.842 63.938 63.100 -0.007 0.000 0.765 583 P CB 0.203 31.843 31.700 -0.099 0.000 0.823 584 F N -0.542 119.354 119.950 -0.090 0.000 2.603 584 F HA 0.828 5.048 4.527 -0.511 0.000 0.317 584 F C -0.556 175.167 175.800 -0.129 0.000 1.066 584 F CA -1.146 56.807 58.000 -0.077 0.000 0.941 584 F CB 1.557 40.371 39.000 -0.310 0.000 1.291 584 F HN 0.369 8.669 8.300 -0.000 0.000 0.472 585 S N -0.185 115.568 115.700 0.089 0.000 2.556 585 S HA 0.917 5.080 4.470 -0.513 0.000 0.271 585 S C -0.672 173.879 174.600 -0.081 0.000 1.135 585 S CA -0.186 58.004 58.200 -0.018 0.000 0.858 585 S CB 1.488 64.780 63.200 0.153 0.000 1.114 585 S HN 1.415 9.725 8.310 -0.000 0.000 0.468 586 G N 0.085 108.791 108.800 -0.156 0.000 3.009 586 G HA2 0.709 4.361 3.960 -0.513 0.000 0.193 586 G HA3 0.709 4.361 3.960 -0.513 0.000 0.193 586 G C -1.299 173.619 174.900 0.031 0.000 1.636 586 G CA -0.053 44.904 45.100 -0.237 0.000 0.832 586 G HN 1.241 9.531 8.290 -0.000 0.000 0.795 587 W N -1.542 119.750 121.300 -0.013 0.000 3.066 587 W HA 0.761 5.113 4.660 -0.514 0.000 0.330 587 W C -1.703 174.811 176.519 -0.008 0.000 1.253 587 W CA -2.299 55.048 57.345 0.004 0.000 1.187 587 W CB 0.289 29.800 29.460 0.086 0.000 1.434 587 W HN 0.412 8.592 8.180 -0.000 0.000 0.572 588 Y N 2.774 123.281 120.300 0.346 0.000 2.397 588 Y HA 0.292 4.534 4.550 -0.513 0.000 0.335 588 Y C 1.006 176.984 175.900 0.130 0.000 1.213 588 Y CA -0.578 57.597 58.100 0.124 0.000 1.391 588 Y CB 1.208 39.641 38.460 -0.044 0.000 1.293 588 Y HN 0.444 8.724 8.280 -0.000 0.000 0.557 589 M N 2.480 122.242 119.600 0.270 0.000 2.264 589 M HA 0.342 4.514 4.480 -0.513 0.000 0.352 589 M C 1.062 177.362 176.300 -0.000 0.000 1.173 589 M CA -0.025 55.360 55.300 0.141 0.000 1.075 589 M CB 1.364 34.028 32.600 0.106 0.000 1.621 589 M HN 0.863 9.153 8.290 -0.000 0.000 0.457 590 G N 1.185 109.943 108.800 -0.069 0.000 2.469 590 G HA2 -0.262 3.390 3.960 -0.513 0.000 0.219 590 G HA3 -0.262 3.390 3.960 -0.513 0.000 0.219 590 G C 1.160 175.897 174.900 -0.272 0.000 1.150 590 G CA 1.610 46.579 45.100 -0.217 0.000 0.763 590 G HN 0.897 9.187 8.290 -0.000 0.000 0.561 591 T N -0.763 113.667 114.554 -0.206 0.000 2.849 591 T HA -0.080 3.962 4.350 -0.513 0.000 0.270 591 T C 1.911 176.447 174.700 -0.274 0.000 1.066 591 T CA 1.676 63.615 62.100 -0.269 0.000 1.130 591 T CB -0.289 68.397 68.868 -0.304 0.000 0.864 591 T HN 0.513 8.753 8.240 -0.000 0.000 0.481 592 E N 0.864 120.923 120.200 -0.234 0.000 2.058 592 E HA -0.071 3.971 4.350 -0.513 0.000 0.194 592 E C 2.049 178.371 176.600 -0.463 0.000 0.997 592 E CA 1.583 57.856 56.400 -0.211 0.000 0.801 592 E CB -0.311 29.418 29.700 0.048 0.000 0.746 592 E HN 0.615 8.975 8.360 -0.000 0.000 0.450 593 I N -0.012 120.088 120.570 -0.784 0.000 2.270 593 I HA -0.062 3.800 4.170 -0.513 0.000 0.239 593 I C 2.565 178.056 176.117 -1.044 0.000 1.080 593 I CA 0.990 61.531 61.300 -1.265 0.000 1.383 593 I CB -0.512 36.520 38.000 -1.613 0.000 1.097 593 I HN 0.102 8.312 8.210 -0.000 0.000 0.420 594 G N 0.678 109.081 108.800 -0.662 0.000 2.421 594 G HA2 -0.147 3.506 3.960 -0.513 0.000 0.216 594 G HA3 -0.147 3.506 3.960 -0.513 0.000 0.216 594 G C 1.648 176.456 174.900 -0.154 0.000 1.171 594 G CA 1.163 46.078 45.100 -0.308 0.000 0.775 594 G HN 0.226 8.516 8.290 -0.000 0.000 0.543 595 V N 0.349 120.139 119.914 -0.207 0.000 2.331 595 V HA 0.028 3.841 4.120 -0.513 0.000 0.242 595 V C 2.864 178.886 176.094 -0.120 0.000 1.034 595 V CA 1.294 63.508 62.300 -0.142 0.000 1.027 595 V CB -0.322 31.391 31.823 -0.183 0.000 0.667 595 V HN 0.149 8.339 8.190 -0.000 0.000 0.457 596 R N 0.670 121.066 120.500 -0.173 0.000 2.055 596 R HA 0.084 4.116 4.340 -0.513 0.000 0.221 596 R C 2.079 178.333 176.300 -0.076 0.000 1.154 596 R CA 1.000 57.029 56.100 -0.119 0.000 0.975 596 R CB -1.219 29.006 30.300 -0.126 0.000 0.869 596 R HN 0.455 8.725 8.270 -0.000 0.000 0.437 597 N N 0.614 119.189 118.700 -0.209 0.000 2.223 597 N HA -0.135 4.298 4.740 -0.513 0.000 0.185 597 N C 1.748 177.346 175.510 0.147 0.000 1.016 597 N CA 1.191 54.150 53.050 -0.152 0.000 0.863 597 N CB -0.203 37.845 38.487 -0.732 0.000 0.983 597 N HN 0.429 8.809 8.380 -0.000 0.000 0.429 598 Y N -1.350 118.898 120.300 -0.086 0.000 2.509 598 Y HA 0.101 4.343 4.550 -0.513 0.000 0.270 598 Y C 1.668 177.622 175.900 0.090 0.000 1.103 598 Y CA -0.138 57.983 58.100 0.034 0.000 1.278 598 Y CB 0.528 38.975 38.460 -0.022 0.000 1.087 598 Y HN 0.070 8.350 8.280 -0.000 0.000 0.542 599 C N -1.237 118.180 119.300 0.194 0.000 3.449 599 C HA 0.159 4.311 4.460 -0.513 0.000 0.404 599 C C 0.142 175.177 174.990 0.075 0.000 1.383 599 C CA -0.485 58.606 59.018 0.121 0.000 1.936 599 C CB -0.339 27.447 27.740 0.075 0.000 2.738 599 C HN 0.206 8.436 8.230 -0.000 0.000 0.663 600 D N 2.482 122.919 120.400 0.061 0.000 2.533 600 D HA 0.012 4.345 4.640 -0.513 0.000 0.236 600 D C 0.997 177.332 176.300 0.058 0.000 1.137 600 D CA 0.536 54.561 54.000 0.041 0.000 0.867 600 D CB 0.471 41.293 40.800 0.037 0.000 1.170 600 D HN 0.235 8.605 8.370 -0.000 0.000 0.474 601 N N 0.902 119.626 118.700 0.040 0.000 2.069 601 N HA -0.217 4.215 4.740 -0.513 0.000 0.196 601 N C 1.505 177.040 175.510 0.041 0.000 1.024 601 N CA 1.534 54.610 53.050 0.043 0.000 0.869 601 N CB -0.427 38.079 38.487 0.032 0.000 1.035 601 N HN 0.461 8.841 8.380 -0.000 0.000 0.434 602 S N 0.076 115.798 115.700 0.037 0.000 2.607 602 S HA 0.146 4.309 4.470 -0.513 0.000 0.224 602 S C 1.089 175.710 174.600 0.035 0.000 0.969 602 S CA -0.076 58.144 58.200 0.034 0.000 0.927 602 S CB 0.372 63.593 63.200 0.035 0.000 0.772 602 S HN 0.043 8.353 8.310 -0.000 0.000 0.533 603 R N 0.088 120.622 120.500 0.057 0.000 2.647 603 R HA 0.379 4.412 4.340 -0.513 0.000 0.124 603 R C 0.868 177.195 176.300 0.045 0.000 1.294 603 R CA -0.384 55.762 56.100 0.077 0.000 1.060 603 R CB -1.088 29.317 30.300 0.176 0.000 1.282 603 R HN 0.326 8.596 8.270 -0.000 0.000 0.430 604 Y N 1.546 121.962 120.300 0.194 0.000 2.516 604 Y HA 0.027 4.268 4.550 -0.514 0.000 0.291 604 Y C 0.640 176.611 175.900 0.117 0.000 1.131 604 Y CA 0.912 59.122 58.100 0.182 0.000 1.281 604 Y CB -0.089 38.547 38.460 0.292 0.000 1.013 604 Y HN 0.520 8.800 8.280 -0.000 0.000 0.554 605 N N 1.193 120.031 118.700 0.231 0.000 2.688 605 N HA -0.220 4.213 4.740 -0.513 0.000 0.258 605 N C 0.311 175.902 175.510 0.135 0.000 1.016 605 N CA 0.465 53.602 53.050 0.146 0.000 0.747 605 N CB -1.031 37.514 38.487 0.096 0.000 0.895 605 N HN 0.642 9.022 8.380 -0.000 0.000 0.543 606 I N -2.440 118.216 120.570 0.143 0.000 3.928 606 I HA 0.119 3.982 4.170 -0.513 0.000 0.335 606 I C 1.635 177.823 176.117 0.117 0.000 1.325 606 I CA -0.490 60.868 61.300 0.097 0.000 1.107 606 I CB 0.039 38.054 38.000 0.026 0.000 1.014 606 I HN 0.167 8.377 8.210 -0.000 0.000 0.400 607 L N 0.949 122.262 121.223 0.150 0.000 1.994 607 L HA -0.125 3.907 4.340 -0.513 0.000 0.208 607 L C 2.721 179.755 176.870 0.274 0.000 1.071 607 L CA 1.624 56.585 54.840 0.201 0.000 0.745 607 L CB -0.518 41.637 42.059 0.161 0.000 0.892 607 L HN 0.325 8.555 8.230 -0.000 0.000 0.431 608 E N 0.144 120.495 120.200 0.252 0.000 2.065 608 E HA -0.300 3.743 4.350 -0.513 0.000 0.201 608 E C 2.026 178.654 176.600 0.048 0.000 1.016 608 E CA 2.020 58.525 56.400 0.175 0.000 0.818 608 E CB -0.192 29.571 29.700 0.106 0.000 0.749 608 E HN 0.561 8.921 8.360 -0.000 0.000 0.453 609 E N 0.249 120.466 120.200 0.028 0.000 2.077 609 E HA -0.137 3.905 4.350 -0.513 0.000 0.193 609 E C 2.223 178.779 176.600 -0.073 0.000 0.989 609 E CA 1.036 57.411 56.400 -0.041 0.000 0.800 609 E CB -0.080 29.595 29.700 -0.041 0.000 0.746 609 E HN 0.033 8.393 8.360 -0.000 0.000 0.452 610 V N 1.106 121.025 119.914 0.009 0.000 2.358 610 V HA -0.240 3.572 4.120 -0.513 0.000 0.246 610 V C 2.265 178.368 176.094 0.016 0.000 1.047 610 V CA 1.692 64.027 62.300 0.060 0.000 1.035 610 V CB -0.804 31.156 31.823 0.228 0.000 0.658 610 V HN 0.355 8.545 8.190 -0.000 0.000 0.452 611 A N -0.135 122.732 122.820 0.079 0.000 1.940 611 A HA -0.278 3.735 4.320 -0.513 0.000 0.219 611 A C 2.289 179.791 177.584 -0.137 0.000 1.176 611 A CA 2.159 54.234 52.037 0.064 0.000 0.631 611 A CB -0.451 18.654 19.000 0.175 0.000 0.814 611 A HN 0.558 8.708 8.150 -0.000 0.000 0.446 612 K N -0.355 119.921 120.400 -0.207 0.000 2.057 612 K HA -0.103 3.909 4.320 -0.513 0.000 0.206 612 K C 1.858 178.226 176.600 -0.388 0.000 1.050 612 K CA 1.344 57.466 56.287 -0.275 0.000 0.935 612 K CB -0.057 32.297 32.500 -0.243 0.000 0.715 612 K HN 0.261 8.511 8.250 -0.000 0.000 0.439 613 K N 0.409 120.469 120.400 -0.566 0.000 2.217 613 K HA -0.026 3.986 4.320 -0.513 0.000 0.202 613 K C 1.859 177.811 176.600 -1.080 0.000 1.051 613 K CA 1.172 56.809 56.287 -1.085 0.000 0.952 613 K CB -0.081 31.341 32.500 -1.797 0.000 0.736 613 K HN 0.255 8.505 8.250 -0.000 0.000 0.453 614 M N 0.419 119.661 119.600 -0.596 0.000 2.492 614 M HA -0.068 4.104 4.480 -0.513 0.000 0.262 614 M C -0.439 175.746 176.300 -0.192 0.000 1.090 614 M CA 0.421 55.548 55.300 -0.288 0.000 1.110 614 M CB -0.314 32.227 32.600 -0.098 0.000 1.407 614 M HN 0.052 8.342 8.290 -0.000 0.000 0.470 615 D N 1.604 121.868 120.400 -0.227 0.000 2.812 615 D HA -0.143 4.189 4.640 -0.513 0.000 0.237 615 D C -1.198 175.043 176.300 -0.099 0.000 1.162 615 D CA 0.395 54.296 54.000 -0.166 0.000 0.740 615 D CB -0.689 40.021 40.800 -0.149 0.000 1.000 615 D HN 0.222 8.592 8.370 -0.000 0.000 0.416 616 L N 0.222 121.390 121.223 -0.091 0.000 2.352 616 L HA 0.454 4.487 4.340 -0.513 0.000 0.269 616 L C 0.822 177.626 176.870 -0.110 0.000 1.034 616 L CA -1.045 53.776 54.840 -0.033 0.000 0.806 616 L CB 0.903 43.008 42.059 0.076 0.000 1.244 616 L HN -0.005 8.225 8.230 -0.000 0.000 0.447 617 D N 1.351 121.717 120.400 -0.056 0.000 2.367 617 D HA 0.120 4.452 4.640 -0.513 0.000 0.255 617 D C 0.555 176.721 176.300 -0.223 0.000 1.300 617 D CA 0.356 54.295 54.000 -0.101 0.000 0.959 617 D CB 0.598 41.387 40.800 -0.018 0.000 1.064 617 D HN 0.372 8.742 8.370 -0.000 0.000 0.509 618 M N 2.324 121.630 119.600 -0.491 0.000 2.563 618 M HA 0.107 4.279 4.480 -0.513 0.000 0.231 618 M C 1.808 177.871 176.300 -0.396 0.000 1.136 618 M CA 0.027 54.747 55.300 -0.966 0.000 1.026 618 M CB 0.271 32.149 32.600 -1.203 0.000 1.597 618 M HN 0.284 8.574 8.290 -0.000 0.000 0.495 619 R N 1.562 121.955 120.500 -0.179 0.000 2.105 619 R HA -0.093 3.939 4.340 -0.513 0.000 0.239 619 R C -0.117 176.204 176.300 0.034 0.000 1.135 619 R CA 1.121 57.184 56.100 -0.062 0.000 0.967 619 R CB -0.005 30.271 30.300 -0.040 0.000 0.861 619 R HN 0.358 8.629 8.270 -0.000 0.000 0.442 620 K N -1.776 118.692 120.400 0.113 0.000 2.502 620 K HA 0.216 4.229 4.320 -0.513 0.000 0.257 620 K C 0.488 177.260 176.600 0.288 0.000 0.938 620 K CA -0.413 55.975 56.287 0.168 0.000 0.819 620 K CB 1.655 34.215 32.500 0.100 0.000 1.333 620 K HN -0.170 8.080 8.250 -0.000 0.000 0.434 621 T N -1.819 112.866 114.554 0.218 0.000 2.699 621 T HA -0.261 3.781 4.350 -0.513 0.000 0.268 621 T C 1.779 176.523 174.700 0.074 0.000 1.036 621 T CA 1.924 64.099 62.100 0.125 0.000 1.147 621 T CB -0.702 68.190 68.868 0.040 0.000 0.862 621 T HN 0.631 8.871 8.240 -0.000 0.000 0.446 622 S N 2.140 117.889 115.700 0.082 0.000 2.537 622 S HA -0.066 4.096 4.470 -0.513 0.000 0.240 622 S C 2.105 176.750 174.600 0.075 0.000 0.981 622 S CA 0.867 59.101 58.200 0.056 0.000 0.948 622 S CB -0.858 62.371 63.200 0.048 0.000 0.759 622 S HN 0.808 9.118 8.310 -0.000 0.000 0.531 623 S N 1.659 117.441 115.700 0.136 0.000 2.561 623 S HA 0.208 4.371 4.470 -0.513 0.000 0.225 623 S C 0.951 175.632 174.600 0.135 0.000 0.977 623 S CA 0.153 58.444 58.200 0.151 0.000 0.926 623 S CB -0.925 62.401 63.200 0.211 0.000 0.769 623 S HN 0.605 8.915 8.310 -0.000 0.000 0.533 624 L N 0.659 121.921 121.223 0.066 0.000 3.717 624 L HA -0.166 3.866 4.340 -0.513 0.000 0.411 624 L C 1.520 178.387 176.870 -0.005 0.000 1.233 624 L CA 0.754 55.576 54.840 -0.030 0.000 0.917 624 L CB -2.582 39.475 42.059 -0.003 0.000 1.902 624 L HN 0.758 8.988 8.230 -0.000 0.000 0.894 625 W N -0.008 121.306 121.300 0.023 0.000 2.418 625 W HA -0.089 4.263 4.660 -0.513 0.000 0.292 625 W C 1.745 178.284 176.519 0.033 0.000 1.213 625 W CA 1.104 58.464 57.345 0.025 0.000 1.283 625 W CB -0.674 28.793 29.460 0.012 0.000 1.119 625 W HN 0.224 8.404 8.180 -0.000 0.000 0.542 626 K N 1.235 121.106 120.400 -0.882 0.000 2.020 626 K HA -0.216 3.796 4.320 -0.513 0.000 0.212 626 K C 1.511 177.975 176.600 -0.227 0.000 1.050 626 K CA 2.666 58.542 56.287 -0.685 0.000 0.929 626 K CB -0.493 31.494 32.500 -0.855 0.000 0.714 626 K HN 0.061 8.311 8.250 -0.000 0.000 0.443 627 D N 0.445 120.730 120.400 -0.192 0.000 2.117 627 D HA -0.153 4.180 4.640 -0.513 0.000 0.197 627 D C 2.151 178.457 176.300 0.010 0.000 0.987 627 D CA 0.968 54.923 54.000 -0.076 0.000 0.829 627 D CB -0.009 40.752 40.800 -0.065 0.000 0.961 627 D HN 0.163 8.533 8.370 -0.000 0.000 0.460 628 Q N 0.289 120.123 119.800 0.056 0.000 1.993 628 Q HA -0.110 3.922 4.340 -0.513 0.000 0.202 628 Q C 2.414 178.509 176.000 0.158 0.000 0.984 628 Q CA 1.462 57.337 55.803 0.120 0.000 0.837 628 Q CB -0.459 28.374 28.738 0.157 0.000 0.902 628 Q HN 0.336 8.606 8.270 -0.000 0.000 0.423 629 A N 1.094 124.025 122.820 0.184 0.000 1.908 629 A HA -0.187 3.825 4.320 -0.513 0.000 0.218 629 A C 2.151 179.849 177.584 0.190 0.000 1.181 629 A CA 1.392 53.563 52.037 0.224 0.000 0.627 629 A CB -0.746 18.410 19.000 0.261 0.000 0.818 629 A HN 0.338 8.488 8.150 -0.000 0.000 0.445 630 L N -0.003 121.288 121.223 0.113 0.000 2.042 630 L HA -0.154 3.878 4.340 -0.513 0.000 0.210 630 L C 2.377 179.295 176.870 0.080 0.000 1.076 630 L CA 2.047 56.934 54.840 0.078 0.000 0.749 630 L CB -0.539 41.523 42.059 0.005 0.000 0.893 630 L HN 0.166 8.396 8.230 -0.000 0.000 0.432 631 V N 0.058 120.023 119.914 0.085 0.000 2.255 631 V HA -0.266 3.547 4.120 -0.513 0.000 0.247 631 V C 2.617 178.781 176.094 0.115 0.000 1.051 631 V CA 2.108 64.460 62.300 0.087 0.000 1.018 631 V CB -0.758 31.122 31.823 0.094 0.000 0.641 631 V HN 0.505 8.695 8.190 -0.000 0.000 0.445 632 E N -0.245 120.066 120.200 0.185 0.000 2.150 632 E HA -0.159 3.884 4.350 -0.513 0.000 0.193 632 E C 2.166 178.871 176.600 0.175 0.000 0.985 632 E CA 1.175 57.732 56.400 0.262 0.000 0.814 632 E CB -0.314 29.638 29.700 0.420 0.000 0.752 632 E HN 0.578 8.938 8.360 -0.000 0.000 0.466 633 I N 1.957 122.643 120.570 0.194 0.000 2.208 633 I HA -0.286 3.576 4.170 -0.513 0.000 0.245 633 I C 2.118 178.291 176.117 0.093 0.000 1.097 633 I CA 1.032 62.457 61.300 0.208 0.000 1.363 633 I CB -0.254 37.940 38.000 0.322 0.000 1.051 633 I HN 0.082 8.292 8.210 -0.000 0.000 0.413 634 N N 0.525 119.256 118.700 0.052 0.000 2.331 634 N HA -0.044 4.389 4.740 -0.513 0.000 0.180 634 N C 1.953 177.447 175.510 -0.026 0.000 1.019 634 N CA 1.079 54.122 53.050 -0.011 0.000 0.881 634 N CB 0.087 38.552 38.487 -0.035 0.000 0.972 634 N HN 0.372 8.752 8.380 -0.000 0.000 0.435 635 I N 1.425 121.973 120.570 -0.037 0.000 2.226 635 I HA -0.236 3.626 4.170 -0.513 0.000 0.245 635 I C 2.498 178.506 176.117 -0.182 0.000 1.100 635 I CA 0.820 62.047 61.300 -0.123 0.000 1.374 635 I CB -0.266 37.603 38.000 -0.218 0.000 1.057 635 I HN 0.049 8.259 8.210 -0.000 0.000 0.413 636 A N 0.468 123.145 122.820 -0.239 0.000 1.877 636 A HA -0.165 3.848 4.320 -0.513 0.000 0.216 636 A C 2.442 180.030 177.584 0.006 0.000 1.186 636 A CA 1.845 53.739 52.037 -0.239 0.000 0.620 636 A CB -1.037 17.613 19.000 -0.583 0.000 0.822 636 A HN 0.224 8.374 8.150 -0.000 0.000 0.443 637 V N 0.251 120.182 119.914 0.028 0.000 2.255 637 V HA -0.305 3.507 4.120 -0.513 0.000 0.247 637 V C 2.616 178.746 176.094 0.060 0.000 1.051 637 V CA 2.182 64.521 62.300 0.065 0.000 1.018 637 V CB -0.850 30.908 31.823 -0.109 0.000 0.641 637 V HN 0.578 8.768 8.190 -0.000 0.000 0.445 638 L N -1.345 119.871 121.223 -0.012 0.000 2.017 638 L HA -0.232 3.800 4.340 -0.513 0.000 0.208 638 L C 2.522 179.440 176.870 0.081 0.000 1.073 638 L CA 2.308 57.151 54.840 0.004 0.000 0.745 638 L CB -0.794 41.263 42.059 -0.003 0.000 0.894 638 L HN 0.440 8.670 8.230 -0.000 0.000 0.432 639 Y N 0.680 120.949 120.300 -0.052 0.000 2.128 639 Y HA -0.281 3.962 4.550 -0.512 0.000 0.284 639 Y C 2.777 178.679 175.900 0.004 0.000 1.154 639 Y CA 1.851 59.913 58.100 -0.064 0.000 1.149 639 Y CB -0.258 38.101 38.460 -0.169 0.000 0.976 639 Y HN 0.070 8.350 8.280 -0.000 0.000 0.505 640 S N 0.246 115.960 115.700 0.023 0.000 2.356 640 S HA -0.177 3.985 4.470 -0.513 0.000 0.223 640 S C 1.751 176.331 174.600 -0.033 0.000 1.032 640 S CA 1.587 59.770 58.200 -0.029 0.000 1.005 640 S CB -0.767 62.517 63.200 0.140 0.000 0.867 640 S HN 0.451 8.761 8.310 -0.000 0.000 0.449 641 F N 1.945 121.841 119.950 -0.089 0.000 2.134 641 F HA -0.107 4.112 4.527 -0.513 0.000 0.299 641 F C 2.665 178.401 175.800 -0.106 0.000 1.097 641 F CA 1.104 59.066 58.000 -0.063 0.000 1.264 641 F CB -0.757 38.229 39.000 -0.022 0.000 1.001 641 F HN 0.203 8.503 8.300 -0.000 0.000 0.479 642 Q N -0.521 119.311 119.800 0.055 0.000 2.061 642 Q HA -0.183 3.849 4.340 -0.513 0.000 0.204 642 Q C 2.350 178.256 176.000 -0.158 0.000 0.984 642 Q CA 2.034 57.802 55.803 -0.059 0.000 0.846 642 Q CB -0.443 28.253 28.738 -0.070 0.000 0.902 642 Q HN 0.255 8.525 8.270 -0.000 0.000 0.421 643 S N 0.863 116.381 115.700 -0.304 0.000 2.399 643 S HA -0.112 4.050 4.470 -0.513 0.000 0.231 643 S C 0.889 175.373 174.600 -0.194 0.000 1.022 643 S CA 1.168 59.171 58.200 -0.328 0.000 0.983 643 S CB -0.054 62.822 63.200 -0.540 0.000 0.803 643 S HN 0.327 8.637 8.310 -0.000 0.000 0.480 644 D N 0.456 120.754 120.400 -0.171 0.000 2.339 644 D HA 0.170 4.503 4.640 -0.513 0.000 0.217 644 D C 0.071 176.306 176.300 -0.107 0.000 1.050 644 D CA 0.137 54.054 54.000 -0.138 0.000 0.856 644 D CB 0.015 40.713 40.800 -0.170 0.000 0.922 644 D HN 0.173 8.543 8.370 -0.000 0.000 0.518 645 K N -0.391 119.954 120.400 -0.091 0.000 3.096 645 K HA -0.136 3.876 4.320 -0.513 0.000 0.266 645 K C -0.852 175.719 176.600 -0.048 0.000 1.043 645 K CA 0.163 56.411 56.287 -0.065 0.000 0.758 645 K CB -1.501 30.961 32.500 -0.063 0.000 1.260 645 K HN 0.009 8.259 8.250 -0.000 0.000 0.481 646 V N 1.219 121.117 119.914 -0.027 0.000 2.370 646 V HA 0.169 3.982 4.120 -0.513 0.000 0.279 646 V C 0.858 177.031 176.094 0.130 0.000 1.029 646 V CA -0.763 61.560 62.300 0.037 0.000 0.870 646 V CB 1.689 33.495 31.823 -0.028 0.000 0.984 646 V HN 0.304 8.494 8.190 -0.000 0.000 0.451 647 T N 6.507 121.078 114.554 0.029 0.000 2.933 647 T HA 0.344 4.387 4.350 -0.513 0.000 0.306 647 T C -0.206 174.527 174.700 0.055 0.000 1.045 647 T CA 0.829 62.864 62.100 -0.108 0.000 1.143 647 T CB 0.198 68.834 68.868 -0.387 0.000 1.003 647 T HN 0.613 8.853 8.240 -0.000 0.000 0.540 648 I N 1.894 122.445 120.570 -0.031 0.000 2.984 648 I HA 0.638 4.500 4.170 -0.513 0.000 0.303 648 I C -1.588 174.534 176.117 0.009 0.000 1.381 648 I CA -0.999 60.320 61.300 0.032 0.000 0.988 648 I CB 1.990 39.924 38.000 -0.109 0.000 1.307 648 I HN 0.482 8.692 8.210 -0.000 0.000 0.460 649 V N 5.558 125.543 119.914 0.118 0.000 2.789 649 V HA 0.501 4.314 4.120 -0.513 0.000 0.311 649 V C -1.106 175.041 176.094 0.088 0.000 1.073 649 V CA -0.404 61.969 62.300 0.122 0.000 0.921 649 V CB 2.090 34.074 31.823 0.268 0.000 1.009 649 V HN 0.837 9.027 8.190 -0.000 0.000 0.426 650 D N 4.803 125.241 120.400 0.064 0.000 2.387 650 D HA 0.149 4.481 4.640 -0.513 0.000 0.251 650 D C 0.721 177.042 176.300 0.035 0.000 1.141 650 D CA -0.132 53.905 54.000 0.060 0.000 0.987 650 D CB 0.836 41.656 40.800 0.033 0.000 1.116 650 D HN 0.807 9.177 8.370 -0.000 0.000 0.491 651 H N -0.441 118.571 119.070 -0.097 0.000 2.436 651 H HA -0.080 4.169 4.556 -0.513 0.000 0.294 651 H C 1.491 176.736 175.328 -0.137 0.000 1.048 651 H CA 0.922 56.882 56.048 -0.146 0.000 1.353 651 H CB -0.684 28.939 29.762 -0.231 0.000 1.414 651 H HN 0.497 8.777 8.280 -0.000 0.000 0.536 652 H N 1.134 119.957 119.070 -0.412 0.000 2.290 652 H HA -0.121 4.127 4.556 -0.512 0.000 0.298 652 H C 2.488 177.785 175.328 -0.053 0.000 1.087 652 H CA 1.799 57.726 56.048 -0.201 0.000 1.291 652 H CB -0.299 29.322 29.762 -0.235 0.000 1.369 652 H HN 0.448 8.728 8.280 -0.000 0.000 0.492 653 S N 0.719 116.473 115.700 0.090 0.000 2.368 653 S HA -0.069 4.094 4.470 -0.513 0.000 0.224 653 S C 2.453 177.123 174.600 0.116 0.000 1.029 653 S CA 1.071 59.326 58.200 0.092 0.000 0.988 653 S CB -0.301 62.943 63.200 0.074 0.000 0.838 653 S HN 0.449 8.759 8.310 -0.000 0.000 0.462 654 A N 1.327 124.217 122.820 0.116 0.000 1.883 654 A HA -0.088 3.924 4.320 -0.513 0.000 0.217 654 A C 2.563 180.245 177.584 0.164 0.000 1.186 654 A CA 2.563 54.689 52.037 0.148 0.000 0.624 654 A CB -1.809 17.269 19.000 0.131 0.000 0.822 654 A HN 0.820 8.970 8.150 -0.000 0.000 0.444 655 T N -2.243 112.393 114.554 0.136 0.000 2.821 655 T HA -0.131 3.912 4.350 -0.513 0.000 0.267 655 T C 1.769 176.603 174.700 0.223 0.000 1.046 655 T CA 1.375 63.581 62.100 0.177 0.000 1.139 655 T CB -0.386 68.552 68.868 0.118 0.000 0.871 655 T HN 0.589 8.829 8.240 -0.000 0.000 0.454 656 E N 1.127 121.427 120.200 0.166 0.000 2.070 656 E HA -0.175 3.867 4.350 -0.513 0.000 0.197 656 E C 2.383 179.069 176.600 0.145 0.000 1.004 656 E CA 1.473 57.959 56.400 0.142 0.000 0.805 656 E CB -0.286 29.478 29.700 0.107 0.000 0.744 656 E HN 0.520 8.880 8.360 -0.000 0.000 0.451 657 S N -0.111 115.685 115.700 0.159 0.000 2.382 657 S HA -0.145 4.018 4.470 -0.513 0.000 0.228 657 S C 1.450 176.165 174.600 0.192 0.000 1.027 657 S CA 1.047 59.340 58.200 0.156 0.000 0.991 657 S CB -0.369 62.928 63.200 0.162 0.000 0.823 657 S HN 0.387 8.697 8.310 -0.000 0.000 0.469 658 F N 1.885 121.903 119.950 0.112 0.000 2.259 658 F HA -0.008 4.212 4.527 -0.513 0.000 0.298 658 F C 1.725 177.622 175.800 0.162 0.000 1.088 658 F CA 0.804 58.891 58.000 0.145 0.000 1.358 658 F CB -0.156 38.910 39.000 0.110 0.000 1.040 658 F HN 0.093 8.393 8.300 -0.000 0.000 0.505 659 I N 0.792 121.405 120.570 0.070 0.000 2.226 659 I HA -0.266 3.596 4.170 -0.513 0.000 0.245 659 I C 2.422 178.491 176.117 -0.080 0.000 1.100 659 I CA 1.300 62.588 61.300 -0.020 0.000 1.374 659 I CB -1.295 36.759 38.000 0.091 0.000 1.057 659 I HN 0.195 8.405 8.210 -0.000 0.000 0.413 660 K N -0.154 120.238 120.400 -0.014 0.000 2.063 660 K HA -0.271 3.741 4.320 -0.513 0.000 0.208 660 K C 2.263 178.841 176.600 -0.038 0.000 1.048 660 K CA 1.752 58.035 56.287 -0.007 0.000 0.928 660 K CB -0.188 32.334 32.500 0.037 0.000 0.713 660 K HN 0.337 8.587 8.250 -0.000 0.000 0.442 661 H N -0.055 118.915 119.070 -0.166 0.000 2.428 661 H HA 0.046 4.294 4.556 -0.512 0.000 0.296 661 H C 1.972 177.138 175.328 -0.271 0.000 1.062 661 H CA 1.601 57.534 56.048 -0.192 0.000 1.350 661 H CB 0.108 29.764 29.762 -0.177 0.000 1.403 661 H HN 0.105 8.385 8.280 -0.000 0.000 0.533 662 M N 0.148 119.430 119.600 -0.530 0.000 2.067 662 M HA -0.164 4.008 4.480 -0.513 0.000 0.260 662 M C 2.093 178.343 176.300 -0.083 0.000 1.069 662 M CA 2.036 57.134 55.300 -0.337 0.000 1.117 662 M CB -0.133 32.315 32.600 -0.252 0.000 1.334 662 M HN 0.445 8.735 8.290 -0.000 0.000 0.407 663 E N 0.269 120.410 120.200 -0.099 0.000 2.049 663 E HA -0.234 3.809 4.350 -0.513 0.000 0.198 663 E C 1.716 178.299 176.600 -0.029 0.000 1.007 663 E CA 1.444 57.819 56.400 -0.041 0.000 0.809 663 E CB -0.463 29.206 29.700 -0.052 0.000 0.749 663 E HN 0.530 8.890 8.360 -0.000 0.000 0.450 664 N N 0.814 119.464 118.700 -0.083 0.000 2.104 664 N HA -0.168 4.264 4.740 -0.513 0.000 0.190 664 N C 1.714 177.158 175.510 -0.110 0.000 1.024 664 N CA 1.012 54.017 53.050 -0.076 0.000 0.853 664 N CB -0.235 38.217 38.487 -0.057 0.000 1.008 664 N HN 0.200 8.580 8.380 -0.000 0.000 0.424 665 E N 0.423 120.482 120.200 -0.235 0.000 2.077 665 E HA -0.133 3.909 4.350 -0.513 0.000 0.193 665 E C 1.984 178.457 176.600 -0.212 0.000 0.989 665 E CA 0.790 57.025 56.400 -0.277 0.000 0.800 665 E CB -0.533 28.889 29.700 -0.463 0.000 0.746 665 E HN 0.497 8.857 8.360 -0.000 0.000 0.452 666 Y N 0.927 121.134 120.300 -0.155 0.000 2.224 666 Y HA -0.165 4.077 4.550 -0.513 0.000 0.289 666 Y C 2.672 178.520 175.900 -0.087 0.000 1.146 666 Y CA 1.652 59.691 58.100 -0.101 0.000 1.182 666 Y CB -0.127 38.281 38.460 -0.086 0.000 0.983 666 Y HN -0.021 8.259 8.280 -0.000 0.000 0.524 667 R N -1.351 119.180 120.500 0.051 0.000 2.119 667 R HA -0.085 3.947 4.340 -0.513 0.000 0.222 667 R C 1.665 177.953 176.300 -0.020 0.000 1.088 667 R CA 1.581 57.689 56.100 0.014 0.000 0.984 667 R CB -0.439 29.864 30.300 0.005 0.000 0.884 667 R HN 0.341 8.611 8.270 -0.000 0.000 0.447 668 C N -1.269 118.005 119.300 -0.042 0.000 2.609 668 C HA 0.320 4.472 4.460 -0.513 0.000 0.305 668 C C 2.275 177.228 174.990 -0.061 0.000 1.319 668 C CA -0.121 58.873 59.018 -0.040 0.000 1.793 668 C CB -0.181 27.547 27.740 -0.019 0.000 2.260 668 C HN 0.469 8.699 8.230 -0.000 0.000 0.535 669 R N -0.209 120.227 120.500 -0.107 0.000 2.419 669 R HA 0.239 4.271 4.340 -0.513 0.000 0.235 669 R C 1.355 177.556 176.300 -0.166 0.000 0.899 669 R CA 0.902 56.923 56.100 -0.130 0.000 1.048 669 R CB 0.375 30.576 30.300 -0.166 0.000 1.182 669 R HN 0.460 8.730 8.270 -0.000 0.000 0.544 670 G N -0.163 108.527 108.800 -0.183 0.000 2.159 670 G HA2 -0.183 3.470 3.960 -0.513 0.000 0.256 670 G HA3 -0.183 3.470 3.960 -0.513 0.000 0.256 670 G C 0.185 174.864 174.900 -0.368 0.000 0.977 670 G CA 0.082 45.055 45.100 -0.212 0.000 0.652 670 G HN 0.808 9.098 8.290 -0.000 0.000 0.531 671 G N -2.371 106.058 108.800 -0.619 0.000 2.359 671 G HA2 0.520 4.173 3.960 -0.513 0.000 0.293 671 G HA3 0.520 4.173 3.960 -0.513 0.000 0.293 671 G C -0.833 173.606 174.900 -0.769 0.000 1.300 671 G CA 0.473 44.852 45.100 -1.202 0.000 0.888 671 G HN 1.926 10.216 8.290 -0.000 0.000 0.541 672 C N 2.046 120.981 119.300 -0.607 0.000 2.833 672 C HA 0.695 4.847 4.460 -0.513 0.000 0.383 672 C C -2.560 172.347 174.990 -0.137 0.000 1.058 672 C CA -1.156 57.715 59.018 -0.246 0.000 1.259 672 C CB 1.112 28.753 27.740 -0.165 0.000 1.726 672 C HN 0.707 8.937 8.230 -0.000 0.000 0.484 673 P HA 0.391 4.811 4.420 -0.000 0.000 0.271 673 P C -0.645 176.555 177.300 -0.167 0.000 1.226 673 P CA 0.610 63.335 63.100 -0.625 0.000 0.765 673 P CB 1.026 32.187 31.700 -0.900 0.000 0.835 674 A N 2.746 125.536 122.820 -0.050 0.000 2.427 674 A HA 0.395 4.407 4.320 -0.513 0.000 0.298 674 A C -0.912 176.720 177.584 0.081 0.000 1.036 674 A CA -0.557 51.536 52.037 0.094 0.000 0.701 674 A CB 1.180 20.366 19.000 0.310 0.000 1.250 674 A HN 0.427 8.577 8.150 -0.000 0.000 0.412 675 D N 2.191 122.623 120.400 0.054 0.000 2.456 675 D HA 0.114 4.447 4.640 -0.513 0.000 0.219 675 D C 0.806 177.235 176.300 0.215 0.000 1.126 675 D CA -0.427 53.636 54.000 0.105 0.000 0.890 675 D CB 0.299 41.097 40.800 -0.004 0.000 1.025 675 D HN 0.632 9.002 8.370 -0.000 0.000 0.511 676 W N 3.925 125.262 121.300 0.062 0.000 2.325 676 W HA -0.249 4.103 4.660 -0.512 0.000 0.299 676 W C 1.632 178.198 176.519 0.078 0.000 1.215 676 W CA 0.981 58.357 57.345 0.051 0.000 1.244 676 W CB 0.134 29.603 29.460 0.015 0.000 1.140 676 W HN 0.284 8.464 8.180 -0.000 0.000 0.523 677 V N -0.354 119.880 119.914 0.534 0.000 2.469 677 V HA -0.307 3.505 4.120 -0.513 0.000 0.251 677 V C 1.415 177.652 176.094 0.239 0.000 1.064 677 V CA 2.063 64.629 62.300 0.444 0.000 1.066 677 V CB -0.829 31.265 31.823 0.452 0.000 0.667 677 V HN 0.317 8.507 8.190 -0.000 0.000 0.461 678 W N -1.759 119.531 121.300 -0.018 0.000 2.808 678 W HA 0.285 4.637 4.660 -0.514 0.000 0.266 678 W C 2.125 178.550 176.519 -0.156 0.000 1.247 678 W CA -0.273 57.031 57.345 -0.068 0.000 1.440 678 W CB -0.143 29.293 29.460 -0.041 0.000 1.040 678 W HN 0.052 8.232 8.180 -0.000 0.000 0.606 679 I N 0.219 120.782 120.570 -0.012 0.000 2.202 679 I HA -0.118 3.744 4.170 -0.513 0.000 0.242 679 I C 0.732 176.681 176.117 -0.279 0.000 1.091 679 I CA 0.903 62.072 61.300 -0.217 0.000 1.368 679 I CB -1.661 36.135 38.000 -0.340 0.000 1.058 679 I HN -0.416 7.794 8.210 -0.000 0.000 0.410 680 V N 4.267 123.919 119.914 -0.436 0.000 2.475 680 V HA -0.002 3.810 4.120 -0.513 0.000 0.292 680 V C -1.881 174.060 176.094 -0.256 0.000 1.003 680 V CA -0.888 61.144 62.300 -0.447 0.000 1.120 680 V CB -0.701 30.610 31.823 -0.853 0.000 0.937 680 V HN 0.169 8.359 8.190 -0.000 0.000 0.476 681 P HA 0.022 4.442 4.420 -0.000 0.000 0.264 681 P C -1.729 175.460 177.300 -0.185 0.000 1.179 681 P CA -0.812 62.189 63.100 -0.164 0.000 0.763 681 P CB 0.002 31.623 31.700 -0.131 0.000 0.806 682 P HA -0.038 4.382 4.420 -0.000 0.000 0.239 682 P C 0.122 177.318 177.300 -0.174 0.000 1.184 682 P CA 1.209 64.202 63.100 -0.178 0.000 0.760 682 P CB 0.007 31.595 31.700 -0.187 0.000 0.884 683 M N -4.166 115.297 119.600 -0.228 0.000 2.518 683 M HA 0.533 4.706 4.480 -0.513 0.000 0.300 683 M C -0.258 175.936 176.300 -0.177 0.000 1.175 683 M CA -0.567 54.607 55.300 -0.210 0.000 0.890 683 M CB 2.135 34.578 32.600 -0.262 0.000 1.710 683 M HN -0.348 7.942 8.290 -0.000 0.000 0.453 684 S N 0.930 116.571 115.700 -0.098 0.000 3.533 684 S HA -0.189 3.974 4.470 -0.513 0.000 0.347 684 S C 1.114 175.677 174.600 -0.061 0.000 1.101 684 S CA 0.836 59.011 58.200 -0.042 0.000 1.009 684 S CB -2.112 61.128 63.200 0.066 0.000 0.916 684 S HN 1.227 9.537 8.310 -0.000 0.000 0.496 685 G N 2.431 111.170 108.800 -0.102 0.000 2.681 685 G HA2 -0.367 3.286 3.960 -0.513 0.000 0.220 685 G HA3 -0.367 3.286 3.960 -0.513 0.000 0.220 685 G C 1.466 176.240 174.900 -0.211 0.000 1.210 685 G CA 1.705 46.755 45.100 -0.084 0.000 0.783 685 G HN 1.372 9.662 8.290 -0.000 0.000 0.609 686 S N 0.701 115.975 115.700 -0.710 0.000 2.595 686 S HA 0.037 4.199 4.470 -0.513 0.000 0.235 686 S C 2.075 176.637 174.600 -0.065 0.000 0.974 686 S CA 1.049 58.687 58.200 -0.937 0.000 0.942 686 S CB -0.427 62.028 63.200 -1.242 0.000 0.766 686 S HN 0.817 9.127 8.310 -0.000 0.000 0.536 687 I N 0.109 120.683 120.570 0.006 0.000 3.956 687 I HA 0.260 4.123 4.170 -0.513 0.000 0.333 687 I C 0.291 176.530 176.117 0.203 0.000 1.302 687 I CA -0.308 61.073 61.300 0.133 0.000 1.122 687 I CB -0.333 37.742 38.000 0.124 0.000 1.013 687 I HN 0.225 8.435 8.210 -0.000 0.000 0.405 688 T N -1.222 113.447 114.554 0.192 0.000 2.902 688 T HA 0.468 4.510 4.350 -0.513 0.000 0.283 688 T C -1.669 173.205 174.700 0.289 0.000 1.009 688 T CA -1.841 60.379 62.100 0.200 0.000 1.051 688 T CB 1.623 70.560 68.868 0.114 0.000 0.999 688 T HN -0.074 8.166 8.240 -0.000 0.000 0.474 689 P HA -0.033 4.387 4.420 -0.000 0.000 0.222 689 P C 1.885 179.391 177.300 0.343 0.000 1.153 689 P CA 0.680 63.968 63.100 0.312 0.000 0.798 689 P CB -0.368 31.455 31.700 0.204 0.000 0.796 690 V N -3.369 116.692 119.914 0.245 0.000 2.568 690 V HA -0.236 3.576 4.120 -0.513 0.000 0.253 690 V C 2.293 178.462 176.094 0.125 0.000 1.072 690 V CA 1.408 63.809 62.300 0.170 0.000 1.084 690 V CB -2.292 29.554 31.823 0.039 0.000 0.676 690 V HN -0.116 8.074 8.190 -0.000 0.000 0.469 691 F N 1.768 121.721 119.950 0.006 0.000 2.161 691 F HA -0.154 4.066 4.527 -0.513 0.000 0.300 691 F C 2.468 178.404 175.800 0.227 0.000 1.089 691 F CA 2.287 60.282 58.000 -0.009 0.000 1.282 691 F CB -0.294 38.580 39.000 -0.210 0.000 1.010 691 F HN 0.291 8.591 8.300 -0.000 0.000 0.485 692 H N -1.341 118.016 119.070 0.479 0.000 2.539 692 H HA 0.101 4.349 4.556 -0.513 0.000 0.269 692 H C 0.323 175.881 175.328 0.384 0.000 0.980 692 H CA 0.147 56.450 56.048 0.425 0.000 1.152 692 H CB -0.036 29.969 29.762 0.405 0.000 1.407 692 H HN 0.219 8.499 8.280 -0.000 0.000 0.564 693 Q N 2.153 122.219 119.800 0.443 0.000 2.360 693 Q HA 0.125 4.158 4.340 -0.513 0.000 0.254 693 Q C -0.584 175.644 176.000 0.381 0.000 0.975 693 Q CA -0.333 55.679 55.803 0.348 0.000 0.912 693 Q CB 0.518 29.432 28.738 0.293 0.000 1.212 693 Q HN 0.231 8.501 8.270 -0.000 0.000 0.452 694 E N 3.647 124.022 120.200 0.291 0.000 2.452 694 E HA 0.085 4.128 4.350 -0.513 0.000 0.261 694 E C -0.447 176.285 176.600 0.220 0.000 0.987 694 E CA 0.653 57.183 56.400 0.216 0.000 0.926 694 E CB 0.557 30.360 29.700 0.172 0.000 0.934 694 E HN 0.598 8.958 8.360 -0.000 0.000 0.452 695 M N 2.504 122.248 119.600 0.239 0.000 2.619 695 M HA 0.446 4.618 4.480 -0.513 0.000 0.297 695 M C -0.935 175.483 176.300 0.197 0.000 1.229 695 M CA -0.817 54.633 55.300 0.251 0.000 0.860 695 M CB 1.572 34.364 32.600 0.320 0.000 1.741 695 M HN 0.220 8.510 8.290 -0.000 0.000 0.462 696 L N 1.480 122.836 121.223 0.221 0.000 2.322 696 L HA 0.507 4.540 4.340 -0.513 0.000 0.281 696 L C -0.511 176.457 176.870 0.163 0.000 1.014 696 L CA -0.381 54.592 54.840 0.221 0.000 0.815 696 L CB 1.617 43.856 42.059 0.301 0.000 1.247 696 L HN 0.719 8.949 8.230 -0.000 0.000 0.421 697 N N 2.767 121.549 118.700 0.137 0.000 2.400 697 N HA 0.573 5.005 4.740 -0.513 0.000 0.288 697 N C -1.708 173.871 175.510 0.116 0.000 1.024 697 N CA -0.394 52.664 53.050 0.013 0.000 0.894 697 N CB 1.308 39.815 38.487 0.032 0.000 1.173 697 N HN 0.504 8.884 8.380 -0.000 0.000 0.487 698 Y N -0.063 120.256 120.300 0.032 0.000 2.677 698 Y HA 0.457 4.699 4.550 -0.512 0.000 0.334 698 Y C -1.415 174.493 175.900 0.014 0.000 1.196 698 Y CA -1.341 56.776 58.100 0.029 0.000 1.059 698 Y CB 0.800 39.291 38.460 0.052 0.000 1.315 698 Y HN 0.202 8.482 8.280 -0.000 0.000 0.455 699 R N 2.540 123.151 120.500 0.185 0.000 2.246 699 R HA 0.603 4.635 4.340 -0.513 0.000 0.332 699 R C -1.285 175.088 176.300 0.121 0.000 0.974 699 R CA -0.608 55.542 56.100 0.083 0.000 0.837 699 R CB 1.386 31.716 30.300 0.051 0.000 1.145 699 R HN 0.684 8.954 8.270 -0.000 0.000 0.467 700 L N 0.922 122.192 121.223 0.079 0.000 2.332 700 L HA 0.536 4.568 4.340 -0.513 0.000 0.269 700 L C 0.569 177.457 176.870 0.029 0.000 1.016 700 L CA -0.705 54.180 54.840 0.076 0.000 0.809 700 L CB 2.011 44.113 42.059 0.071 0.000 1.280 700 L HN 0.436 8.666 8.230 -0.000 0.000 0.447 701 T N 0.881 115.460 114.554 0.041 0.000 2.887 701 T HA 0.527 4.569 4.350 -0.513 0.000 0.288 701 T C -2.603 172.140 174.700 0.072 0.000 1.021 701 T CA -1.719 60.398 62.100 0.028 0.000 1.000 701 T CB 1.912 70.800 68.868 0.033 0.000 1.034 701 T HN 0.218 8.458 8.240 -0.000 0.000 0.467 702 P HA 0.248 4.668 4.420 -0.000 0.000 0.268 702 P C -1.167 176.047 177.300 -0.144 0.000 1.208 702 P CA -0.128 62.932 63.100 -0.067 0.000 0.777 702 P CB 0.438 32.084 31.700 -0.090 0.000 0.875 703 S N 0.146 115.710 115.700 -0.227 0.000 2.579 703 S HA 0.669 4.831 4.470 -0.513 0.000 0.272 703 S C -1.232 173.135 174.600 -0.390 0.000 1.141 703 S CA -0.830 57.231 58.200 -0.231 0.000 0.843 703 S CB 0.854 64.000 63.200 -0.090 0.000 1.122 703 S HN 0.147 8.457 8.310 -0.000 0.000 0.468 704 F N 1.147 121.061 119.950 -0.060 0.000 2.420 704 F HA 0.624 4.843 4.527 -0.514 0.000 0.342 704 F C 0.753 176.537 175.800 -0.026 0.000 1.113 704 F CA -0.293 57.679 58.000 -0.047 0.000 1.059 704 F CB 1.386 40.324 39.000 -0.103 0.000 1.128 704 F HN 0.471 8.771 8.300 -0.000 0.000 0.475 705 E N 1.608 121.914 120.200 0.176 0.000 2.288 705 E HA 0.576 4.619 4.350 -0.513 0.000 0.268 705 E C -0.723 175.929 176.600 0.086 0.000 0.885 705 E CA -0.954 55.498 56.400 0.087 0.000 0.767 705 E CB 2.185 31.910 29.700 0.041 0.000 1.220 705 E HN 0.617 8.977 8.360 -0.000 0.000 0.427 706 A N 2.193 125.035 122.820 0.038 0.000 2.366 706 A HA 0.417 4.429 4.320 -0.513 0.000 0.249 706 A C 0.041 177.624 177.584 -0.003 0.000 1.084 706 A CA 0.019 52.066 52.037 0.017 0.000 0.794 706 A CB 0.274 19.274 19.000 -0.000 0.000 1.034 706 A HN 0.608 8.758 8.150 -0.000 0.000 0.491 707 Q N 0.264 120.045 119.800 -0.033 0.000 2.534 707 Q HA 0.647 4.679 4.340 -0.513 0.000 0.290 707 Q C -3.036 172.888 176.000 -0.127 0.000 0.991 707 Q CA -1.866 53.899 55.803 -0.063 0.000 0.783 707 Q CB 1.022 29.732 28.738 -0.046 0.000 1.470 707 Q HN 0.493 8.763 8.270 -0.000 0.000 0.406 708 P HA 0.100 4.520 4.420 -0.000 0.000 0.271 708 P C -0.772 176.293 177.300 -0.392 0.000 1.216 708 P CA -0.047 62.911 63.100 -0.237 0.000 0.771 708 P CB 0.380 31.958 31.700 -0.203 0.000 0.864 709 D N 4.353 124.410 120.400 -0.573 0.000 2.586 709 D HA -0.060 4.273 4.640 -0.513 0.000 0.234 709 D C -1.302 174.327 176.300 -1.118 0.000 1.132 709 D CA -0.451 52.916 54.000 -1.056 0.000 0.860 709 D CB 0.178 39.921 40.800 -1.761 0.000 1.159 709 D HN 0.240 8.610 8.370 -0.000 0.000 0.490 710 P HA -0.131 4.289 4.420 -0.000 0.000 0.221 710 P C 1.205 177.965 177.300 -0.899 0.000 1.145 710 P CA 1.049 63.531 63.100 -1.030 0.000 0.795 710 P CB -0.017 30.647 31.700 -1.727 0.000 0.775 711 W N -1.162 119.710 121.300 -0.714 0.000 2.518 711 W HA 0.115 4.465 4.660 -0.517 0.000 0.273 711 W C 1.348 177.860 176.519 -0.011 0.000 1.247 711 W CA 0.275 57.468 57.345 -0.252 0.000 1.288 711 W CB -2.013 27.480 29.460 0.055 0.000 1.107 711 W HN -0.191 7.989 8.180 -0.000 0.000 0.586 712 N N 0.546 119.077 118.700 -0.282 0.000 2.453 712 N HA -0.070 4.362 4.740 -0.513 0.000 0.183 712 N C 1.123 176.592 175.510 -0.068 0.000 1.041 712 N CA 1.866 54.847 53.050 -0.115 0.000 0.900 712 N CB -0.216 38.124 38.487 -0.245 0.000 0.961 712 N HN 0.304 8.684 8.380 -0.000 0.000 0.443 713 T N -1.476 113.006 114.554 -0.121 0.000 3.098 713 T HA 0.002 4.044 4.350 -0.513 0.000 0.246 713 T C 0.365 175.043 174.700 -0.038 0.000 0.983 713 T CA -0.208 61.839 62.100 -0.088 0.000 1.094 713 T CB 0.117 68.898 68.868 -0.145 0.000 1.035 713 T HN 0.217 8.457 8.240 -0.000 0.000 0.456 714 H N 2.576 121.558 119.070 -0.147 0.000 2.871 714 H HA 0.348 4.600 4.556 -0.507 0.000 0.355 714 H C -0.436 174.812 175.328 -0.132 0.000 1.092 714 H CA 0.018 55.965 56.048 -0.170 0.000 1.420 714 H CB 0.450 30.074 29.762 -0.229 0.000 1.400 714 H HN 0.083 8.363 8.280 -0.000 0.000 0.604 715 V N 2.699 122.080 119.914 -0.888 0.000 2.604 715 V HA 0.448 4.261 4.120 -0.513 0.000 0.305 715 V C -0.884 174.827 176.094 -0.639 0.000 1.043 715 V CA -1.053 60.963 62.300 -0.473 0.000 0.888 715 V CB 0.900 32.635 31.823 -0.146 0.000 0.995 715 V HN 0.701 8.891 8.190 -0.000 0.000 0.429 716 W N 0.000 121.199 121.300 -0.168 0.000 2.388 716 W HA 0.000 4.347 4.660 -0.522 0.000 0.303 716 W CA 0.000 57.346 57.345 0.001 0.000 1.226 716 W CB 0.000 29.525 29.460 0.108 0.000 1.126 716 W HN 0.000 8.180 8.180 -0.000 0.000 0.535