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 1s5n_1_A DATA FIRST_RESID 1 DATA SEQUENCE SYQPTPEDRF TFGLWTVGWQ GRDPFGDATR PALDPVETVQ RLAELGAHGV DATA SEQUENCE TFHDDDLIPF GSSDTERESH IKRFRQALDA TGMTVPMATT NLFTHPVFKD DATA SEQUENCE GGFTANDRDV RRYALRKTIR NIDLAVELGA KTYVAWGGRE GAESGAAKDV DATA SEQUENCE RVALDRMKEA FDLLGEYVTS QGYDIRFAIE PKPNEPRGDI LLPTVGHALA DATA SEQUENCE FIERLERPEL YGVNPEVGHE QMAGLNFPHG IAQALWAGKL FHIDLNGQSG DATA SEQUENCE IKYDQDLRFG AGDLRAAFWL VDLLESAGYE GPRHFDFKPP RTEDIDGVWA DATA SEQUENCE SAAGCMRNYL ILKERAAAFR ADPEVQEALR ASRLDELAQP TAADGVQELL DATA SEQUENCE ADRTAFEDFD VDAAAARGMA FERLDQLAMD HLLGAR VARS RESID RESNAME ATOMNAME SS_SHIFT SHIFT RC_SHIFT HM_SHIFT EF_SHIFT SIGMA FORMAT %4d %4s %4s %9.3f %9.3f %9.3f %9.3f %9.3f %9.3f 1 S HA 0.000 4.297 4.470 -0.288 0.000 0.327 1 S C 0.000 174.541 174.600 -0.098 0.000 1.055 1 S CA 0.000 58.056 58.200 -0.241 0.000 1.107 1 S CB 0.000 62.971 63.200 -0.381 0.000 0.593 2 Y N -2.698 117.644 120.300 0.070 0.000 3.389 2 Y HA -0.419 4.200 4.550 0.115 0.000 0.213 2 Y C -2.117 173.842 175.900 0.097 0.000 1.272 2 Y CA 0.634 58.789 58.100 0.092 0.000 1.444 2 Y CB -1.361 37.145 38.460 0.077 0.000 1.445 2 Y HN 0.600 8.613 8.280 -0.444 0.000 0.583 3 Q N -0.641 119.260 119.800 0.168 0.000 2.377 3 Q HA 0.181 4.606 4.340 0.143 0.000 0.249 3 Q C -2.026 174.081 176.000 0.178 0.000 1.005 3 Q CA -2.179 53.709 55.803 0.141 0.000 0.912 3 Q CB 0.527 29.314 28.738 0.082 0.000 1.223 3 Q HN -0.346 7.991 8.270 0.112 0.000 0.459 4 P HA 0.159 4.995 4.420 0.376 -0.190 0.271 4 P C -0.680 176.751 177.300 0.219 0.000 1.218 4 P CA -0.711 62.577 63.100 0.314 0.000 0.780 4 P CB 1.108 33.048 31.700 0.399 0.000 0.901 5 T N -2.707 111.965 114.554 0.197 0.000 2.865 5 T HA 0.534 4.963 4.350 0.131 0.000 0.294 5 T C -1.323 173.446 174.700 0.114 0.000 1.119 5 T CA -3.277 58.900 62.100 0.128 0.000 1.007 5 T CB 1.769 70.683 68.868 0.076 0.000 1.225 5 T HN 0.285 8.962 8.240 0.208 -0.312 0.515 6 P HA -0.107 4.427 4.420 0.190 0.000 0.219 6 P C 1.051 178.353 177.300 0.003 0.000 1.146 6 P CA 2.015 65.193 63.100 0.129 0.000 0.808 6 P CB 0.007 31.802 31.700 0.159 0.000 0.779 7 E N -3.514 116.661 120.200 -0.041 0.000 2.267 7 E HA -0.297 3.963 4.350 -0.149 0.000 0.197 7 E C 0.600 177.056 176.600 -0.241 0.000 0.998 7 E CA 1.941 58.264 56.400 -0.128 0.000 0.830 7 E CB -1.172 28.480 29.700 -0.080 0.000 0.751 7 E HN -0.401 7.935 8.360 -0.003 0.022 0.491 8 D N -3.242 116.997 120.400 -0.268 0.000 2.363 8 D HA -0.046 4.320 4.640 -0.458 0.000 0.220 8 D C -0.240 175.566 176.300 -0.823 0.000 0.994 8 D CA 0.580 54.251 54.000 -0.548 0.000 0.890 8 D CB 0.398 40.819 40.800 -0.632 0.000 0.906 8 D HN -0.387 7.728 8.370 -0.163 0.157 0.530 9 R N -6.715 113.428 120.500 -0.595 0.000 3.776 9 R HA -0.506 3.392 4.340 -0.737 0.000 0.312 9 R C -1.572 174.537 176.300 -0.317 0.000 1.181 9 R CA 0.850 56.605 56.100 -0.575 0.000 0.836 9 R CB -2.916 27.038 30.300 -0.578 0.000 1.324 9 R HN -0.551 7.353 8.270 -0.452 0.095 0.501 10 F N -2.400 117.533 119.950 -0.029 0.000 2.456 10 F HA 0.655 5.473 4.527 -0.225 -0.426 0.358 10 F C 0.676 176.532 175.800 0.093 0.000 1.095 10 F CA -0.740 57.246 58.000 -0.024 0.000 1.216 10 F CB 0.378 39.482 39.000 0.172 0.000 1.125 10 F HN -0.438 7.717 8.300 -0.184 0.035 0.549 11 T N -2.128 112.500 114.554 0.124 0.000 2.901 11 T HA 0.862 5.645 4.350 0.396 -0.195 0.293 11 T C -1.341 173.342 174.700 -0.027 0.000 1.084 11 T CA -2.325 59.914 62.100 0.232 0.000 1.008 11 T CB 3.559 72.608 68.868 0.302 0.000 1.170 11 T HN 0.536 8.726 8.240 -0.082 0.000 0.509 12 F N -1.553 118.557 119.950 0.267 0.000 2.591 12 F HA 0.474 5.103 4.527 -0.095 -0.159 0.309 12 F C 0.331 176.145 175.800 0.023 0.000 1.098 12 F CA -1.139 56.912 58.000 0.085 0.000 0.937 12 F CB 4.586 43.690 39.000 0.174 0.000 1.250 12 F HN -0.231 8.388 8.300 0.532 0.000 0.447 13 G N 0.004 108.676 108.800 -0.213 0.000 2.483 13 G HA2 0.178 4.135 3.960 -0.261 0.000 0.248 13 G HA3 0.178 2.805 3.960 -2.223 0.000 0.248 13 G C 0.701 175.408 174.900 -0.321 0.000 1.248 13 G CA -0.621 44.028 45.100 -0.751 0.000 0.838 13 G HN 0.046 8.073 8.290 -0.438 0.000 0.566 14 L N 1.844 123.137 121.223 0.116 0.000 2.127 14 L HA -0.244 4.234 4.340 0.231 0.000 0.211 14 L C 1.331 178.343 176.870 0.237 0.000 1.089 14 L CA 2.996 57.991 54.840 0.258 0.000 0.757 14 L CB -0.002 42.278 42.059 0.368 0.000 0.899 14 L HN 0.179 8.585 8.230 0.293 0.000 0.434 15 W N -6.951 114.523 121.300 0.289 0.000 3.077 15 W HA -0.123 4.678 4.660 0.235 0.000 0.245 15 W C -0.486 176.137 176.519 0.175 0.000 1.316 15 W CA -0.196 57.301 57.345 0.253 0.000 1.537 15 W CB -1.100 28.552 29.460 0.320 0.000 1.131 15 W HN -0.138 8.290 8.180 0.472 0.035 0.695 16 T N -3.123 111.218 114.554 -0.355 0.000 2.896 16 T HA -0.066 4.159 4.350 -0.358 -0.090 0.238 16 T C 2.659 177.188 174.700 -0.284 0.000 1.045 16 T CA 1.306 63.173 62.100 -0.388 0.000 1.248 16 T CB 1.544 70.189 68.868 -0.372 0.000 0.955 16 T HN -0.691 7.112 8.240 -0.420 0.186 0.416 17 V N -2.153 117.637 119.914 -0.207 0.000 2.594 17 V HA -0.211 3.693 4.120 -0.360 0.000 0.253 17 V C 0.889 176.887 176.094 -0.160 0.000 1.069 17 V CA 2.051 64.196 62.300 -0.258 0.000 1.082 17 V CB -1.427 30.232 31.823 -0.274 0.000 0.680 17 V HN -0.082 8.041 8.190 -0.112 0.000 0.469 18 G N -1.989 106.814 108.800 0.006 0.000 2.985 18 G HA2 -0.107 3.874 3.960 0.036 0.000 0.209 18 G HA3 -0.107 4.056 3.960 0.142 -0.117 0.209 18 G C -0.676 174.318 174.900 0.156 0.000 1.165 18 G CA -0.767 44.384 45.100 0.086 0.000 0.776 18 G HN -0.742 7.527 8.290 0.024 0.036 0.541 19 W N 2.175 123.448 121.300 -0.045 0.000 2.397 19 W HA -0.121 4.568 4.660 0.049 0.000 0.327 19 W C -0.075 176.420 176.519 -0.041 0.000 1.421 19 W CA -0.009 57.327 57.345 -0.014 0.000 1.288 19 W CB 0.438 29.871 29.460 -0.046 0.000 1.312 19 W HN -0.518 7.627 8.180 0.229 0.172 0.559 20 Q N 8.262 127.829 119.800 -0.388 0.000 2.451 20 Q HA -0.146 3.997 4.340 -0.328 0.000 0.206 20 Q C 0.247 175.754 176.000 -0.823 0.000 0.947 20 Q CA 1.513 57.038 55.803 -0.463 0.000 0.937 20 Q CB 0.233 28.823 28.738 -0.248 0.000 1.025 20 Q HN 0.314 8.443 8.270 -0.235 0.000 0.511 21 G N -3.497 104.203 108.800 -1.834 0.000 2.159 21 G HA2 -0.428 1.513 3.960 -3.364 0.000 0.227 21 G HA3 -0.428 2.850 3.960 -1.137 0.000 0.227 21 G C -1.388 172.955 174.900 -0.928 0.000 0.986 21 G CA -0.155 43.809 45.100 -1.894 0.000 0.651 21 G HN 0.163 6.780 8.290 -2.702 0.051 0.523 22 R N -0.030 120.142 120.500 -0.546 0.000 2.489 22 R HA 0.118 4.557 4.340 -0.110 -0.165 0.287 22 R C -1.237 175.190 176.300 0.212 0.000 1.053 22 R CA 0.582 56.627 56.100 -0.093 0.000 1.036 22 R CB 0.542 30.832 30.300 -0.016 0.000 0.966 22 R HN -0.263 7.611 8.270 -0.660 0.000 0.432 23 D N 3.596 124.084 120.400 0.146 0.000 2.636 23 D HA 0.418 5.204 4.640 0.244 0.000 0.275 23 D C -0.852 175.451 176.300 0.006 0.000 1.130 23 D CA -2.420 51.689 54.000 0.182 0.000 1.031 23 D CB 0.032 40.985 40.800 0.254 0.000 1.451 23 D HN -0.013 8.393 8.370 0.061 0.000 0.505 24 P HA -0.073 4.149 4.420 -0.330 0.000 0.225 24 P C -0.560 176.302 177.300 -0.729 0.000 1.148 24 P CA 1.915 64.751 63.100 -0.441 0.000 0.779 24 P CB 0.118 31.410 31.700 -0.680 0.000 0.780 25 F N -4.261 115.678 119.950 -0.018 0.000 2.775 25 F HA 0.281 4.796 4.527 -0.021 0.000 0.313 25 F C -0.382 175.406 175.800 -0.019 0.000 1.121 25 F CA -0.477 57.509 58.000 -0.023 0.000 1.206 25 F CB 1.223 40.200 39.000 -0.038 0.000 1.052 25 F HN -0.528 7.957 8.300 -0.015 -0.194 0.524 26 G N 0.004 108.844 108.800 0.067 0.000 2.753 26 G HA2 0.133 4.118 3.960 0.042 0.000 0.297 26 G HA3 0.133 4.177 3.960 0.045 -0.057 0.297 26 G C -2.127 172.765 174.900 -0.014 0.000 1.430 26 G CA -0.194 44.928 45.100 0.037 0.000 1.040 26 G HN -0.780 7.507 8.290 0.015 0.013 0.530 27 D N 1.479 121.861 120.400 -0.031 0.000 2.383 27 D HA 0.030 4.637 4.640 -0.056 0.000 0.248 27 D C -0.048 176.188 176.300 -0.108 0.000 1.170 27 D CA -0.253 53.712 54.000 -0.058 0.000 0.977 27 D CB 1.811 42.584 40.800 -0.045 0.000 1.120 27 D HN 0.071 8.430 8.370 -0.019 0.000 0.481 28 A N -0.521 122.222 122.820 -0.129 0.000 2.498 28 A HA -0.083 4.153 4.320 -0.289 -0.090 0.239 28 A C 0.594 178.072 177.584 -0.176 0.000 1.068 28 A CA 1.426 53.343 52.037 -0.199 0.000 0.766 28 A CB 0.084 18.986 19.000 -0.164 0.000 1.003 28 A HN 0.364 8.453 8.150 -0.102 0.000 0.497 29 T N -2.333 112.080 114.554 -0.234 0.000 3.023 29 T HA 0.113 4.385 4.350 -0.129 0.000 0.253 29 T C 0.462 175.067 174.700 -0.159 0.000 1.038 29 T CA -0.359 61.636 62.100 -0.175 0.000 0.962 29 T CB 0.895 69.660 68.868 -0.171 0.000 1.018 29 T HN 0.387 8.430 8.240 -0.328 0.000 0.521 30 R N 0.635 121.021 120.500 -0.189 0.000 2.771 30 R HA 0.456 4.729 4.340 -0.111 0.000 0.274 30 R C -2.935 173.296 176.300 -0.115 0.000 0.987 30 R CA -2.459 53.554 56.100 -0.144 0.000 0.908 30 R CB 2.150 32.348 30.300 -0.171 0.000 1.213 30 R HN -0.618 7.512 8.270 -0.234 0.000 0.468 31 P HA 0.118 4.512 4.420 -0.042 0.000 0.274 31 P C -0.836 176.448 177.300 -0.027 0.000 1.237 31 P CA -0.539 62.537 63.100 -0.039 0.000 0.793 31 P CB 0.426 32.118 31.700 -0.014 0.000 0.977 32 A N 0.487 123.306 122.820 -0.003 0.000 2.520 32 A HA -0.101 4.233 4.320 0.023 0.000 0.235 32 A C 0.178 177.793 177.584 0.050 0.000 1.065 32 A CA 0.458 52.511 52.037 0.027 0.000 0.764 32 A CB 0.519 19.545 19.000 0.043 0.000 1.002 32 A HN -0.035 8.113 8.150 -0.003 0.000 0.502 33 L N 1.740 123.008 121.223 0.076 0.000 2.309 33 L HA 0.061 4.466 4.340 0.109 0.000 0.282 33 L C -0.183 176.763 176.870 0.127 0.000 1.036 33 L CA -0.870 54.036 54.840 0.112 0.000 0.806 33 L CB 0.942 43.087 42.059 0.144 0.000 1.220 33 L HN 0.266 8.542 8.230 0.077 0.000 0.429 34 D N 4.984 125.463 120.400 0.130 0.000 2.417 34 D HA 0.154 4.873 4.640 0.131 0.000 0.250 34 D C -0.556 175.842 176.300 0.163 0.000 1.166 34 D CA -2.726 51.355 54.000 0.135 0.000 0.881 34 D CB 1.499 42.368 40.800 0.116 0.000 1.164 34 D HN 0.142 8.588 8.370 0.125 0.000 0.467 35 P HA -0.208 4.344 4.420 0.220 0.000 0.217 35 P C 1.115 178.576 177.300 0.268 0.000 1.148 35 P CA 1.915 65.141 63.100 0.211 0.000 0.828 35 P CB 0.317 32.084 31.700 0.111 0.000 0.783 36 V N -2.851 117.195 119.914 0.220 0.000 2.287 36 V HA -0.533 3.698 4.120 0.184 0.000 0.248 36 V C 1.806 177.969 176.094 0.115 0.000 1.053 36 V CA 4.692 67.091 62.300 0.165 0.000 1.027 36 V CB -0.249 31.645 31.823 0.117 0.000 0.646 36 V HN -0.240 8.331 8.190 0.196 -0.263 0.447 37 E N -0.262 120.009 120.200 0.117 0.000 2.058 37 E HA -0.358 4.020 4.350 0.046 0.000 0.194 37 E C 1.992 178.646 176.600 0.090 0.000 0.997 37 E CA 3.058 59.514 56.400 0.093 0.000 0.801 37 E CB -0.808 28.972 29.700 0.133 0.000 0.746 37 E HN -0.439 7.998 8.360 0.130 0.000 0.450 38 T N 2.892 117.564 114.554 0.196 0.000 2.720 38 T HA -0.396 4.156 4.350 0.337 0.000 0.268 38 T C 2.111 176.881 174.700 0.116 0.000 1.037 38 T CA 5.071 67.320 62.100 0.249 0.000 1.144 38 T CB -0.149 68.912 68.868 0.322 0.000 0.864 38 T HN -0.563 7.806 8.240 0.216 0.000 0.444 39 V N 1.569 121.563 119.914 0.132 0.000 2.287 39 V HA -0.556 3.623 4.120 0.098 0.000 0.248 39 V C 1.390 177.470 176.094 -0.023 0.000 1.053 39 V CA 4.917 67.260 62.300 0.071 0.000 1.027 39 V CB -0.260 31.593 31.823 0.050 0.000 0.646 39 V HN -0.306 7.989 8.190 0.176 0.000 0.447 40 Q N -0.970 118.801 119.800 -0.049 0.000 2.050 40 Q HA -0.385 3.906 4.340 -0.081 0.000 0.202 40 Q C 2.233 178.112 176.000 -0.201 0.000 0.980 40 Q CA 3.323 59.066 55.803 -0.101 0.000 0.840 40 Q CB -0.246 28.440 28.738 -0.085 0.000 0.898 40 Q HN -0.358 7.903 8.270 -0.015 0.000 0.424 41 R N -1.513 118.778 120.500 -0.349 0.000 2.075 41 R HA -0.209 3.785 4.340 -0.576 0.000 0.232 41 R C 2.734 178.704 176.300 -0.550 0.000 1.126 41 R CA 2.269 57.955 56.100 -0.690 0.000 0.963 41 R CB -0.215 29.154 30.300 -1.552 0.000 0.858 41 R HN -0.146 7.947 8.270 -0.296 0.000 0.435 42 L N -1.495 119.519 121.223 -0.349 0.000 2.093 42 L HA -0.299 3.916 4.340 -0.208 0.000 0.208 42 L C 1.791 178.626 176.870 -0.058 0.000 1.085 42 L CA 2.847 57.591 54.840 -0.160 0.000 0.755 42 L CB -0.588 41.461 42.059 -0.018 0.000 0.904 42 L HN 0.005 8.058 8.230 -0.294 0.000 0.435 43 A N -0.706 122.082 122.820 -0.054 0.000 1.883 43 A HA -0.314 4.023 4.320 0.027 0.000 0.217 43 A C 2.568 180.131 177.584 -0.034 0.000 1.186 43 A CA 2.796 54.822 52.037 -0.018 0.000 0.624 43 A CB -0.887 18.094 19.000 -0.032 0.000 0.822 43 A HN -0.168 7.937 8.150 -0.074 0.000 0.444 44 E N -1.134 119.011 120.200 -0.093 0.000 2.204 44 E HA -0.234 4.081 4.350 -0.058 0.000 0.195 44 E C 1.407 177.968 176.600 -0.066 0.000 0.990 44 E CA 2.121 58.467 56.400 -0.090 0.000 0.821 44 E CB -0.070 29.545 29.700 -0.142 0.000 0.750 44 E HN -0.478 7.801 8.360 -0.135 0.000 0.477 45 L N -4.067 117.113 121.223 -0.071 0.000 2.554 45 L HA -0.029 4.300 4.340 -0.018 0.000 0.226 45 L C 0.200 177.108 176.870 0.063 0.000 1.137 45 L CA -0.127 54.702 54.840 -0.018 0.000 0.863 45 L CB 0.585 42.620 42.059 -0.040 0.000 0.985 45 L HN -0.721 7.322 8.230 -0.112 0.120 0.451 46 G N -4.137 104.714 108.800 0.086 0.000 2.148 46 G HA2 -0.310 3.724 3.960 0.124 0.000 0.203 46 G HA3 -0.310 3.904 3.960 0.168 -0.153 0.203 46 G C -0.976 174.074 174.900 0.250 0.000 0.993 46 G CA -0.360 44.832 45.100 0.154 0.000 0.661 46 G HN -0.555 7.534 8.290 0.053 0.233 0.518 47 A N -0.499 122.482 122.820 0.268 0.000 2.406 47 A HA -0.068 4.567 4.320 0.525 0.000 0.243 47 A C -0.833 176.935 177.584 0.307 0.000 1.082 47 A CA 0.064 52.337 52.037 0.394 0.000 0.786 47 A CB 1.034 20.296 19.000 0.436 0.000 1.029 47 A HN -0.585 7.683 8.150 0.198 0.000 0.495 48 H N 0.317 119.514 119.070 0.213 0.000 2.486 48 H HA 0.003 4.608 4.556 0.082 0.000 0.287 48 H C -0.503 174.896 175.328 0.118 0.000 1.010 48 H CA 1.858 57.973 56.048 0.113 0.000 1.324 48 H CB 2.295 32.085 29.762 0.046 0.000 1.446 48 H HN 0.442 8.996 8.280 0.456 0.000 0.537 49 G N -4.311 104.563 108.800 0.124 0.000 2.489 49 G HA2 0.357 4.347 3.960 0.001 0.000 0.305 49 G HA3 0.357 4.347 3.960 -0.041 -0.055 0.305 49 G C -3.426 171.620 174.900 0.245 0.000 1.311 49 G CA 0.411 45.545 45.100 0.056 0.000 0.813 49 G HN -0.709 7.752 8.290 0.284 0.000 0.480 50 V N -0.710 119.350 119.914 0.244 0.000 2.971 50 V HA 0.986 5.537 4.120 0.392 -0.196 0.309 50 V C -2.243 174.088 176.094 0.396 0.000 1.130 50 V CA -3.201 59.313 62.300 0.356 0.000 0.964 50 V CB 4.322 36.364 31.823 0.365 0.000 1.029 50 V HN 0.457 8.756 8.190 0.182 0.000 0.427 51 T N 1.175 115.981 114.554 0.420 0.000 2.907 51 T HA 0.778 5.472 4.350 0.380 -0.116 0.290 51 T C -1.594 173.459 174.700 0.587 0.000 1.066 51 T CA -2.854 59.485 62.100 0.398 0.000 1.012 51 T CB 2.987 71.988 68.868 0.221 0.000 1.184 51 T HN 0.081 8.564 8.240 0.404 0.000 0.522 52 F N -3.843 116.333 119.950 0.376 0.000 2.654 52 F HA 0.523 5.430 4.527 0.634 0.000 0.308 52 F C -2.521 173.371 175.800 0.154 0.000 1.108 52 F CA -1.739 56.493 58.000 0.387 0.000 0.957 52 F CB 2.127 41.235 39.000 0.180 0.000 1.309 52 F HN -0.136 8.161 8.300 -0.006 0.000 0.446 53 H N 2.180 121.422 119.070 0.287 0.000 2.562 53 H HA 0.454 5.102 4.556 -0.082 -0.141 0.352 53 H C 2.143 177.667 175.328 0.326 0.000 1.125 53 H CA 0.417 56.512 56.048 0.079 0.000 1.379 53 H CB 1.032 30.779 29.762 -0.025 0.000 1.464 53 H HN 0.073 9.012 8.280 0.578 -0.313 0.563 54 D N 2.685 123.308 120.400 0.373 0.000 2.192 54 D HA -0.463 4.567 4.640 0.508 -0.085 0.189 54 D C 1.362 177.815 176.300 0.255 0.000 1.007 54 D CA 3.322 57.541 54.000 0.365 0.000 0.859 54 D CB -0.657 40.287 40.800 0.240 0.000 0.936 54 D HN 0.027 8.544 8.370 0.245 0.000 0.447 55 D N -2.424 118.101 120.400 0.209 0.000 2.349 55 D HA 0.067 5.010 4.640 0.124 -0.229 0.224 55 D C 1.165 177.542 176.300 0.127 0.000 1.029 55 D CA 1.364 55.452 54.000 0.147 0.000 0.879 55 D CB -0.679 40.213 40.800 0.154 0.000 0.906 55 D HN 0.233 8.716 8.370 0.212 0.014 0.528 56 D N -0.502 120.022 120.400 0.208 0.000 2.213 56 D HA -0.127 4.623 4.640 0.183 0.000 0.205 56 D C 0.853 177.197 176.300 0.073 0.000 0.961 56 D CA 1.810 55.938 54.000 0.212 0.000 0.853 56 D CB 0.308 41.357 40.800 0.416 0.000 0.967 56 D HN -0.255 8.131 8.370 0.290 0.158 0.496 57 L N -2.065 119.154 121.223 -0.006 0.000 2.168 57 L HA -0.085 4.064 4.340 -0.317 0.000 0.203 57 L C -1.315 175.404 176.870 -0.252 0.000 1.078 57 L CA 0.634 55.311 54.840 -0.272 0.000 0.780 57 L CB 1.667 43.354 42.059 -0.620 0.000 0.939 57 L HN -0.710 7.583 8.230 0.105 0.000 0.451 58 I N -3.256 117.201 120.570 -0.188 0.000 2.410 58 I HA 0.342 4.180 4.170 -0.553 0.000 0.286 58 I C -2.872 173.125 176.117 -0.201 0.000 1.009 58 I CA -3.262 57.868 61.300 -0.283 0.000 1.111 58 I CB 1.746 39.673 38.000 -0.121 0.000 1.262 58 I HN -0.492 7.667 8.210 -0.085 0.000 0.443 59 P HA -0.030 4.386 4.420 -0.007 0.000 0.264 59 P C -0.279 177.034 177.300 0.022 0.000 1.183 59 P CA -0.457 62.603 63.100 -0.067 0.000 0.763 59 P CB 0.317 31.977 31.700 -0.066 0.000 0.807 60 F N 5.604 125.554 119.950 0.001 0.000 2.629 60 F HA -0.416 4.136 4.527 0.042 0.000 0.377 60 F C 1.429 177.255 175.800 0.042 0.000 1.101 60 F CA 1.865 59.890 58.000 0.041 0.000 1.301 60 F CB 0.410 39.460 39.000 0.084 0.000 1.062 60 F HN 0.384 8.840 8.300 0.261 0.000 0.583 61 G N 6.172 114.555 108.800 -0.695 0.000 2.179 61 G HA2 -0.473 3.169 3.960 -0.531 0.000 0.260 61 G HA3 -0.473 3.375 3.960 -0.188 0.000 0.260 61 G C -0.443 174.364 174.900 -0.156 0.000 0.977 61 G CA -0.176 44.688 45.100 -0.393 0.000 0.641 61 G HN 0.551 8.220 8.290 -1.033 0.000 0.533 62 S N 2.064 117.695 115.700 -0.115 0.000 2.563 62 S HA -0.071 4.543 4.470 -0.001 -0.145 0.284 62 S C 0.526 175.107 174.600 -0.031 0.000 1.331 62 S CA 1.541 59.720 58.200 -0.034 0.000 1.047 62 S CB 0.955 64.147 63.200 -0.013 0.000 0.859 62 S HN -0.558 7.608 8.310 -0.146 0.056 0.514 63 S N 3.593 119.296 115.700 0.005 0.000 2.608 63 S HA -0.001 4.465 4.470 -0.008 0.000 0.261 63 S C 0.971 175.581 174.600 0.017 0.000 1.314 63 S CA 0.127 58.331 58.200 0.006 0.000 0.992 63 S CB 1.220 64.429 63.200 0.016 0.000 0.935 63 S HN 0.224 8.895 8.310 0.021 -0.349 0.564 64 D N 1.834 122.242 120.400 0.014 0.000 2.117 64 D HA -0.227 4.425 4.640 0.020 0.000 0.197 64 D C 2.296 178.615 176.300 0.032 0.000 0.987 64 D CA 3.843 57.855 54.000 0.021 0.000 0.829 64 D CB -0.536 40.275 40.800 0.019 0.000 0.961 64 D HN 0.577 8.952 8.370 0.009 0.000 0.460 65 T N 2.002 116.573 114.554 0.029 0.000 2.652 65 T HA -0.357 4.009 4.350 0.026 0.000 0.267 65 T C 2.026 176.751 174.700 0.041 0.000 1.039 65 T CA 4.591 66.708 62.100 0.029 0.000 1.153 65 T CB -0.028 68.853 68.868 0.021 0.000 0.863 65 T HN -0.243 8.012 8.240 0.024 0.000 0.428 66 E N 0.956 121.190 120.200 0.058 0.000 2.077 66 E HA -0.380 4.010 4.350 0.068 0.000 0.193 66 E C 2.103 178.817 176.600 0.191 0.000 0.989 66 E CA 3.094 59.559 56.400 0.107 0.000 0.800 66 E CB -0.240 29.535 29.700 0.126 0.000 0.746 66 E HN -0.633 7.757 8.360 0.050 0.000 0.452 67 R N -0.358 120.219 120.500 0.130 0.000 2.083 67 R HA -0.392 4.032 4.340 0.141 0.000 0.237 67 R C 1.871 178.239 176.300 0.114 0.000 1.137 67 R CA 3.586 59.756 56.100 0.116 0.000 0.951 67 R CB -0.032 30.299 30.300 0.053 0.000 0.851 67 R HN 0.166 8.488 8.270 0.088 0.000 0.434 68 E N -1.311 118.934 120.200 0.075 0.000 2.110 68 E HA -0.305 4.083 4.350 0.062 0.000 0.193 68 E C 2.163 178.794 176.600 0.051 0.000 0.988 68 E CA 3.115 59.550 56.400 0.058 0.000 0.804 68 E CB -0.600 29.125 29.700 0.041 0.000 0.745 68 E HN -0.426 7.973 8.360 0.066 0.000 0.458 69 S N 0.546 116.264 115.700 0.030 0.000 2.368 69 S HA -0.291 4.168 4.470 -0.018 0.000 0.225 69 S C 2.254 176.827 174.600 -0.044 0.000 1.030 69 S CA 3.635 61.818 58.200 -0.029 0.000 0.999 69 S CB -0.347 62.797 63.200 -0.093 0.000 0.844 69 S HN -0.482 7.850 8.310 0.037 0.000 0.459 70 H N 1.456 120.536 119.070 0.017 0.000 2.353 70 H HA -0.210 4.358 4.556 0.020 0.000 0.300 70 H C 2.887 178.227 175.328 0.020 0.000 1.090 70 H CA 4.060 60.114 56.048 0.008 0.000 1.327 70 H CB 0.230 29.979 29.762 -0.021 0.000 1.383 70 H HN -0.479 7.869 8.280 0.114 0.000 0.508 71 I N -0.389 120.263 120.570 0.137 0.000 2.179 71 I HA -0.569 3.668 4.170 0.113 0.000 0.242 71 I C 1.270 177.469 176.117 0.136 0.000 1.088 71 I CA 4.276 65.645 61.300 0.116 0.000 1.357 71 I CB -0.182 37.868 38.000 0.084 0.000 1.051 71 I HN 0.002 8.296 8.210 0.140 0.000 0.409 72 K N 0.081 120.534 120.400 0.088 0.000 2.032 72 K HA -0.534 3.822 4.320 0.059 0.000 0.209 72 K C 2.066 178.707 176.600 0.069 0.000 1.048 72 K CA 3.998 60.323 56.287 0.063 0.000 0.927 72 K CB -0.228 32.292 32.500 0.034 0.000 0.712 72 K HN -0.056 8.238 8.250 0.074 0.000 0.441 73 R N -2.259 118.285 120.500 0.074 0.000 2.091 73 R HA -0.320 4.049 4.340 0.049 0.000 0.238 73 R C 2.433 178.820 176.300 0.144 0.000 1.136 73 R CA 3.366 59.515 56.100 0.081 0.000 0.959 73 R CB -0.197 30.136 30.300 0.056 0.000 0.856 73 R HN -0.537 7.770 8.270 0.061 0.000 0.437 74 F N -0.049 119.902 119.950 0.002 0.000 2.128 74 F HA -0.292 4.240 4.527 0.007 0.000 0.295 74 F C 1.083 176.878 175.800 -0.008 0.000 1.100 74 F CA 2.589 60.585 58.000 -0.006 0.000 1.260 74 F CB 0.053 39.030 39.000 -0.039 0.000 1.009 74 F HN -0.642 7.821 8.300 0.291 0.011 0.476 75 R N -0.658 119.855 120.500 0.021 0.000 2.091 75 R HA -0.552 3.664 4.340 -0.206 0.000 0.238 75 R C 2.109 178.354 176.300 -0.091 0.000 1.136 75 R CA 4.019 60.066 56.100 -0.088 0.000 0.959 75 R CB -0.133 30.168 30.300 0.001 0.000 0.856 75 R HN 0.140 8.502 8.270 0.154 0.000 0.437 76 Q N -1.654 118.125 119.800 -0.035 0.000 2.119 76 Q HA -0.284 4.033 4.340 -0.038 0.000 0.201 76 Q C 2.372 178.337 176.000 -0.059 0.000 0.972 76 Q CA 3.069 58.850 55.803 -0.036 0.000 0.847 76 Q CB -0.221 28.512 28.738 -0.008 0.000 0.903 76 Q HN -0.146 8.124 8.270 0.000 0.000 0.433 77 A N 0.280 123.061 122.820 -0.065 0.000 1.902 77 A HA -0.278 4.012 4.320 -0.050 0.000 0.217 77 A C 1.886 179.388 177.584 -0.138 0.000 1.181 77 A CA 3.081 55.072 52.037 -0.077 0.000 0.623 77 A CB -0.569 18.410 19.000 -0.035 0.000 0.818 77 A HN -0.490 7.630 8.150 -0.050 0.000 0.443 78 L N -2.185 118.890 121.223 -0.247 0.000 2.012 78 L HA -0.400 3.801 4.340 -0.231 0.000 0.210 78 L C 2.492 179.274 176.870 -0.146 0.000 1.073 78 L CA 2.852 57.541 54.840 -0.252 0.000 0.748 78 L CB -0.431 41.402 42.059 -0.377 0.000 0.891 78 L HN -0.070 7.970 8.230 -0.317 0.000 0.431 79 D N -1.721 118.607 120.400 -0.119 0.000 2.144 79 D HA -0.230 4.365 4.640 -0.074 0.000 0.200 79 D C 1.639 177.904 176.300 -0.059 0.000 0.978 79 D CA 2.749 56.704 54.000 -0.076 0.000 0.833 79 D CB -0.377 40.389 40.800 -0.057 0.000 0.961 79 D HN -0.168 8.123 8.370 -0.131 0.000 0.470 80 A N -1.799 120.987 122.820 -0.057 0.000 1.930 80 A HA -0.105 4.194 4.320 -0.035 0.000 0.217 80 A C 1.528 179.087 177.584 -0.042 0.000 1.175 80 A CA 2.456 54.468 52.037 -0.043 0.000 0.627 80 A CB 0.138 19.116 19.000 -0.037 0.000 0.815 80 A HN -0.185 7.926 8.150 -0.066 0.000 0.443 81 T N -6.002 108.520 114.554 -0.053 0.000 3.051 81 T HA -0.015 4.313 4.350 -0.038 0.000 0.255 81 T C 1.590 176.266 174.700 -0.042 0.000 1.085 81 T CA 0.039 62.112 62.100 -0.046 0.000 1.109 81 T CB 1.101 69.938 68.868 -0.051 0.000 0.921 81 T HN -0.638 7.562 8.240 -0.065 0.000 0.488 82 G N 1.963 110.732 108.800 -0.053 0.000 2.168 82 G HA2 -0.420 3.507 3.960 -0.055 0.000 0.263 82 G HA3 -0.420 3.520 3.960 -0.035 0.000 0.263 82 G C -0.277 174.579 174.900 -0.073 0.000 0.977 82 G CA 0.407 45.476 45.100 -0.052 0.000 0.659 82 G HN -0.401 7.853 8.290 -0.060 0.000 0.533 83 M N 1.030 120.578 119.600 -0.086 0.000 2.284 83 M HA -0.176 4.415 4.480 -0.115 -0.180 0.351 83 M C 0.574 176.786 176.300 -0.147 0.000 1.443 83 M CA -0.362 54.875 55.300 -0.106 0.000 1.031 83 M CB -0.966 31.593 32.600 -0.067 0.000 1.893 83 M HN -0.683 7.487 8.290 -0.073 0.076 0.456 84 T N -2.493 111.937 114.554 -0.206 0.000 2.923 84 T HA 0.224 4.494 4.350 -0.134 0.000 0.281 84 T C -1.106 173.557 174.700 -0.062 0.000 0.995 84 T CA -1.991 60.000 62.100 -0.181 0.000 0.985 84 T CB 2.752 71.424 68.868 -0.327 0.000 1.114 84 T HN 0.042 8.127 8.240 -0.258 0.000 0.548 85 V N 1.088 121.011 119.914 0.016 0.000 2.320 85 V HA 0.766 5.465 4.120 0.178 -0.472 0.268 85 V C -1.783 174.373 176.094 0.103 0.000 1.021 85 V CA -3.880 58.505 62.300 0.141 0.000 0.813 85 V CB 0.195 32.181 31.823 0.271 0.000 1.054 85 V HN 0.601 8.788 8.190 -0.005 0.000 0.444 86 P HA 0.121 4.576 4.420 0.059 0.000 0.240 86 P C -1.450 175.867 177.300 0.028 0.000 1.190 86 P CA 0.507 63.653 63.100 0.076 0.000 0.781 86 P CB 0.803 32.580 31.700 0.128 0.000 0.931 87 M N -2.634 116.954 119.600 -0.020 0.000 2.465 87 M HA 0.736 5.344 4.480 -0.181 -0.236 0.284 87 M C -2.985 173.163 176.300 -0.254 0.000 1.212 87 M CA -1.092 54.092 55.300 -0.194 0.000 0.910 87 M CB 4.104 36.443 32.600 -0.434 0.000 1.725 87 M HN -0.681 7.577 8.290 0.031 0.050 0.477 88 A N 1.544 124.104 122.820 -0.433 0.000 2.564 88 A HA 0.856 4.841 4.320 -0.708 -0.090 0.288 88 A C -2.432 174.556 177.584 -0.993 0.000 1.164 88 A CA -1.014 50.575 52.037 -0.747 0.000 0.712 88 A CB 3.893 22.272 19.000 -1.034 0.000 1.303 88 A HN 0.076 7.991 8.150 -0.393 0.000 0.418 89 T N -1.624 112.361 114.554 -0.947 0.000 2.739 89 T HA 0.480 4.051 4.350 -1.447 -0.090 0.303 89 T C -1.477 173.026 174.700 -0.328 0.000 1.389 89 T CA -1.631 59.949 62.100 -0.868 0.000 1.001 89 T CB 1.472 69.971 68.868 -0.615 0.000 1.436 89 T HN 0.384 8.105 8.240 -0.866 0.000 0.500 90 T N 2.816 117.347 114.554 -0.039 0.000 2.859 90 T HA 0.217 4.649 4.350 0.137 0.000 0.281 90 T C -1.527 173.240 174.700 0.111 0.000 1.005 90 T CA -0.134 62.033 62.100 0.111 0.000 1.025 90 T CB 1.287 70.232 68.868 0.128 0.000 0.977 90 T HN 0.305 8.512 8.240 -0.055 0.000 0.458 91 N N 4.920 123.617 118.700 -0.005 0.000 2.439 91 N HA 0.031 4.473 4.740 -0.497 0.000 0.243 91 N C -1.080 174.128 175.510 -0.504 0.000 1.088 91 N CA -0.586 52.212 53.050 -0.420 0.000 0.940 91 N CB -0.346 37.800 38.487 -0.569 0.000 1.180 91 N HN 0.400 9.159 8.380 0.038 -0.356 0.505 92 L N 4.441 125.323 121.223 -0.568 0.000 3.062 92 L HA 0.177 3.523 4.340 -1.657 0.000 0.255 92 L C -1.328 175.158 176.870 -0.639 0.000 1.274 92 L CA -0.345 53.880 54.840 -1.024 0.000 1.047 92 L CB -1.030 40.448 42.059 -0.968 0.000 1.402 92 L HN -0.102 7.943 8.230 -0.307 0.000 0.550 93 F N -6.505 113.298 119.950 -0.244 0.000 2.767 93 F HA 0.498 4.957 4.527 -0.115 0.000 0.329 93 F C 0.176 176.014 175.800 0.064 0.000 0.912 93 F CA -0.235 57.704 58.000 -0.102 0.000 1.115 93 F CB 0.697 39.592 39.000 -0.175 0.000 0.936 93 F HN -0.067 7.991 8.300 -0.817 -0.248 0.624 94 T N 2.715 117.183 114.554 -0.143 0.000 2.809 94 T HA -0.238 4.188 4.350 0.128 0.000 0.260 94 T C 0.169 174.870 174.700 0.001 0.000 1.039 94 T CA 4.355 66.449 62.100 -0.009 0.000 1.141 94 T CB 0.240 69.013 68.868 -0.158 0.000 0.869 94 T HN -0.331 7.909 8.240 -0.573 -0.344 0.437 95 H N 2.602 121.626 119.070 -0.078 0.000 2.815 95 H HA 0.052 4.431 4.556 -0.295 0.000 0.350 95 H C -0.257 174.969 175.328 -0.171 0.000 1.080 95 H CA -0.962 54.940 56.048 -0.244 0.000 1.433 95 H CB 1.648 31.126 29.762 -0.474 0.000 1.432 95 H HN -0.249 8.128 8.280 0.161 0.000 0.592 96 P HA -0.239 4.124 4.420 -0.095 0.000 0.221 96 P C 0.890 178.160 177.300 -0.050 0.000 1.145 96 P CA 1.925 64.934 63.100 -0.151 0.000 0.795 96 P CB 0.112 31.672 31.700 -0.232 0.000 0.775 97 V N -1.614 118.306 119.914 0.010 0.000 2.469 97 V HA -0.378 3.649 4.120 -0.154 0.000 0.251 97 V C 0.969 176.907 176.094 -0.261 0.000 1.064 97 V CA 2.894 65.052 62.300 -0.237 0.000 1.066 97 V CB 0.184 31.689 31.823 -0.531 0.000 0.667 97 V HN -0.783 7.608 8.190 0.393 0.035 0.461 98 F N -4.741 115.246 119.950 0.063 0.000 2.693 98 F HA 0.223 4.917 4.527 0.019 -0.156 0.303 98 F C 1.380 177.175 175.800 -0.009 0.000 1.143 98 F CA -1.658 56.353 58.000 0.018 0.000 1.389 98 F CB -1.794 37.204 39.000 -0.003 0.000 1.060 98 F HN -0.467 7.705 8.300 -0.163 0.030 0.535 99 K N -0.428 120.034 120.400 0.103 0.000 2.209 99 K HA -0.288 4.068 4.320 0.059 0.000 0.204 99 K C 0.230 176.853 176.600 0.039 0.000 1.048 99 K CA 3.067 59.386 56.287 0.053 0.000 0.940 99 K CB -0.483 32.023 32.500 0.010 0.000 0.729 99 K HN -0.650 7.543 8.250 0.055 0.089 0.451 100 D N -1.384 119.046 120.400 0.049 0.000 2.440 100 D HA 0.125 4.770 4.640 0.009 0.000 0.216 100 D C -0.880 175.437 176.300 0.029 0.000 1.150 100 D CA -1.171 52.845 54.000 0.027 0.000 0.832 100 D CB 1.133 41.946 40.800 0.021 0.000 0.992 100 D HN -0.300 8.084 8.370 0.065 0.025 0.502 101 G N -2.164 106.669 108.800 0.055 0.000 2.357 101 G HA2 -0.208 3.792 3.960 -0.064 0.000 0.643 101 G HA3 -0.208 3.829 3.960 -0.002 -0.078 0.643 101 G C -1.425 173.543 174.900 0.113 0.000 1.358 101 G CA -0.830 44.278 45.100 0.014 0.000 0.986 101 G HN -0.557 7.607 8.290 0.092 0.182 0.620 102 G N -1.225 107.529 108.800 -0.077 0.000 2.571 102 G HA2 0.375 4.447 3.960 0.187 0.000 0.225 102 G HA3 0.375 4.058 3.960 -0.461 0.000 0.225 102 G C 0.955 175.899 174.900 0.073 0.000 1.731 102 G CA 0.325 45.364 45.100 -0.101 0.000 0.858 102 G HN 0.185 8.851 8.290 -0.200 -0.495 0.611 103 F N -1.603 118.277 119.950 -0.117 0.000 2.365 103 F HA -0.051 4.417 4.527 -0.098 0.000 0.300 103 F C 0.762 176.525 175.800 -0.062 0.000 1.090 103 F CA 0.139 58.069 58.000 -0.115 0.000 1.408 103 F CB -0.100 38.772 39.000 -0.213 0.000 1.060 103 F HN -0.194 7.875 8.300 -0.386 0.000 0.534 104 T N -7.601 107.022 114.554 0.114 0.000 3.182 104 T HA 0.095 4.490 4.350 0.076 0.000 0.277 104 T C -0.536 174.193 174.700 0.048 0.000 1.013 104 T CA -1.964 60.175 62.100 0.065 0.000 0.900 104 T CB 1.265 70.150 68.868 0.029 0.000 1.098 104 T HN -0.392 8.099 8.240 0.062 -0.214 0.543 105 A N 1.241 124.103 122.820 0.071 0.000 2.561 105 A HA -0.290 4.274 4.320 0.054 -0.211 0.234 105 A C 0.330 177.945 177.584 0.052 0.000 1.055 105 A CA 0.459 52.538 52.037 0.069 0.000 0.756 105 A CB 0.523 19.591 19.000 0.114 0.000 0.986 105 A HN -0.680 7.525 8.150 0.093 0.000 0.505 106 N N 2.521 121.243 118.700 0.035 0.000 2.244 106 N HA -0.262 4.494 4.740 0.027 0.000 0.183 106 N C -0.002 175.525 175.510 0.028 0.000 1.016 106 N CA 1.862 54.928 53.050 0.027 0.000 0.866 106 N CB 0.008 38.505 38.487 0.016 0.000 0.980 106 N HN -0.012 8.641 8.380 0.031 -0.254 0.430 107 D N -0.443 119.976 120.400 0.031 0.000 2.343 107 D HA 0.048 4.699 4.640 0.019 0.000 0.255 107 D C 0.146 176.471 176.300 0.041 0.000 1.187 107 D CA 0.498 54.514 54.000 0.027 0.000 0.875 107 D CB 0.468 41.277 40.800 0.016 0.000 1.136 107 D HN -0.297 8.079 8.370 0.033 0.014 0.469 108 R N 4.935 125.454 120.500 0.032 0.000 2.081 108 R HA -0.477 3.889 4.340 0.044 0.000 0.235 108 R C 0.677 177.007 176.300 0.050 0.000 1.131 108 R CA 4.208 60.331 56.100 0.038 0.000 0.960 108 R CB 0.069 30.383 30.300 0.024 0.000 0.856 108 R HN 0.489 8.773 8.270 0.024 0.000 0.436 109 D N -3.153 117.270 120.400 0.038 0.000 2.178 109 D HA -0.214 4.455 4.640 0.049 0.000 0.201 109 D C 2.174 178.525 176.300 0.086 0.000 0.980 109 D CA 2.860 56.886 54.000 0.044 0.000 0.842 109 D CB -1.592 39.213 40.800 0.009 0.000 0.948 109 D HN 0.388 8.773 8.370 0.026 0.000 0.472 110 V N 0.924 120.890 119.914 0.088 0.000 2.358 110 V HA -0.397 3.823 4.120 0.168 0.000 0.246 110 V C 2.084 178.334 176.094 0.260 0.000 1.047 110 V CA 3.343 65.740 62.300 0.161 0.000 1.035 110 V CB -0.632 31.259 31.823 0.114 0.000 0.658 110 V HN -0.864 7.349 8.190 0.060 0.013 0.452 111 R N -0.547 120.062 120.500 0.181 0.000 2.091 111 R HA -0.255 4.428 4.340 0.235 -0.203 0.238 111 R C 2.972 179.370 176.300 0.163 0.000 1.136 111 R CA 3.634 59.843 56.100 0.181 0.000 0.959 111 R CB -0.416 29.950 30.300 0.110 0.000 0.856 111 R HN -0.653 7.621 8.270 0.136 0.077 0.437 112 R N -1.433 119.143 120.500 0.126 0.000 2.081 112 R HA -0.335 4.032 4.340 0.045 0.000 0.235 112 R C 2.373 178.760 176.300 0.146 0.000 1.131 112 R CA 3.370 59.526 56.100 0.094 0.000 0.960 112 R CB -0.203 30.140 30.300 0.071 0.000 0.856 112 R HN -0.393 7.947 8.270 0.116 0.000 0.436 113 Y N 0.677 121.026 120.300 0.081 0.000 2.165 113 Y HA -0.478 4.112 4.550 0.067 0.000 0.286 113 Y C 1.087 177.102 175.900 0.191 0.000 1.155 113 Y CA 2.967 61.128 58.100 0.103 0.000 1.164 113 Y CB -0.226 38.276 38.460 0.071 0.000 0.978 113 Y HN -0.425 8.041 8.280 0.310 0.000 0.513 114 A N -0.927 122.030 122.820 0.227 0.000 1.908 114 A HA -0.415 3.931 4.320 0.045 0.000 0.218 114 A C 1.765 179.429 177.584 0.134 0.000 1.181 114 A CA 3.316 55.443 52.037 0.149 0.000 0.627 114 A CB -0.745 18.398 19.000 0.237 0.000 0.818 114 A HN 0.133 8.508 8.150 0.375 0.000 0.445 115 L N -2.534 118.771 121.223 0.137 0.000 2.046 115 L HA -0.436 3.939 4.340 0.058 0.000 0.208 115 L C 2.500 179.326 176.870 -0.073 0.000 1.077 115 L CA 3.042 57.882 54.840 0.001 0.000 0.747 115 L CB -0.461 41.515 42.059 -0.139 0.000 0.896 115 L HN -0.511 7.802 8.230 0.139 0.000 0.432 116 R N -1.894 118.555 120.500 -0.086 0.000 2.081 116 R HA -0.335 3.926 4.340 -0.132 0.000 0.235 116 R C 2.324 178.539 176.300 -0.141 0.000 1.131 116 R CA 2.349 58.380 56.100 -0.116 0.000 0.960 116 R CB -0.860 29.401 30.300 -0.064 0.000 0.856 116 R HN -0.272 7.965 8.270 -0.054 0.000 0.436 117 K N -0.133 120.139 120.400 -0.214 0.000 2.057 117 K HA -0.268 3.953 4.320 -0.165 0.000 0.207 117 K C 2.244 178.812 176.600 -0.053 0.000 1.049 117 K CA 3.382 59.557 56.287 -0.187 0.000 0.931 117 K CB -0.182 32.131 32.500 -0.313 0.000 0.714 117 K HN -0.024 8.061 8.250 -0.276 0.000 0.440 118 T N 2.121 116.665 114.554 -0.016 0.000 2.674 118 T HA -0.338 4.089 4.350 0.128 0.000 0.265 118 T C 1.988 176.667 174.700 -0.035 0.000 1.039 118 T CA 4.789 66.923 62.100 0.058 0.000 1.150 118 T CB -0.042 68.924 68.868 0.165 0.000 0.864 118 T HN -0.417 7.808 8.240 -0.025 0.000 0.427 119 I N 1.152 121.652 120.570 -0.118 0.000 2.208 119 I HA -0.553 3.489 4.170 -0.213 0.000 0.245 119 I C 1.223 177.275 176.117 -0.107 0.000 1.097 119 I CA 4.511 65.672 61.300 -0.231 0.000 1.363 119 I CB -0.360 37.348 38.000 -0.487 0.000 1.051 119 I HN -0.080 8.058 8.210 -0.120 0.000 0.413 120 R N -0.990 119.473 120.500 -0.061 0.000 2.091 120 R HA -0.451 3.903 4.340 0.024 0.000 0.238 120 R C 2.062 178.408 176.300 0.076 0.000 1.136 120 R CA 3.849 59.957 56.100 0.014 0.000 0.959 120 R CB -0.213 30.091 30.300 0.006 0.000 0.856 120 R HN -0.259 7.962 8.270 -0.082 0.000 0.437 121 N N -1.309 117.448 118.700 0.095 0.000 2.354 121 N HA -0.110 4.763 4.740 0.222 0.000 0.179 121 N C 2.149 177.757 175.510 0.164 0.000 1.021 121 N CA 2.511 55.679 53.050 0.197 0.000 0.887 121 N CB -0.060 38.602 38.487 0.291 0.000 0.974 121 N HN -0.731 7.679 8.380 0.067 0.010 0.437 122 I N 1.216 121.746 120.570 -0.066 0.000 2.163 122 I HA -0.658 3.304 4.170 -0.348 0.000 0.243 122 I C 1.247 177.371 176.117 0.012 0.000 1.085 122 I CA 4.675 65.867 61.300 -0.180 0.000 1.347 122 I CB -0.383 37.526 38.000 -0.153 0.000 1.044 122 I HN 0.186 8.338 8.210 -0.097 0.000 0.408 123 D N -0.675 119.802 120.400 0.128 0.000 2.123 123 D HA -0.262 4.401 4.640 0.039 0.000 0.196 123 D C 2.590 178.921 176.300 0.052 0.000 0.992 123 D CA 3.436 57.505 54.000 0.115 0.000 0.833 123 D CB -0.491 40.443 40.800 0.222 0.000 0.954 123 D HN -0.551 7.908 8.370 0.149 0.000 0.455 124 L N -0.250 121.052 121.223 0.131 0.000 2.056 124 L HA -0.263 4.162 4.340 0.141 0.000 0.207 124 L C 1.280 178.286 176.870 0.226 0.000 1.078 124 L CA 2.874 57.824 54.840 0.183 0.000 0.749 124 L CB -0.507 41.704 42.059 0.253 0.000 0.901 124 L HN -0.844 7.476 8.230 0.149 0.000 0.433 125 A N -0.705 122.265 122.820 0.251 0.000 1.883 125 A HA -0.349 4.172 4.320 0.335 0.000 0.217 125 A C 2.202 179.834 177.584 0.080 0.000 1.186 125 A CA 3.297 55.470 52.037 0.227 0.000 0.624 125 A CB -0.940 18.212 19.000 0.253 0.000 0.822 125 A HN 0.170 8.469 8.150 0.249 0.000 0.444 126 V N -1.689 118.181 119.914 -0.074 0.000 2.287 126 V HA -0.423 3.594 4.120 -0.171 0.000 0.248 126 V C 3.013 179.041 176.094 -0.109 0.000 1.053 126 V CA 3.898 66.071 62.300 -0.212 0.000 1.027 126 V CB -0.792 30.648 31.823 -0.638 0.000 0.646 126 V HN -0.106 8.025 8.190 -0.098 0.000 0.447 127 E N -0.340 119.829 120.200 -0.052 0.000 2.118 127 E HA -0.323 4.013 4.350 -0.023 0.000 0.195 127 E C 1.961 178.582 176.600 0.036 0.000 0.992 127 E CA 2.482 58.882 56.400 -0.001 0.000 0.804 127 E CB -0.228 29.493 29.700 0.034 0.000 0.741 127 E HN -0.574 7.757 8.360 -0.048 0.000 0.458 128 L N -4.882 116.396 121.223 0.092 0.000 2.552 128 L HA -0.086 4.304 4.340 0.084 0.000 0.227 128 L C -0.067 176.851 176.870 0.081 0.000 1.146 128 L CA 0.253 55.163 54.840 0.117 0.000 0.858 128 L CB 0.283 42.494 42.059 0.254 0.000 0.969 128 L HN -0.567 7.715 8.230 0.118 0.019 0.451 129 G N -5.007 103.820 108.800 0.046 0.000 2.184 129 G HA2 -0.329 3.628 3.960 -0.005 0.000 0.206 129 G HA3 -0.329 3.642 3.960 0.018 0.000 0.206 129 G C -0.914 173.997 174.900 0.018 0.000 0.995 129 G CA -0.399 44.711 45.100 0.017 0.000 0.651 129 G HN -0.699 7.380 8.290 0.036 0.233 0.511 130 A N 1.177 124.019 122.820 0.037 0.000 2.520 130 A HA 0.041 4.516 4.320 0.025 -0.140 0.245 130 A C -0.291 177.280 177.584 -0.021 0.000 1.072 130 A CA 0.122 52.171 52.037 0.019 0.000 0.761 130 A CB 0.379 19.397 19.000 0.031 0.000 1.004 130 A HN -0.232 7.955 8.150 0.061 0.000 0.499 131 K N 1.573 121.956 120.400 -0.029 0.000 2.353 131 K HA 0.355 4.630 4.320 -0.075 0.000 0.195 131 K C -0.085 176.470 176.600 -0.075 0.000 1.031 131 K CA -0.821 55.430 56.287 -0.061 0.000 1.079 131 K CB 1.101 33.563 32.500 -0.062 0.000 0.857 131 K HN -0.176 8.067 8.250 -0.013 0.000 0.535 132 T N 1.823 116.346 114.554 -0.051 0.000 2.861 132 T HA 0.636 5.346 4.350 -0.040 -0.384 0.287 132 T C -2.258 172.409 174.700 -0.055 0.000 1.003 132 T CA -0.416 61.658 62.100 -0.044 0.000 0.977 132 T CB 3.120 71.983 68.868 -0.009 0.000 0.996 132 T HN -0.745 7.468 8.240 -0.045 0.000 0.448 133 Y N 7.476 127.700 120.300 -0.127 0.000 2.345 133 Y HA 0.500 5.185 4.550 -0.091 -0.189 0.331 133 Y C -1.796 174.179 175.900 0.126 0.000 0.959 133 Y CA -1.632 56.439 58.100 -0.048 0.000 1.204 133 Y CB 2.499 40.918 38.460 -0.069 0.000 1.135 133 Y HN 0.801 9.107 8.280 0.043 0.000 0.477 134 V N 8.101 127.850 119.914 -0.275 0.000 2.732 134 V HA 0.346 4.737 4.120 0.107 -0.208 0.297 134 V C -1.194 174.959 176.094 0.098 0.000 1.060 134 V CA -0.752 61.517 62.300 -0.051 0.000 1.038 134 V CB 1.429 33.143 31.823 -0.182 0.000 1.003 134 V HN 0.160 8.011 8.190 -0.566 0.000 0.481 135 A N 6.032 129.033 122.820 0.301 0.000 2.375 135 A HA 0.419 4.895 4.320 0.260 0.000 0.291 135 A C -2.265 175.512 177.584 0.323 0.000 1.160 135 A CA -0.922 51.326 52.037 0.351 0.000 0.747 135 A CB 2.613 21.986 19.000 0.622 0.000 1.170 135 A HN 0.601 8.939 8.150 0.314 0.000 0.458 136 W N 6.754 128.092 121.300 0.063 0.000 2.282 136 W HA 0.466 5.154 4.660 0.047 0.000 0.322 136 W C -0.534 175.966 176.519 -0.032 0.000 1.011 136 W CA -1.912 55.447 57.345 0.024 0.000 1.392 136 W CB 1.502 30.959 29.460 -0.005 0.000 1.215 136 W HN 0.552 8.923 8.180 0.319 0.000 0.394 137 G N 8.146 116.660 108.800 -0.476 0.000 3.316 137 G HA2 0.012 3.629 3.960 -0.572 0.000 0.255 137 G HA3 0.012 3.735 3.960 -0.395 0.000 0.255 137 G C 0.046 174.384 174.900 -0.937 0.000 0.880 137 G CA -0.940 43.803 45.100 -0.595 0.000 1.956 137 G HN 0.487 8.636 8.290 -0.235 0.000 0.634 138 G N 1.001 108.778 108.800 -1.704 0.000 2.471 138 G HA2 -0.253 2.766 3.960 -1.569 0.000 0.219 138 G HA3 -0.253 2.007 3.960 -2.834 0.000 0.219 138 G C -0.083 174.371 174.900 -0.744 0.000 1.125 138 G CA 0.996 45.009 45.100 -1.811 0.000 0.775 138 G HN -0.300 6.850 8.290 -1.806 0.056 0.548 139 R N -4.142 116.051 120.500 -0.512 0.000 2.334 139 R HA 0.043 4.261 4.340 -0.203 0.000 0.216 139 R C -0.928 175.254 176.300 -0.197 0.000 0.905 139 R CA -1.085 54.867 56.100 -0.246 0.000 1.064 139 R CB -0.432 29.798 30.300 -0.116 0.000 1.046 139 R HN 0.083 7.981 8.270 -0.570 0.031 0.508 140 E N 0.748 120.797 120.200 -0.252 0.000 2.129 140 E HA 0.165 4.440 4.350 -0.124 0.000 0.283 140 E C -0.011 176.506 176.600 -0.138 0.000 1.080 140 E CA -0.819 55.479 56.400 -0.170 0.000 0.867 140 E CB -0.752 28.841 29.700 -0.179 0.000 1.056 140 E HN -0.824 7.158 8.360 -0.348 0.169 0.404 141 G N 1.952 110.697 108.800 -0.092 0.000 2.403 141 G HA2 0.107 4.026 3.960 -0.068 0.000 0.223 141 G HA3 0.107 4.209 3.960 -0.086 -0.194 0.223 141 G C -2.857 172.013 174.900 -0.050 0.000 1.287 141 G CA 0.250 45.305 45.100 -0.074 0.000 0.982 141 G HN -0.296 7.950 8.290 -0.075 0.000 0.471 142 A N -2.017 120.777 122.820 -0.043 0.000 2.597 142 A HA 0.425 4.730 4.320 -0.025 0.000 0.292 142 A C -2.127 175.443 177.584 -0.023 0.000 1.057 142 A CA -0.157 51.863 52.037 -0.028 0.000 0.674 142 A CB 2.603 21.591 19.000 -0.021 0.000 1.278 142 A HN -0.176 7.944 8.150 -0.048 0.000 0.416 143 E N -0.801 119.390 120.200 -0.016 0.000 2.431 143 E HA 0.125 4.468 4.350 -0.011 0.000 0.200 143 E C -0.417 176.179 176.600 -0.007 0.000 0.995 143 E CA 0.591 56.985 56.400 -0.010 0.000 0.915 143 E CB 0.675 30.370 29.700 -0.008 0.000 0.930 143 E HN 0.460 8.811 8.360 -0.015 0.000 0.496 144 S N -3.595 112.101 115.700 -0.007 0.000 2.588 144 S HA 0.284 4.753 4.470 -0.003 0.000 0.275 144 S C 0.736 175.334 174.600 -0.004 0.000 1.130 144 S CA -1.541 56.657 58.200 -0.004 0.000 0.855 144 S CB 3.143 66.342 63.200 -0.002 0.000 1.116 144 S HN -0.598 7.707 8.310 -0.009 0.000 0.472 145 G N 0.543 109.342 108.800 -0.001 0.000 2.403 145 G HA2 -0.146 3.814 3.960 -0.001 0.000 0.216 145 G HA3 -0.146 3.815 3.960 0.001 0.000 0.216 145 G C 0.594 175.495 174.900 0.001 0.000 1.154 145 G CA 1.110 46.210 45.100 -0.000 0.000 0.784 145 G HN 0.336 8.626 8.290 -0.000 0.000 0.538 146 A N -0.522 122.299 122.820 0.001 0.000 2.218 146 A HA 0.076 4.398 4.320 0.003 0.000 0.209 146 A C 0.461 178.046 177.584 0.001 0.000 1.168 146 A CA 0.224 52.262 52.037 0.002 0.000 0.804 146 A CB -0.342 18.659 19.000 0.002 0.000 0.834 146 A HN -0.175 7.975 8.150 0.001 0.000 0.482 147 A N -1.714 121.106 122.820 -0.001 0.000 2.015 147 A HA -0.124 4.196 4.320 -0.000 0.000 0.219 147 A C -0.174 177.410 177.584 -0.001 0.000 1.163 147 A CA 1.410 53.446 52.037 -0.001 0.000 0.646 147 A CB 0.238 19.236 19.000 -0.004 0.000 0.806 147 A HN -0.353 7.740 8.150 -0.001 0.057 0.448 148 K N -1.941 118.458 120.400 -0.001 0.000 2.578 148 K HA 0.124 4.445 4.320 0.002 0.000 0.250 148 K C -1.693 174.908 176.600 0.003 0.000 0.955 148 K CA -0.938 55.348 56.287 -0.001 0.000 0.825 148 K CB 1.373 33.868 32.500 -0.008 0.000 1.151 148 K HN -0.550 7.657 8.250 -0.002 0.042 0.432 149 D N 7.272 127.676 120.400 0.008 0.000 2.365 149 D HA 0.053 4.699 4.640 0.011 0.000 0.237 149 D C 0.279 176.588 176.300 0.015 0.000 1.190 149 D CA -0.901 53.106 54.000 0.011 0.000 0.867 149 D CB 0.269 41.077 40.800 0.013 0.000 1.050 149 D HN 0.238 8.613 8.370 0.008 0.000 0.491 150 V N 5.311 125.234 119.914 0.014 0.000 2.515 150 V HA -0.481 3.645 4.120 0.010 0.000 0.250 150 V C 1.504 177.616 176.094 0.031 0.000 1.058 150 V CA 3.254 65.564 62.300 0.017 0.000 1.064 150 V CB 0.278 32.108 31.823 0.013 0.000 0.675 150 V HN 0.442 8.640 8.190 0.013 0.000 0.461 151 R N -0.994 119.526 120.500 0.034 0.000 2.081 151 R HA -0.349 4.024 4.340 0.054 0.000 0.235 151 R C 2.376 178.704 176.300 0.046 0.000 1.131 151 R CA 3.586 59.712 56.100 0.043 0.000 0.960 151 R CB -0.463 29.858 30.300 0.035 0.000 0.856 151 R HN -0.576 7.792 8.270 0.029 -0.081 0.436 152 V N -0.232 119.703 119.914 0.036 0.000 2.427 152 V HA -0.235 4.067 4.120 0.037 -0.161 0.248 152 V C 2.013 178.132 176.094 0.042 0.000 1.051 152 V CA 2.782 65.103 62.300 0.035 0.000 1.048 152 V CB -0.615 31.223 31.823 0.025 0.000 0.666 152 V HN -0.472 8.015 8.190 0.030 -0.280 0.456 153 A N 0.613 123.455 122.820 0.037 0.000 1.908 153 A HA -0.356 3.987 4.320 0.039 0.000 0.218 153 A C 2.115 179.735 177.584 0.061 0.000 1.181 153 A CA 3.423 55.482 52.037 0.037 0.000 0.627 153 A CB -0.701 18.308 19.000 0.016 0.000 0.818 153 A HN 0.140 8.308 8.150 0.030 0.000 0.445 154 L N -2.423 118.847 121.223 0.077 0.000 2.083 154 L HA -0.492 3.933 4.340 0.143 0.000 0.209 154 L C 2.066 179.054 176.870 0.196 0.000 1.083 154 L CA 3.073 58.004 54.840 0.152 0.000 0.752 154 L CB -0.671 41.489 42.059 0.168 0.000 0.899 154 L HN 0.083 8.351 8.230 0.064 0.000 0.433 155 D N -0.169 120.301 120.400 0.116 0.000 2.104 155 D HA -0.302 4.391 4.640 0.088 0.000 0.194 155 D C 2.822 179.173 176.300 0.085 0.000 0.994 155 D CA 3.529 57.581 54.000 0.087 0.000 0.830 155 D CB -0.695 40.136 40.800 0.051 0.000 0.959 155 D HN -0.238 8.115 8.370 0.092 0.073 0.452 156 R N -1.458 119.087 120.500 0.075 0.000 2.092 156 R HA -0.148 4.211 4.340 0.031 0.000 0.231 156 R C 2.625 178.971 176.300 0.077 0.000 1.119 156 R CA 1.763 57.897 56.100 0.056 0.000 0.970 156 R CB -0.483 29.847 30.300 0.050 0.000 0.864 156 R HN -0.294 8.018 8.270 0.071 0.000 0.440 157 M N 0.514 120.206 119.600 0.153 0.000 2.086 157 M HA -0.353 4.245 4.480 0.197 0.000 0.261 157 M C 1.309 177.866 176.300 0.429 0.000 1.067 157 M CA 4.212 59.666 55.300 0.258 0.000 1.116 157 M CB -0.028 32.678 32.600 0.177 0.000 1.348 157 M HN 0.160 8.537 8.290 0.145 0.000 0.407 158 K N -1.024 119.646 120.400 0.450 0.000 2.032 158 K HA -0.435 4.043 4.320 0.263 0.000 0.209 158 K C 1.649 178.291 176.600 0.071 0.000 1.048 158 K CA 3.641 60.064 56.287 0.227 0.000 0.927 158 K CB -0.321 32.201 32.500 0.037 0.000 0.712 158 K HN -0.054 8.449 8.250 0.421 0.000 0.441 159 E N -0.832 119.385 120.200 0.029 0.000 2.058 159 E HA -0.356 3.973 4.350 -0.035 0.000 0.194 159 E C 1.972 178.495 176.600 -0.127 0.000 0.997 159 E CA 3.061 59.436 56.400 -0.041 0.000 0.801 159 E CB -0.067 29.611 29.700 -0.036 0.000 0.746 159 E HN -0.399 7.996 8.360 0.058 0.000 0.450 160 A N -0.911 121.765 122.820 -0.239 0.000 1.858 160 A HA -0.234 3.764 4.320 -0.536 0.000 0.216 160 A C 2.286 179.520 177.584 -0.583 0.000 1.190 160 A CA 3.114 54.791 52.037 -0.601 0.000 0.617 160 A CB -0.740 17.578 19.000 -1.136 0.000 0.827 160 A HN -0.374 7.677 8.150 -0.165 0.000 0.443 161 F N -2.608 117.179 119.950 -0.273 0.000 2.216 161 F HA -0.366 4.008 4.527 -0.255 0.000 0.300 161 F C 2.362 178.098 175.800 -0.106 0.000 1.085 161 F CA 3.794 61.676 58.000 -0.196 0.000 1.326 161 F CB -0.426 38.485 39.000 -0.149 0.000 1.027 161 F HN -0.136 8.080 8.300 -0.140 0.000 0.497 162 D N 0.588 121.015 120.400 0.044 0.000 2.117 162 D HA -0.257 4.462 4.640 0.132 0.000 0.197 162 D C 2.452 178.783 176.300 0.051 0.000 0.987 162 D CA 3.413 57.448 54.000 0.059 0.000 0.829 162 D CB -0.297 40.503 40.800 0.001 0.000 0.961 162 D HN 0.108 8.487 8.370 0.014 0.000 0.460 163 L N 0.776 121.978 121.223 -0.035 0.000 2.046 163 L HA -0.387 3.958 4.340 0.009 0.000 0.208 163 L C 1.351 178.234 176.870 0.021 0.000 1.077 163 L CA 3.379 58.203 54.840 -0.027 0.000 0.747 163 L CB -0.072 41.923 42.059 -0.105 0.000 0.896 163 L HN -0.271 7.908 8.230 -0.085 0.000 0.432 164 L N -2.827 118.365 121.223 -0.052 0.000 2.079 164 L HA -0.452 3.944 4.340 0.094 0.000 0.210 164 L C 2.226 179.252 176.870 0.259 0.000 1.081 164 L CA 3.106 57.968 54.840 0.036 0.000 0.752 164 L CB -0.826 41.079 42.059 -0.258 0.000 0.896 164 L HN -0.211 7.933 8.230 -0.144 0.000 0.433 165 G N -2.060 106.898 108.800 0.263 0.000 2.408 165 G HA2 -0.386 3.822 3.960 0.413 0.000 0.217 165 G HA3 -0.386 3.793 3.960 0.365 0.000 0.217 165 G C 0.932 175.953 174.900 0.202 0.000 1.150 165 G CA 1.876 47.172 45.100 0.327 0.000 0.776 165 G HN -0.070 8.347 8.290 0.225 0.008 0.542 166 E N 3.246 123.538 120.200 0.154 0.000 2.077 166 E HA -0.328 4.065 4.350 0.071 0.000 0.193 166 E C 1.474 178.127 176.600 0.088 0.000 0.989 166 E CA 2.554 59.011 56.400 0.096 0.000 0.800 166 E CB -0.470 29.275 29.700 0.075 0.000 0.746 166 E HN -0.197 8.178 8.360 0.151 0.076 0.452 167 Y N 1.137 121.447 120.300 0.017 0.000 2.114 167 Y HA -0.296 4.225 4.550 -0.047 0.000 0.284 167 Y C 2.123 177.988 175.900 -0.059 0.000 1.143 167 Y CA 3.269 61.357 58.100 -0.019 0.000 1.135 167 Y CB 0.120 38.583 38.460 0.005 0.000 0.980 167 Y HN -0.019 8.419 8.280 0.264 0.000 0.499 168 V N -1.823 118.085 119.914 -0.010 0.000 2.282 168 V HA -0.589 3.392 4.120 -0.232 0.000 0.249 168 V C 2.291 178.252 176.094 -0.222 0.000 1.057 168 V CA 4.606 66.850 62.300 -0.094 0.000 1.032 168 V CB -0.957 30.966 31.823 0.165 0.000 0.645 168 V HN -0.095 8.249 8.190 0.256 0.000 0.447 169 T N 0.706 115.199 114.554 -0.102 0.000 2.708 169 T HA -0.360 3.942 4.350 -0.080 0.000 0.266 169 T C 2.693 177.292 174.700 -0.170 0.000 1.037 169 T CA 4.889 66.933 62.100 -0.094 0.000 1.146 169 T CB -0.136 68.719 68.868 -0.023 0.000 0.865 169 T HN -0.220 8.007 8.240 -0.022 0.000 0.435 170 S N 1.266 116.842 115.700 -0.207 0.000 2.423 170 S HA -0.225 4.154 4.470 -0.151 0.000 0.231 170 S C 1.439 175.838 174.600 -0.336 0.000 1.014 170 S CA 3.234 61.303 58.200 -0.218 0.000 0.965 170 S CB -0.650 62.450 63.200 -0.166 0.000 0.785 170 S HN -0.047 8.153 8.310 -0.184 0.000 0.495 171 Q N -1.099 118.349 119.800 -0.586 0.000 2.424 171 Q HA 0.081 4.083 4.340 -0.564 0.000 0.204 171 Q C 0.541 176.230 176.000 -0.518 0.000 0.933 171 Q CA -0.210 55.129 55.803 -0.774 0.000 0.929 171 Q CB 0.241 27.968 28.738 -1.685 0.000 1.037 171 Q HN -0.592 7.252 8.270 -0.658 0.031 0.511 172 G N -1.472 107.130 108.800 -0.330 0.000 2.153 172 G HA2 -0.397 3.499 3.960 -0.105 0.000 0.252 172 G HA3 -0.397 3.501 3.960 -0.103 0.000 0.252 172 G C -0.171 174.723 174.900 -0.009 0.000 0.994 172 G CA 0.662 45.681 45.100 -0.136 0.000 0.698 172 G HN -0.538 7.379 8.290 -0.328 0.176 0.521 173 Y N -0.348 119.883 120.300 -0.115 0.000 2.411 173 Y HA -0.176 4.324 4.550 -0.084 0.000 0.333 173 Y C -0.591 175.251 175.900 -0.097 0.000 1.186 173 Y CA -0.826 57.213 58.100 -0.102 0.000 1.381 173 Y CB 0.224 38.614 38.460 -0.116 0.000 1.273 173 Y HN -0.575 7.549 8.280 -0.211 0.029 0.546 174 D N 2.906 123.349 120.400 0.072 0.000 2.499 174 D HA 0.171 4.797 4.640 -0.023 0.000 0.225 174 D C -1.309 174.952 176.300 -0.065 0.000 1.124 174 D CA -0.199 53.792 54.000 -0.016 0.000 0.938 174 D CB 0.621 41.399 40.800 -0.038 0.000 1.014 174 D HN 0.200 8.612 8.370 0.070 0.000 0.517 175 I N 1.489 122.005 120.570 -0.090 0.000 2.894 175 I HA 0.210 4.444 4.170 -0.152 -0.155 0.302 175 I C -2.403 173.554 176.117 -0.266 0.000 1.188 175 I CA -1.740 59.459 61.300 -0.169 0.000 1.014 175 I CB 3.805 41.696 38.000 -0.182 0.000 1.242 175 I HN -0.260 7.753 8.210 -0.039 0.173 0.430 176 R N 0.489 120.811 120.500 -0.296 0.000 2.855 176 R HA 0.510 4.605 4.340 -0.408 0.000 0.266 176 R C -2.323 173.797 176.300 -0.300 0.000 1.034 176 R CA -2.591 53.328 56.100 -0.300 0.000 0.944 176 R CB 3.079 33.304 30.300 -0.124 0.000 1.219 176 R HN 0.014 8.145 8.270 -0.232 0.000 0.474 177 F N -1.669 118.385 119.950 0.174 0.000 2.425 177 F HA 0.775 5.707 4.527 0.327 -0.209 0.331 177 F C -0.917 175.077 175.800 0.322 0.000 1.085 177 F CA -2.095 56.073 58.000 0.280 0.000 1.028 177 F CB 3.515 42.707 39.000 0.320 0.000 1.177 177 F HN 0.369 8.716 8.300 0.078 0.000 0.487 178 A N 1.398 124.491 122.820 0.454 0.000 2.375 178 A HA 0.629 5.185 4.320 0.230 -0.098 0.291 178 A C -1.755 175.986 177.584 0.262 0.000 1.160 178 A CA -1.431 50.783 52.037 0.295 0.000 0.747 178 A CB 2.174 21.333 19.000 0.265 0.000 1.170 178 A HN 0.691 9.128 8.150 0.478 0.000 0.458 179 I N 5.133 125.815 120.570 0.186 0.000 2.371 179 I HA 0.153 4.627 4.170 0.227 -0.168 0.290 179 I C -0.625 175.597 176.117 0.174 0.000 1.028 179 I CA -0.086 61.309 61.300 0.157 0.000 1.345 179 I CB 1.225 39.227 38.000 0.003 0.000 1.407 179 I HN 0.553 8.846 8.210 0.139 0.000 0.501 180 E N 8.583 128.930 120.200 0.245 0.000 2.081 180 E HA 0.567 5.203 4.350 0.241 -0.142 0.276 180 E C -2.161 174.651 176.600 0.354 0.000 0.950 180 E CA -3.636 52.942 56.400 0.296 0.000 0.776 180 E CB 2.628 32.533 29.700 0.341 0.000 1.094 180 E HN 0.088 8.613 8.360 0.274 0.000 0.402 181 P HA 0.402 5.044 4.420 0.183 -0.113 0.276 181 P C -1.687 175.811 177.300 0.331 0.000 1.244 181 P CA -0.947 62.299 63.100 0.243 0.000 0.801 181 P CB 1.429 33.241 31.700 0.187 0.000 1.006 182 K N -1.543 118.968 120.400 0.186 0.000 2.557 182 K HA 0.469 4.793 4.320 0.006 0.000 0.261 182 K C -1.843 174.746 176.600 -0.018 0.000 0.932 182 K CA -2.285 54.013 56.287 0.019 0.000 0.829 182 K CB 3.515 35.956 32.500 -0.098 0.000 1.358 182 K HN -0.576 7.750 8.250 0.127 0.000 0.430 183 P HA 0.066 4.516 4.420 -0.066 -0.069 0.221 183 P C -1.849 175.420 177.300 -0.052 0.000 1.155 183 P CA 0.851 63.923 63.100 -0.048 0.000 0.812 183 P CB 0.752 32.438 31.700 -0.024 0.000 0.801 184 N N -4.004 114.668 118.700 -0.046 0.000 3.046 184 N HA -0.104 4.688 4.740 -0.036 -0.074 0.243 184 N C -2.135 173.366 175.510 -0.014 0.000 1.452 184 N CA -0.673 52.359 53.050 -0.029 0.000 0.882 184 N CB 3.036 41.513 38.487 -0.016 0.000 1.425 184 N HN -0.651 7.693 8.380 -0.059 0.000 0.517 185 E N -2.066 118.138 120.200 0.006 0.000 7.334 185 E HA -0.175 4.193 4.350 0.031 0.000 0.208 185 E C -2.157 174.495 176.600 0.086 0.000 0.948 185 E CA -0.004 56.417 56.400 0.035 0.000 1.626 185 E CB 0.954 30.679 29.700 0.043 0.000 0.908 185 E HN 0.316 8.674 8.360 -0.003 0.000 0.271 186 P HA 0.151 4.591 4.420 0.033 0.000 0.257 186 P C -0.989 176.305 177.300 -0.010 0.000 1.241 186 P CA 0.183 63.297 63.100 0.024 0.000 0.816 186 P CB 0.592 32.312 31.700 0.035 0.000 1.150 187 R N -1.239 119.238 120.500 -0.038 0.000 2.528 187 R HA 0.294 4.778 4.340 -0.033 -0.164 0.271 187 R C 1.806 178.089 176.300 -0.027 0.000 1.056 187 R CA -2.438 53.637 56.100 -0.042 0.000 1.117 187 R CB -0.018 30.240 30.300 -0.070 0.000 1.085 187 R HN -1.007 7.230 8.270 -0.054 0.000 0.530 188 G N 2.628 111.416 108.800 -0.021 0.000 2.440 188 G HA2 -0.276 3.681 3.960 -0.005 0.000 0.218 188 G HA3 -0.276 3.677 3.960 -0.011 0.000 0.218 188 G C -0.467 174.421 174.900 -0.021 0.000 1.154 188 G CA 1.187 46.279 45.100 -0.013 0.000 0.767 188 G HN 0.298 8.885 8.290 -0.022 -0.311 0.552 189 D N 0.186 120.565 120.400 -0.034 0.000 2.879 189 D HA 0.415 5.168 4.640 -0.046 -0.140 0.236 189 D C -1.783 174.477 176.300 -0.068 0.000 1.171 189 D CA -0.180 53.791 54.000 -0.048 0.000 0.868 189 D CB 3.755 44.528 40.800 -0.045 0.000 1.598 189 D HN -0.493 7.856 8.370 -0.035 0.000 0.497 190 I N 1.302 121.822 120.570 -0.084 0.000 2.437 190 I HA 0.391 4.672 4.170 -0.119 -0.182 0.298 190 I C -0.143 175.901 176.117 -0.122 0.000 0.984 190 I CA -0.996 60.237 61.300 -0.111 0.000 1.214 190 I CB 2.010 39.944 38.000 -0.110 0.000 1.365 190 I HN 0.007 8.170 8.210 -0.078 0.000 0.469 191 L N 4.960 126.105 121.223 -0.131 0.000 2.439 191 L HA -0.013 4.251 4.340 -0.126 0.000 0.269 191 L C 0.041 176.821 176.870 -0.150 0.000 1.179 191 L CA 0.372 55.131 54.840 -0.134 0.000 0.828 191 L CB 0.472 42.455 42.059 -0.127 0.000 1.106 191 L HN -0.136 8.012 8.230 -0.136 0.000 0.467 192 L N -4.622 116.512 121.223 -0.148 0.000 3.573 192 L HA -0.213 4.110 4.340 -0.027 0.000 0.578 192 L C -1.449 175.362 176.870 -0.098 0.000 1.299 192 L CA -0.424 54.358 54.840 -0.096 0.000 0.914 192 L CB -1.969 40.020 42.059 -0.116 0.000 1.563 192 L HN 0.291 8.439 8.230 -0.136 0.000 0.860 193 P HA 0.091 4.610 4.420 -0.106 -0.163 0.231 193 P C -0.245 177.027 177.300 -0.046 0.000 1.168 193 P CA 0.624 63.611 63.100 -0.188 0.000 0.779 193 P CB 0.571 32.086 31.700 -0.308 0.000 0.844 194 T N -9.369 105.219 114.554 0.057 0.000 2.841 194 T HA 0.233 4.812 4.350 0.169 -0.128 0.296 194 T C 0.528 175.362 174.700 0.223 0.000 1.166 194 T CA -3.061 59.159 62.100 0.200 0.000 1.007 194 T CB 3.099 72.137 68.868 0.283 0.000 1.253 194 T HN -1.029 7.187 8.240 0.036 0.046 0.511 195 V N 1.036 121.061 119.914 0.184 0.000 2.282 195 V HA -0.404 3.795 4.120 0.131 0.000 0.249 195 V C 1.455 177.620 176.094 0.119 0.000 1.057 195 V CA 4.053 66.433 62.300 0.134 0.000 1.032 195 V CB -0.579 31.295 31.823 0.085 0.000 0.645 195 V HN 0.232 8.966 8.190 0.185 -0.433 0.447 196 G N -2.353 106.516 108.800 0.115 0.000 2.446 196 G HA2 -0.337 3.640 3.960 0.028 0.000 0.217 196 G HA3 -0.337 3.610 3.960 -0.021 0.000 0.217 196 G C 1.245 176.155 174.900 0.017 0.000 1.168 196 G CA 2.348 47.467 45.100 0.032 0.000 0.771 196 G HN -0.315 8.058 8.290 0.138 0.000 0.551 197 H N 2.637 121.739 119.070 0.053 0.000 2.352 197 H HA -0.313 4.280 4.556 0.062 0.000 0.299 197 H C 2.283 177.656 175.328 0.075 0.000 1.097 197 H CA 3.897 59.979 56.048 0.056 0.000 1.311 197 H CB -0.384 29.399 29.762 0.035 0.000 1.377 197 H HN -0.687 7.792 8.280 0.332 0.000 0.504 198 A N -0.959 121.975 122.820 0.189 0.000 1.873 198 A HA -0.348 4.054 4.320 0.135 0.000 0.215 198 A C 1.473 179.137 177.584 0.132 0.000 1.186 198 A CA 3.205 55.325 52.037 0.138 0.000 0.616 198 A CB -0.449 18.610 19.000 0.099 0.000 0.823 198 A HN -0.330 7.941 8.150 0.201 0.000 0.442 199 L N -2.143 119.131 121.223 0.085 0.000 2.042 199 L HA -0.488 3.866 4.340 0.024 0.000 0.210 199 L C 2.290 179.189 176.870 0.048 0.000 1.076 199 L CA 3.126 57.995 54.840 0.047 0.000 0.749 199 L CB -0.396 41.688 42.059 0.043 0.000 0.893 199 L HN -0.140 8.142 8.230 0.087 0.000 0.432 200 A N -1.220 121.639 122.820 0.065 0.000 1.898 200 A HA -0.276 4.057 4.320 0.022 0.000 0.216 200 A C 1.772 179.395 177.584 0.065 0.000 1.181 200 A CA 2.818 54.884 52.037 0.048 0.000 0.620 200 A CB -0.732 18.286 19.000 0.029 0.000 0.819 200 A HN -0.227 7.954 8.150 0.070 0.011 0.442 201 F N -0.590 119.340 119.950 -0.033 0.000 2.134 201 F HA -0.364 4.139 4.527 -0.040 0.000 0.299 201 F C 1.786 177.517 175.800 -0.114 0.000 1.097 201 F CA 3.011 60.977 58.000 -0.057 0.000 1.264 201 F CB 0.375 39.347 39.000 -0.048 0.000 1.001 201 F HN -0.614 7.848 8.300 0.269 0.000 0.479 202 I N -1.977 118.507 120.570 -0.144 0.000 2.335 202 I HA -0.540 3.332 4.170 -0.497 0.000 0.251 202 I C 2.003 177.960 176.117 -0.266 0.000 1.129 202 I CA 3.934 65.065 61.300 -0.283 0.000 1.402 202 I CB -0.457 37.487 38.000 -0.094 0.000 1.069 202 I HN -0.244 7.999 8.210 0.056 0.000 0.424 203 E N -2.483 117.618 120.200 -0.166 0.000 2.268 203 E HA -0.251 4.044 4.350 -0.092 0.000 0.195 203 E C 0.880 177.384 176.600 -0.159 0.000 0.995 203 E CA 1.775 58.103 56.400 -0.120 0.000 0.836 203 E CB -0.718 28.943 29.700 -0.065 0.000 0.763 203 E HN -0.614 7.647 8.360 -0.123 0.025 0.491 204 R N -3.649 116.697 120.500 -0.256 0.000 2.317 204 R HA 0.089 4.330 4.340 -0.165 0.000 0.208 204 R C -0.494 175.618 176.300 -0.313 0.000 0.914 204 R CA -1.201 54.750 56.100 -0.249 0.000 1.060 204 R CB 0.409 30.570 30.300 -0.232 0.000 1.015 204 R HN -0.429 7.502 8.270 -0.320 0.147 0.498 205 L N -1.490 119.493 121.223 -0.400 0.000 2.453 205 L HA -0.277 3.838 4.340 -0.375 0.000 0.261 205 L C -0.281 176.494 176.870 -0.159 0.000 1.179 205 L CA 0.325 54.943 54.840 -0.371 0.000 0.813 205 L CB 0.185 41.877 42.059 -0.610 0.000 1.110 205 L HN -0.599 7.155 8.230 -0.419 0.224 0.466 206 E N 1.649 121.799 120.200 -0.083 0.000 2.150 206 E HA -0.205 4.130 4.350 -0.025 0.000 0.193 206 E C 0.510 177.143 176.600 0.054 0.000 0.985 206 E CA 1.982 58.377 56.400 -0.008 0.000 0.814 206 E CB 0.677 30.383 29.700 0.010 0.000 0.752 206 E HN 0.267 8.934 8.360 -0.098 -0.366 0.466 207 R N -3.291 117.298 120.500 0.148 0.000 2.651 207 R HA 0.530 5.008 4.340 0.132 -0.060 0.282 207 R C -2.043 174.449 176.300 0.320 0.000 1.565 207 R CA -2.946 53.279 56.100 0.208 0.000 1.661 207 R CB -0.312 30.123 30.300 0.226 0.000 1.189 207 R HN -0.226 8.152 8.270 0.179 0.000 0.621 208 P HA -0.152 4.421 4.420 0.255 0.000 0.221 208 P C 0.927 178.399 177.300 0.286 0.000 1.145 208 P CA 2.030 65.260 63.100 0.218 0.000 0.795 208 P CB 0.281 32.016 31.700 0.059 0.000 0.775 209 E N -3.015 117.310 120.200 0.208 0.000 2.265 209 E HA -0.226 4.249 4.350 0.208 0.000 0.196 209 E C 0.769 177.508 176.600 0.232 0.000 0.996 209 E CA 2.309 58.825 56.400 0.195 0.000 0.832 209 E CB -1.656 28.113 29.700 0.116 0.000 0.756 209 E HN 0.537 8.921 8.360 0.170 0.077 0.491 210 L N -2.342 118.976 121.223 0.160 0.000 2.599 210 L HA -0.032 4.321 4.340 0.021 0.000 0.230 210 L C -1.667 175.139 176.870 -0.108 0.000 1.141 210 L CA 0.487 55.289 54.840 -0.063 0.000 0.877 210 L CB 0.211 42.087 42.059 -0.306 0.000 1.009 210 L HN -0.616 7.698 8.230 0.217 0.046 0.447 211 Y N -3.573 116.936 120.300 0.349 0.000 2.442 211 Y HA 0.638 5.587 4.550 0.354 -0.186 0.344 211 Y C -0.756 174.979 175.900 -0.276 0.000 0.976 211 Y CA -1.799 56.418 58.100 0.195 0.000 1.040 211 Y CB 2.958 41.450 38.460 0.053 0.000 1.228 211 Y HN -0.510 7.936 8.280 0.399 0.074 0.451 212 G N -0.394 108.099 108.800 -0.511 0.000 3.135 212 G HA2 0.788 4.271 3.960 -0.795 0.000 0.278 212 G HA3 0.788 3.504 3.960 -2.201 -0.076 0.278 212 G C -2.730 171.977 174.900 -0.321 0.000 1.302 212 G CA -1.376 43.103 45.100 -1.034 0.000 0.880 212 G HN 0.668 8.885 8.290 -0.121 0.000 0.574 213 V N -5.781 113.997 119.914 -0.227 0.000 2.732 213 V HA 0.702 5.011 4.120 0.030 -0.171 0.310 213 V C -2.004 174.145 176.094 0.092 0.000 1.053 213 V CA -3.938 58.356 62.300 -0.009 0.000 0.957 213 V CB 2.364 34.194 31.823 0.011 0.000 1.018 213 V HN 0.168 8.163 8.190 -0.326 0.000 0.452 214 N N 2.462 121.251 118.700 0.148 0.000 2.904 214 N HA 0.583 5.658 4.740 0.224 -0.200 0.257 214 N C -2.304 173.315 175.510 0.181 0.000 1.363 214 N CA -3.561 49.609 53.050 0.199 0.000 0.856 214 N CB 1.125 39.737 38.487 0.209 0.000 1.166 214 N HN 0.065 8.427 8.380 0.144 0.104 0.499 215 P HA 0.101 4.661 4.420 0.234 0.000 0.274 215 P C -2.286 175.163 177.300 0.248 0.000 1.231 215 P CA -0.464 62.782 63.100 0.244 0.000 0.790 215 P CB 0.994 32.831 31.700 0.230 0.000 0.951 216 E N 1.406 121.667 120.200 0.102 0.000 2.210 216 E HA 0.506 4.978 4.350 -0.174 -0.227 0.266 216 E C 1.061 177.327 176.600 -0.556 0.000 0.883 216 E CA -2.654 53.589 56.400 -0.261 0.000 0.761 216 E CB 2.809 32.048 29.700 -0.769 0.000 1.156 216 E HN 0.143 8.591 8.360 0.145 0.000 0.412 217 V N 7.130 126.430 119.914 -1.023 0.000 2.231 217 V HA -0.501 1.718 4.120 -3.168 0.000 0.250 217 V C 1.730 177.440 176.094 -0.640 0.000 1.058 217 V CA 4.427 65.837 62.300 -1.483 0.000 1.022 217 V CB -0.496 30.892 31.823 -0.725 0.000 0.640 217 V HN 0.211 7.974 8.190 -0.710 0.000 0.445 218 G N -4.377 104.216 108.800 -0.345 0.000 2.422 218 G HA2 -0.278 3.600 3.960 -0.136 0.000 0.218 218 G HA3 -0.278 3.623 3.960 -0.098 0.000 0.218 218 G C 0.908 175.817 174.900 0.015 0.000 1.140 218 G CA 1.968 46.986 45.100 -0.137 0.000 0.775 218 G HN -0.298 7.986 8.290 -0.355 -0.207 0.545 219 H N 2.526 121.527 119.070 -0.115 0.000 2.321 219 H HA -0.275 4.258 4.556 -0.039 0.000 0.300 219 H C 2.596 177.936 175.328 0.021 0.000 1.087 219 H CA 2.063 58.091 56.048 -0.034 0.000 1.319 219 H CB 0.180 29.943 29.762 0.001 0.000 1.379 219 H HN -0.726 7.474 8.280 -0.095 0.024 0.501 220 E N -2.681 117.642 120.200 0.204 0.000 2.153 220 E HA -0.306 4.162 4.350 0.197 0.000 0.194 220 E C 2.426 179.102 176.600 0.127 0.000 0.988 220 E CA 2.286 58.813 56.400 0.212 0.000 0.811 220 E CB -0.746 29.179 29.700 0.376 0.000 0.746 220 E HN -0.638 7.828 8.360 0.177 0.000 0.466 221 Q N -1.278 118.563 119.800 0.069 0.000 2.291 221 Q HA -0.145 4.222 4.340 0.044 0.000 0.205 221 Q C 3.006 179.015 176.000 0.016 0.000 0.970 221 Q CA 2.171 57.991 55.803 0.029 0.000 0.876 221 Q CB -0.084 28.644 28.738 -0.017 0.000 0.935 221 Q HN -0.682 7.598 8.270 0.038 0.014 0.455 222 M N -1.348 118.265 119.600 0.022 0.000 2.549 222 M HA -0.157 4.317 4.480 -0.009 0.000 0.260 222 M C 0.636 176.948 176.300 0.018 0.000 1.076 222 M CA 2.659 57.963 55.300 0.008 0.000 1.090 222 M CB 0.155 32.754 32.600 -0.000 0.000 1.418 222 M HN -0.328 7.851 8.290 0.040 0.135 0.486 223 A N -4.248 118.594 122.820 0.037 0.000 2.430 223 A HA 0.233 4.570 4.320 0.028 0.000 0.243 223 A C -0.134 177.473 177.584 0.038 0.000 1.254 223 A CA -1.111 50.950 52.037 0.039 0.000 0.914 223 A CB 0.649 19.680 19.000 0.053 0.000 0.998 223 A HN -0.653 7.366 8.150 0.051 0.162 0.515 224 G N -0.631 108.187 108.800 0.031 0.000 2.168 224 G HA2 -0.329 3.641 3.960 0.016 0.000 0.257 224 G HA3 -0.329 3.643 3.960 0.019 0.000 0.257 224 G C -0.065 174.852 174.900 0.028 0.000 0.997 224 G CA 0.855 45.969 45.100 0.023 0.000 0.708 224 G HN -0.415 7.698 8.290 0.028 0.194 0.520 225 L N -2.302 118.952 121.223 0.052 0.000 2.439 225 L HA 0.029 4.390 4.340 0.036 0.000 0.259 225 L C -0.681 176.220 176.870 0.051 0.000 1.129 225 L CA -1.136 53.738 54.840 0.056 0.000 0.803 225 L CB 0.898 43.013 42.059 0.093 0.000 1.161 225 L HN -0.668 7.562 8.230 0.063 0.038 0.462 226 N N -0.591 118.110 118.700 0.002 0.000 2.415 226 N HA -0.041 4.677 4.740 -0.037 0.000 0.246 226 N C -0.034 175.516 175.510 0.066 0.000 1.078 226 N CA -0.928 52.081 53.050 -0.068 0.000 0.942 226 N CB 0.010 38.255 38.487 -0.403 0.000 1.140 226 N HN 0.096 8.474 8.380 -0.004 0.000 0.501 227 F N 9.076 129.021 119.950 -0.009 0.000 2.102 227 F HA -0.029 4.521 4.527 0.039 0.000 0.298 227 F C -1.521 174.312 175.800 0.055 0.000 1.105 227 F CA 4.555 62.575 58.000 0.034 0.000 1.239 227 F CB -1.713 37.315 39.000 0.046 0.000 0.991 227 F HN 0.427 8.882 8.300 0.257 0.000 0.474 228 P HA -0.352 4.028 4.420 -0.066 0.000 0.216 228 P C 1.747 179.064 177.300 0.029 0.000 1.153 228 P CA 3.502 66.611 63.100 0.015 0.000 0.858 228 P CB -0.550 31.237 31.700 0.145 0.000 0.789 229 H N -2.296 116.714 119.070 -0.099 0.000 2.353 229 H HA -0.332 4.150 4.556 -0.124 0.000 0.300 229 H C 2.460 177.708 175.328 -0.134 0.000 1.090 229 H CA 2.472 58.451 56.048 -0.116 0.000 1.327 229 H CB 0.068 29.773 29.762 -0.094 0.000 1.383 229 H HN -0.018 8.658 8.280 0.111 -0.330 0.508 230 G N -0.419 108.370 108.800 -0.017 0.000 2.422 230 G HA2 -0.325 3.615 3.960 -0.033 0.000 0.218 230 G HA3 -0.325 3.583 3.960 -0.086 0.000 0.218 230 G C 1.181 175.975 174.900 -0.176 0.000 1.146 230 G CA 1.943 46.992 45.100 -0.085 0.000 0.769 230 G HN -0.255 8.034 8.290 -0.002 0.000 0.547 231 I N 2.183 122.547 120.570 -0.345 0.000 2.226 231 I HA -0.371 3.618 4.170 -0.302 0.000 0.245 231 I C 1.765 177.799 176.117 -0.139 0.000 1.100 231 I CA 1.375 62.484 61.300 -0.318 0.000 1.374 231 I CB -1.356 36.362 38.000 -0.470 0.000 1.057 231 I HN -0.021 7.920 8.210 -0.448 0.000 0.413 232 A N -0.657 122.104 122.820 -0.098 0.000 1.908 232 A HA -0.410 3.899 4.320 -0.018 0.000 0.218 232 A C 2.037 179.624 177.584 0.006 0.000 1.181 232 A CA 3.448 55.458 52.037 -0.044 0.000 0.627 232 A CB -1.018 17.932 19.000 -0.084 0.000 0.818 232 A HN 0.048 8.058 8.150 -0.110 0.074 0.445 233 Q N -0.754 119.032 119.800 -0.024 0.000 2.079 233 Q HA -0.332 4.048 4.340 0.067 0.000 0.200 233 Q C 2.141 178.226 176.000 0.142 0.000 0.974 233 Q CA 2.938 58.770 55.803 0.049 0.000 0.840 233 Q CB -0.084 28.647 28.738 -0.011 0.000 0.898 233 Q HN -0.298 7.936 8.270 -0.059 0.000 0.430 234 A N 0.037 122.887 122.820 0.051 0.000 1.902 234 A HA -0.333 4.021 4.320 0.056 0.000 0.217 234 A C 1.977 179.607 177.584 0.076 0.000 1.181 234 A CA 3.194 55.257 52.037 0.044 0.000 0.623 234 A CB -0.532 18.457 19.000 -0.019 0.000 0.818 234 A HN -0.283 7.865 8.150 -0.002 0.000 0.443 235 L N -2.709 118.560 121.223 0.077 0.000 2.046 235 L HA -0.370 4.029 4.340 0.098 0.000 0.208 235 L C 2.633 179.593 176.870 0.150 0.000 1.077 235 L CA 2.653 57.555 54.840 0.103 0.000 0.747 235 L CB -0.298 41.810 42.059 0.083 0.000 0.896 235 L HN -0.050 8.206 8.230 0.043 0.000 0.432 236 W N 1.234 122.525 121.300 -0.015 0.000 2.342 236 W HA -0.400 4.255 4.660 -0.008 0.000 0.297 236 W C 1.012 177.530 176.519 -0.003 0.000 1.213 236 W CA 3.291 60.628 57.345 -0.013 0.000 1.251 236 W CB -0.002 29.440 29.460 -0.030 0.000 1.136 236 W HN 0.075 8.442 8.180 0.311 0.000 0.526 237 A N -4.960 117.910 122.820 0.084 0.000 2.208 237 A HA 0.032 4.199 4.320 -0.255 0.000 0.209 237 A C 0.344 177.894 177.584 -0.057 0.000 1.161 237 A CA 0.121 52.117 52.037 -0.068 0.000 0.782 237 A CB 0.327 19.358 19.000 0.052 0.000 0.816 237 A HN -0.642 7.622 8.150 0.222 0.019 0.477 238 G N -0.312 108.490 108.800 0.003 0.000 2.198 238 G HA2 -0.275 3.737 3.960 0.088 0.000 0.257 238 G HA3 -0.275 3.712 3.960 0.047 0.000 0.257 238 G C -0.380 174.614 174.900 0.156 0.000 1.042 238 G CA 0.474 45.616 45.100 0.070 0.000 0.791 238 G HN -0.440 7.670 8.290 0.023 0.194 0.502 239 K N -3.338 117.110 120.400 0.081 0.000 2.469 239 K HA 0.312 4.509 4.320 -0.204 0.000 0.204 239 K C -1.562 175.000 176.600 -0.063 0.000 1.047 239 K CA -1.613 54.611 56.287 -0.106 0.000 1.072 239 K CB 0.760 33.154 32.500 -0.176 0.000 0.863 239 K HN -0.122 8.169 8.250 0.069 0.000 0.530 240 L N 1.894 123.217 121.223 0.166 0.000 2.387 240 L HA 0.069 4.468 4.340 0.098 0.000 0.267 240 L C -0.858 176.286 176.870 0.455 0.000 1.197 240 L CA -0.437 54.516 54.840 0.187 0.000 1.070 240 L CB -1.125 40.983 42.059 0.082 0.000 1.349 240 L HN -0.185 8.160 8.230 0.192 0.000 0.422 241 F N 4.010 124.063 119.950 0.171 0.000 2.512 241 F HA -0.147 4.486 4.527 0.177 0.000 0.296 241 F C -0.478 175.499 175.800 0.295 0.000 1.110 241 F CA -0.502 57.616 58.000 0.196 0.000 1.446 241 F CB 0.766 39.856 39.000 0.150 0.000 1.092 241 F HN -0.358 8.148 8.300 0.344 0.000 0.554 242 H N -3.591 115.679 119.070 0.333 0.000 2.950 242 H HA 0.382 5.125 4.556 0.313 0.000 0.307 242 H C -2.073 173.331 175.328 0.126 0.000 1.403 242 H CA -0.455 55.735 56.048 0.236 0.000 1.145 242 H CB 4.046 33.894 29.762 0.143 0.000 1.844 242 H HN -0.825 7.664 8.280 0.412 0.039 0.515 243 I N 0.332 120.821 120.570 -0.136 0.000 2.827 243 I HA 0.191 4.561 4.170 0.080 -0.152 0.298 243 I C -3.277 172.833 176.117 -0.011 0.000 1.235 243 I CA -1.558 59.713 61.300 -0.047 0.000 1.021 243 I CB 4.259 42.130 38.000 -0.214 0.000 1.259 243 I HN 0.185 8.028 8.210 -0.611 0.000 0.427 244 D N 6.359 126.801 120.400 0.071 0.000 2.381 244 D HA 0.528 5.372 4.640 0.085 -0.153 0.235 244 D C -1.059 175.172 176.300 -0.115 0.000 1.068 244 D CA -1.218 52.804 54.000 0.037 0.000 0.832 244 D CB 1.819 42.654 40.800 0.059 0.000 1.101 244 D HN 0.102 8.533 8.370 0.101 0.000 0.515 245 L N 3.150 124.241 121.223 -0.220 0.000 2.307 245 L HA 0.398 4.636 4.340 -0.169 0.000 0.284 245 L C -1.747 175.172 176.870 0.082 0.000 1.023 245 L CA -0.553 54.159 54.840 -0.213 0.000 0.810 245 L CB 1.078 42.740 42.059 -0.661 0.000 1.231 245 L HN 0.579 8.633 8.230 -0.293 0.000 0.423 246 N N 0.573 119.403 118.700 0.217 0.000 3.441 246 N HA 0.066 4.997 4.740 0.319 0.000 0.313 246 N C -1.862 173.749 175.510 0.169 0.000 1.526 246 N CA -0.956 52.232 53.050 0.231 0.000 0.871 246 N CB 2.361 40.919 38.487 0.118 0.000 1.779 246 N HN -0.047 8.460 8.380 0.210 0.000 0.529 247 G N -3.618 105.215 108.800 0.055 0.000 2.533 247 G HA2 0.262 4.191 3.960 -0.052 0.000 0.304 247 G HA3 0.262 4.317 3.960 -0.048 -0.124 0.304 247 G C -2.837 172.025 174.900 -0.062 0.000 1.263 247 G CA -1.126 43.955 45.100 -0.032 0.000 0.964 247 G HN 0.093 8.336 8.290 0.073 0.090 0.479 248 Q N -0.059 119.689 119.800 -0.088 0.000 2.281 248 Q HA 0.206 4.467 4.340 -0.131 0.000 0.263 248 Q C -0.182 175.758 176.000 -0.100 0.000 0.989 248 Q CA -0.419 55.318 55.803 -0.111 0.000 0.852 248 Q CB 3.357 32.029 28.738 -0.110 0.000 1.337 248 Q HN 0.197 8.415 8.270 -0.087 0.000 0.418 249 S N 9.900 125.532 115.700 -0.113 0.000 2.849 249 S HA 0.101 4.529 4.470 -0.069 0.000 0.244 249 S C -0.659 173.896 174.600 -0.075 0.000 1.297 249 S CA -0.282 57.868 58.200 -0.084 0.000 1.241 249 S CB -1.028 62.129 63.200 -0.073 0.000 0.958 249 S HN 0.595 9.145 8.310 -0.146 -0.327 0.489 250 G N 0.074 108.832 108.800 -0.069 0.000 2.500 250 G HA2 -0.282 3.656 3.960 -0.036 0.000 0.209 250 G HA3 -0.282 3.655 3.960 -0.039 0.000 0.209 250 G C -2.119 172.749 174.900 -0.054 0.000 1.283 250 G CA -0.772 44.300 45.100 -0.048 0.000 0.960 250 G HN -0.805 7.374 8.290 -0.069 0.069 0.528 251 I N 2.591 123.143 120.570 -0.029 0.000 2.329 251 I HA -0.043 4.114 4.170 -0.022 0.000 0.295 251 I C -0.544 175.566 176.117 -0.012 0.000 1.109 251 I CA 0.528 61.818 61.300 -0.017 0.000 1.297 251 I CB -1.713 36.287 38.000 0.001 0.000 1.433 251 I HN 0.119 8.317 8.210 -0.020 0.000 0.509 252 K N 5.921 126.302 120.400 -0.031 0.000 2.670 252 K HA 0.110 4.471 4.320 0.068 0.000 0.289 252 K C -2.073 174.515 176.600 -0.019 0.000 1.045 252 K CA -1.821 54.469 56.287 0.005 0.000 0.834 252 K CB 1.583 34.075 32.500 -0.013 0.000 1.531 252 K HN -0.413 7.806 8.250 -0.051 0.000 0.376 253 Y N -2.483 117.828 120.300 0.019 0.000 2.861 253 Y HA -0.181 4.523 4.550 0.009 -0.149 0.344 253 Y C -0.253 175.647 175.900 -0.000 0.000 1.272 253 Y CA -0.200 57.908 58.100 0.014 0.000 1.502 253 Y CB 0.222 38.703 38.460 0.034 0.000 1.333 253 Y HN -0.053 8.457 8.280 0.382 0.000 0.634 254 D N -0.884 119.507 120.400 -0.015 0.000 2.317 254 D HA -0.151 4.546 4.640 -0.169 -0.158 0.252 254 D C -0.193 176.025 176.300 -0.136 0.000 1.174 254 D CA -0.389 53.545 54.000 -0.109 0.000 0.866 254 D CB 0.209 40.990 40.800 -0.032 0.000 1.127 254 D HN -0.163 8.923 8.370 0.109 -0.651 0.467 255 Q N 2.233 121.863 119.800 -0.282 0.000 2.250 255 Q HA -0.053 4.207 4.340 -0.132 0.000 0.200 255 Q C 0.073 176.006 176.000 -0.113 0.000 0.941 255 Q CA 0.651 56.316 55.803 -0.229 0.000 0.872 255 Q CB 1.062 29.619 28.738 -0.302 0.000 0.965 255 Q HN 0.335 8.786 8.270 -0.279 -0.347 0.480 256 D N -3.030 117.313 120.400 -0.096 0.000 2.723 256 D HA -0.372 4.257 4.640 -0.017 0.000 0.236 256 D C -0.917 175.407 176.300 0.039 0.000 1.138 256 D CA 1.041 55.013 54.000 -0.047 0.000 0.676 256 D CB -2.149 38.572 40.800 -0.132 0.000 1.069 256 D HN -0.316 8.074 8.370 -0.103 -0.081 0.430 257 L N -3.056 118.189 121.223 0.037 0.000 2.479 257 L HA -0.146 4.264 4.340 0.116 0.000 0.270 257 L C 0.756 177.735 176.870 0.183 0.000 1.236 257 L CA 0.580 55.475 54.840 0.091 0.000 0.823 257 L CB 0.261 42.332 42.059 0.019 0.000 1.098 257 L HN -0.499 7.708 8.230 -0.012 0.015 0.500 258 R N -1.690 118.921 120.500 0.184 0.000 2.734 258 R HA -0.177 4.114 4.340 -0.082 0.000 0.266 258 R C -0.509 175.774 176.300 -0.029 0.000 1.044 258 R CA 0.097 56.189 56.100 -0.013 0.000 1.128 258 R CB 0.501 30.708 30.300 -0.154 0.000 1.010 258 R HN 0.253 8.628 8.270 0.175 0.000 0.461 259 F N 3.052 122.877 119.950 -0.208 0.000 2.572 259 F HA -0.288 4.279 4.527 -0.022 -0.054 0.370 259 F C 0.704 176.448 175.800 -0.094 0.000 1.103 259 F CA 1.852 59.811 58.000 -0.069 0.000 1.286 259 F CB 0.719 39.787 39.000 0.114 0.000 1.105 259 F HN -0.521 7.714 8.300 -0.108 0.000 0.583 260 G N 5.716 113.956 108.800 -0.934 0.000 2.308 260 G HA2 -0.449 3.004 3.960 -0.845 0.000 0.221 260 G HA3 -0.449 3.192 3.960 -0.531 0.000 0.221 260 G C -1.312 173.372 174.900 -0.360 0.000 1.032 260 G CA -0.159 44.532 45.100 -0.681 0.000 0.623 260 G HN 0.449 8.038 8.290 -1.170 0.000 0.506 261 A N 1.072 123.747 122.820 -0.241 0.000 2.310 261 A HA 0.219 4.454 4.320 -0.142 0.000 0.260 261 A C 0.336 177.837 177.584 -0.137 0.000 1.112 261 A CA 0.326 52.274 52.037 -0.148 0.000 0.804 261 A CB 0.249 19.198 19.000 -0.086 0.000 1.081 261 A HN -0.692 7.234 8.150 -0.230 0.086 0.499 262 G N 0.651 109.391 108.800 -0.099 0.000 2.536 262 G HA2 -0.408 3.507 3.960 -0.075 0.000 0.280 262 G HA3 -0.408 3.676 3.960 -0.089 -0.177 0.280 262 G C -0.511 174.335 174.900 -0.090 0.000 1.152 262 G CA 0.726 45.773 45.100 -0.088 0.000 0.970 262 G HN 0.147 8.386 8.290 -0.086 0.000 0.549 263 D N 3.788 124.140 120.400 -0.081 0.000 2.435 263 D HA 0.168 4.775 4.640 -0.054 0.000 0.230 263 D C 0.292 176.543 176.300 -0.082 0.000 1.215 263 D CA -1.547 52.418 54.000 -0.059 0.000 0.947 263 D CB -0.887 39.899 40.800 -0.023 0.000 1.048 263 D HN -0.128 8.194 8.370 -0.081 0.000 0.512 264 L N 6.661 127.820 121.223 -0.107 0.000 2.046 264 L HA -0.189 4.135 4.340 -0.205 -0.107 0.208 264 L C 1.138 177.941 176.870 -0.112 0.000 1.077 264 L CA 2.398 57.147 54.840 -0.151 0.000 0.747 264 L CB 0.165 42.130 42.059 -0.156 0.000 0.896 264 L HN -0.377 7.795 8.230 -0.097 0.000 0.432 265 R N -1.975 118.485 120.500 -0.067 0.000 2.092 265 R HA -0.350 3.902 4.340 -0.146 0.000 0.231 265 R C 2.031 178.403 176.300 0.120 0.000 1.119 265 R CA 3.252 59.331 56.100 -0.037 0.000 0.970 265 R CB -0.598 29.717 30.300 0.026 0.000 0.864 265 R HN -0.157 8.078 8.270 -0.058 0.000 0.440 266 A N -0.947 121.961 122.820 0.147 0.000 1.972 266 A HA -0.201 4.331 4.320 0.353 0.000 0.219 266 A C 1.814 179.513 177.584 0.193 0.000 1.169 266 A CA 2.799 54.971 52.037 0.224 0.000 0.635 266 A CB -0.963 18.131 19.000 0.157 0.000 0.810 266 A HN -0.258 8.241 8.150 0.087 -0.296 0.446 267 A N -0.758 122.095 122.820 0.054 0.000 1.902 267 A HA -0.359 4.072 4.320 0.186 0.000 0.217 267 A C 1.238 178.851 177.584 0.048 0.000 1.181 267 A CA 3.147 55.187 52.037 0.005 0.000 0.623 267 A CB -0.549 18.190 19.000 -0.435 0.000 0.818 267 A HN -0.403 7.635 8.150 -0.010 0.106 0.443 268 F N 0.655 120.478 119.950 -0.211 0.000 2.069 268 F HA -0.387 3.968 4.527 -0.286 0.000 0.298 268 F C 1.017 176.652 175.800 -0.276 0.000 1.113 268 F CA 4.095 61.890 58.000 -0.342 0.000 1.214 268 F CB 0.066 38.712 39.000 -0.590 0.000 0.978 268 F HN -0.407 7.914 8.300 0.035 0.000 0.474 269 W N -3.215 118.071 121.300 -0.023 0.000 2.425 269 W HA -0.389 4.069 4.660 -0.337 0.000 0.277 269 W C 2.117 178.574 176.519 -0.104 0.000 1.231 269 W CA 2.574 59.837 57.345 -0.137 0.000 1.248 269 W CB -0.021 29.449 29.460 0.017 0.000 1.117 269 W HN 0.020 8.234 8.180 0.056 0.000 0.568 270 L N 0.024 121.367 121.223 0.199 0.000 2.017 270 L HA -0.354 4.077 4.340 0.153 0.000 0.208 270 L C 1.289 178.194 176.870 0.059 0.000 1.073 270 L CA 3.519 58.463 54.840 0.173 0.000 0.745 270 L CB -0.469 41.786 42.059 0.326 0.000 0.894 270 L HN -0.100 8.252 8.230 0.227 0.014 0.432 271 V N -0.268 119.627 119.914 -0.031 0.000 2.343 271 V HA -0.610 3.444 4.120 -0.110 0.000 0.247 271 V C 1.800 177.802 176.094 -0.154 0.000 1.051 271 V CA 4.771 66.969 62.300 -0.170 0.000 1.036 271 V CB -0.473 31.121 31.823 -0.382 0.000 0.654 271 V HN -0.258 7.926 8.190 -0.010 0.000 0.451 272 D N -0.357 119.882 120.400 -0.268 0.000 2.116 272 D HA -0.342 4.183 4.640 -0.191 0.000 0.193 272 D C 1.906 178.196 176.300 -0.017 0.000 0.998 272 D CA 3.407 57.292 54.000 -0.192 0.000 0.836 272 D CB 0.192 40.815 40.800 -0.296 0.000 0.951 272 D HN -0.316 7.815 8.370 -0.398 0.000 0.449 273 L N -0.188 121.050 121.223 0.025 0.000 2.027 273 L HA -0.158 4.217 4.340 0.057 0.000 0.206 273 L C 1.661 178.558 176.870 0.045 0.000 1.074 273 L CA 2.726 57.594 54.840 0.046 0.000 0.745 273 L CB -0.099 41.986 42.059 0.043 0.000 0.898 273 L HN -0.615 7.622 8.230 0.022 0.007 0.433 274 L N -1.916 119.335 121.223 0.046 0.000 2.042 274 L HA -0.507 3.879 4.340 0.077 0.000 0.210 274 L C 2.327 179.279 176.870 0.137 0.000 1.076 274 L CA 3.559 58.456 54.840 0.095 0.000 0.749 274 L CB -0.718 41.419 42.059 0.129 0.000 0.893 274 L HN 0.099 8.350 8.230 0.034 0.000 0.432 275 E N -1.494 118.767 120.200 0.102 0.000 2.072 275 E HA -0.235 4.182 4.350 0.112 0.000 0.190 275 E C 3.403 180.044 176.600 0.068 0.000 0.982 275 E CA 2.228 58.682 56.400 0.091 0.000 0.803 275 E CB -0.613 29.129 29.700 0.069 0.000 0.755 275 E HN -0.107 8.287 8.360 0.073 0.010 0.453 276 S N 0.899 116.634 115.700 0.058 0.000 2.382 276 S HA -0.325 4.174 4.470 0.049 0.000 0.228 276 S C 1.216 175.851 174.600 0.058 0.000 1.027 276 S CA 2.351 60.584 58.200 0.055 0.000 0.991 276 S CB 0.159 63.394 63.200 0.059 0.000 0.823 276 S HN -0.039 8.303 8.310 0.052 0.000 0.469 277 A N -2.716 120.146 122.820 0.070 0.000 2.167 277 A HA -0.013 4.347 4.320 0.067 0.000 0.214 277 A C 0.373 178.006 177.584 0.082 0.000 1.151 277 A CA 0.313 52.396 52.037 0.077 0.000 0.735 277 A CB 0.138 19.192 19.000 0.089 0.000 0.802 277 A HN -0.385 7.810 8.150 0.073 0.000 0.467 278 G N -1.826 107.023 108.800 0.082 0.000 2.225 278 G HA2 -0.347 3.639 3.960 0.043 0.000 0.264 278 G HA3 -0.347 3.635 3.960 0.035 0.000 0.264 278 G C -0.397 174.548 174.900 0.075 0.000 1.060 278 G CA 0.304 45.438 45.100 0.057 0.000 0.833 278 G HN -0.731 7.388 8.290 0.084 0.221 0.498 279 Y N -0.139 120.160 120.300 -0.002 0.000 2.721 279 Y HA -0.260 4.286 4.550 -0.006 0.000 0.329 279 Y C -0.453 175.420 175.900 -0.045 0.000 1.211 279 Y CA 0.613 58.704 58.100 -0.014 0.000 1.512 279 Y CB 0.978 39.433 38.460 -0.008 0.000 1.249 279 Y HN -0.647 7.777 8.280 0.239 0.000 0.549 280 E N 5.927 125.763 120.200 -0.607 0.000 2.603 280 E HA 0.074 4.137 4.350 -0.479 0.000 0.211 280 E C -0.736 175.403 176.600 -0.769 0.000 0.995 280 E CA -0.946 55.122 56.400 -0.554 0.000 0.990 280 E CB 0.979 30.505 29.700 -0.291 0.000 1.036 280 E HN 0.123 8.173 8.360 -0.517 0.000 0.475 281 G N 0.613 108.570 108.800 -1.405 0.000 2.653 281 G HA2 0.144 3.825 3.960 -0.466 0.000 0.265 281 G HA3 0.144 3.668 3.960 -0.726 0.000 0.265 281 G C -2.592 171.959 174.900 -0.581 0.000 1.237 281 G CA -1.280 43.315 45.100 -0.842 0.000 0.946 281 G HN -0.370 6.457 8.290 -2.440 0.000 0.522 282 P HA 0.063 4.454 4.420 -0.216 -0.101 0.269 282 P C -1.020 176.159 177.300 -0.202 0.000 1.209 282 P CA -0.011 62.969 63.100 -0.200 0.000 0.776 282 P CB 0.503 32.154 31.700 -0.082 0.000 0.876 283 R N 2.089 122.415 120.500 -0.290 0.000 2.391 283 R HA 0.276 4.402 4.340 -0.356 0.000 0.310 283 R C -1.344 174.575 176.300 -0.635 0.000 1.174 283 R CA -1.889 53.948 56.100 -0.439 0.000 1.118 283 R CB -0.426 29.513 30.300 -0.602 0.000 1.134 283 R HN 0.294 8.370 8.270 -0.323 0.000 0.524 284 H N 4.879 123.537 119.070 -0.686 0.000 2.562 284 H HA 0.291 4.720 4.556 -0.529 -0.191 0.314 284 H C -1.615 173.251 175.328 -0.770 0.000 1.079 284 H CA -1.174 54.526 56.048 -0.580 0.000 1.349 284 H CB 2.064 31.701 29.762 -0.207 0.000 1.432 284 H HN -0.166 7.863 8.280 -0.418 0.000 0.479 285 F N 6.631 126.109 119.950 -0.786 0.000 2.391 285 F HA 0.316 4.785 4.527 -0.433 -0.201 0.359 285 F C -1.126 174.344 175.800 -0.551 0.000 1.122 285 F CA -1.343 56.287 58.000 -0.618 0.000 1.120 285 F CB 0.642 39.197 39.000 -0.741 0.000 1.142 285 F HN 0.570 8.244 8.300 -1.044 0.000 0.483 286 D N 4.143 124.466 120.400 -0.129 0.000 2.493 286 D HA 0.193 4.788 4.640 -0.075 0.000 0.235 286 D C -2.140 174.254 176.300 0.158 0.000 1.117 286 D CA -1.873 52.140 54.000 0.022 0.000 0.930 286 D CB 0.579 41.475 40.800 0.160 0.000 1.010 286 D HN -0.320 7.997 8.370 -0.089 0.000 0.514 287 F N 0.063 119.983 119.950 -0.050 0.000 2.650 287 F HA 0.264 4.821 4.527 -0.054 -0.063 0.320 287 F C -3.308 172.454 175.800 -0.065 0.000 1.091 287 F CA -2.279 55.701 58.000 -0.034 0.000 0.962 287 F CB 2.650 41.663 39.000 0.023 0.000 1.363 287 F HN -0.783 7.658 8.300 0.235 0.000 0.482 288 K N 0.037 120.073 120.400 -0.606 0.000 2.545 288 K HA 0.495 4.376 4.320 -0.732 0.000 0.252 288 K C -2.599 173.747 176.600 -0.424 0.000 0.948 288 K CA -3.142 52.752 56.287 -0.655 0.000 0.827 288 K CB 2.498 34.533 32.500 -0.775 0.000 1.128 288 K HN 0.207 8.318 8.250 -0.232 0.000 0.429 289 P HA 0.079 4.567 4.420 0.114 0.000 0.263 289 P C -2.093 175.314 177.300 0.179 0.000 1.195 289 P CA -1.262 61.834 63.100 -0.006 0.000 0.762 289 P CB -0.453 31.214 31.700 -0.056 0.000 0.799 290 P HA -0.036 4.598 4.420 0.358 0.000 0.267 290 P C 0.746 178.174 177.300 0.214 0.000 1.201 290 P CA 0.278 63.529 63.100 0.251 0.000 0.775 290 P CB 0.495 32.287 31.700 0.154 0.000 0.854 291 R N 1.577 122.211 120.500 0.224 0.000 2.316 291 R HA -0.266 3.995 4.340 -0.132 0.000 0.202 291 R C 1.660 177.943 176.300 -0.028 0.000 1.029 291 R CA 2.823 58.901 56.100 -0.036 0.000 1.018 291 R CB -0.789 29.406 30.300 -0.174 0.000 0.888 291 R HN 0.511 8.981 8.270 0.333 0.000 0.471 292 T N -4.654 109.916 114.554 0.026 0.000 2.929 292 T HA -0.272 4.077 4.350 -0.002 0.000 0.271 292 T C 0.526 175.221 174.700 -0.007 0.000 1.085 292 T CA 1.552 63.658 62.100 0.010 0.000 1.125 292 T CB -0.383 68.502 68.868 0.029 0.000 0.874 292 T HN -0.149 8.090 8.240 0.066 0.040 0.494 293 E N 1.824 122.018 120.200 -0.010 0.000 2.277 293 E HA 0.172 4.513 4.350 -0.015 0.000 0.274 293 E C -0.362 176.204 176.600 -0.056 0.000 1.022 293 E CA -1.252 55.134 56.400 -0.024 0.000 0.853 293 E CB 1.074 30.764 29.700 -0.016 0.000 1.086 293 E HN -0.486 7.705 8.360 0.002 0.170 0.397 294 D N 1.427 121.797 120.400 -0.051 0.000 2.478 294 D HA -0.009 4.587 4.640 -0.074 0.000 0.269 294 D C 1.290 177.534 176.300 -0.093 0.000 1.232 294 D CA -1.082 52.882 54.000 -0.062 0.000 1.059 294 D CB 0.729 41.510 40.800 -0.033 0.000 1.104 294 D HN 0.117 8.467 8.370 -0.035 0.000 0.566 295 I N -1.751 118.767 120.570 -0.088 0.000 2.361 295 I HA -0.308 3.699 4.170 -0.272 0.000 0.251 295 I C 0.276 176.320 176.117 -0.122 0.000 1.133 295 I CA 2.160 63.372 61.300 -0.148 0.000 1.413 295 I CB 0.205 38.189 38.000 -0.026 0.000 1.073 295 I HN 0.101 8.277 8.210 -0.056 0.000 0.424 296 D N -0.804 119.603 120.400 0.012 0.000 2.144 296 D HA -0.251 4.510 4.640 0.201 0.000 0.200 296 D C 2.531 178.851 176.300 0.034 0.000 0.978 296 D CA 3.474 57.527 54.000 0.087 0.000 0.833 296 D CB -0.615 40.231 40.800 0.077 0.000 0.961 296 D HN -0.550 7.935 8.370 0.014 -0.107 0.470 297 G N -0.205 108.581 108.800 -0.022 0.000 2.422 297 G HA2 -0.240 3.726 3.960 0.010 0.000 0.218 297 G HA3 -0.240 3.840 3.960 -0.021 -0.132 0.218 297 G C 1.424 176.286 174.900 -0.064 0.000 1.140 297 G CA 1.763 46.850 45.100 -0.021 0.000 0.775 297 G HN -0.496 8.010 8.290 -0.029 -0.233 0.545 298 V N 2.247 122.035 119.914 -0.210 0.000 2.255 298 V HA -0.478 3.509 4.120 -0.222 0.000 0.247 298 V C 1.645 177.551 176.094 -0.312 0.000 1.051 298 V CA 4.096 66.172 62.300 -0.373 0.000 1.018 298 V CB -0.618 30.757 31.823 -0.748 0.000 0.641 298 V HN -0.304 7.661 8.190 -0.230 0.087 0.445 299 W N -2.594 118.713 121.300 0.011 0.000 2.436 299 W HA -0.346 4.284 4.660 -0.050 0.000 0.284 299 W C 1.761 178.265 176.519 -0.025 0.000 1.225 299 W CA 2.374 59.704 57.345 -0.025 0.000 1.271 299 W CB -0.647 28.792 29.460 -0.034 0.000 1.114 299 W HN -0.626 7.331 8.180 -0.372 0.000 0.559 300 A N -1.171 121.741 122.820 0.152 0.000 1.902 300 A HA -0.400 3.972 4.320 0.086 0.000 0.217 300 A C 2.082 179.694 177.584 0.046 0.000 1.181 300 A CA 3.045 55.133 52.037 0.084 0.000 0.623 300 A CB -1.060 17.974 19.000 0.058 0.000 0.818 300 A HN -0.068 8.159 8.150 0.130 0.000 0.443 301 S N -1.182 114.557 115.700 0.066 0.000 2.368 301 S HA -0.317 4.168 4.470 0.026 0.000 0.224 301 S C 1.871 176.447 174.600 -0.040 0.000 1.029 301 S CA 2.997 61.247 58.200 0.083 0.000 0.988 301 S CB -0.320 63.032 63.200 0.254 0.000 0.838 301 S HN -0.259 8.092 8.310 0.069 0.000 0.462 302 A N 0.594 123.452 122.820 0.063 0.000 1.902 302 A HA -0.260 3.881 4.320 -0.298 0.000 0.217 302 A C 1.339 178.829 177.584 -0.157 0.000 1.181 302 A CA 2.812 54.786 52.037 -0.106 0.000 0.623 302 A CB -0.692 18.252 19.000 -0.094 0.000 0.818 302 A HN -0.396 7.847 8.150 0.154 0.000 0.443 303 A N -2.154 120.631 122.820 -0.059 0.000 1.933 303 A HA -0.363 3.924 4.320 -0.055 0.000 0.218 303 A C 1.831 179.333 177.584 -0.136 0.000 1.175 303 A CA 2.898 54.898 52.037 -0.062 0.000 0.628 303 A CB -0.547 18.455 19.000 0.004 0.000 0.814 303 A HN -0.080 8.075 8.150 0.010 0.000 0.444 304 G N -2.485 106.225 108.800 -0.151 0.000 2.422 304 G HA2 -0.400 3.483 3.960 -0.129 0.000 0.218 304 G HA3 -0.400 3.469 3.960 -0.152 0.000 0.218 304 G C 0.796 175.524 174.900 -0.288 0.000 1.146 304 G CA 1.955 46.950 45.100 -0.175 0.000 0.769 304 G HN -0.175 7.951 8.290 -0.118 0.094 0.547 305 C N 3.290 122.286 119.300 -0.506 0.000 2.393 305 C HA -0.313 3.815 4.460 -0.553 0.000 0.276 305 C C 2.529 177.088 174.990 -0.719 0.000 1.215 305 C CA 3.749 62.265 59.018 -0.837 0.000 1.743 305 C CB -1.674 25.006 27.740 -1.767 0.000 2.044 305 C HN -0.366 7.553 8.230 -0.517 0.000 0.464 306 M N -1.770 117.380 119.600 -0.751 0.000 2.132 306 M HA -0.442 3.317 4.480 -1.201 0.000 0.263 306 M C 1.987 178.134 176.300 -0.255 0.000 1.065 306 M CA 3.990 58.816 55.300 -0.790 0.000 1.122 306 M CB -0.303 31.861 32.600 -0.727 0.000 1.365 306 M HN -0.713 7.184 8.290 -0.654 0.000 0.411 307 R N -0.197 120.221 120.500 -0.136 0.000 2.083 307 R HA -0.402 3.980 4.340 0.071 0.000 0.237 307 R C 2.052 178.333 176.300 -0.033 0.000 1.137 307 R CA 4.003 60.092 56.100 -0.019 0.000 0.951 307 R CB -0.134 30.144 30.300 -0.037 0.000 0.851 307 R HN 0.072 8.232 8.270 -0.183 0.000 0.434 308 N N -1.122 117.547 118.700 -0.052 0.000 2.188 308 N HA -0.339 4.324 4.740 -0.128 0.000 0.184 308 N C 2.110 177.693 175.510 0.122 0.000 1.018 308 N CA 3.135 56.156 53.050 -0.047 0.000 0.858 308 N CB -0.022 38.389 38.487 -0.128 0.000 0.989 308 N HN -0.234 8.091 8.380 -0.092 0.000 0.426 309 Y N 1.890 122.345 120.300 0.257 0.000 2.128 309 Y HA -0.439 4.460 4.550 0.581 0.000 0.284 309 Y C 1.396 177.474 175.900 0.297 0.000 1.154 309 Y CA 3.973 62.330 58.100 0.428 0.000 1.149 309 Y CB 0.084 38.849 38.460 0.510 0.000 0.976 309 Y HN -0.577 7.949 8.280 0.410 0.000 0.505 310 L N -2.173 119.340 121.223 0.483 0.000 2.093 310 L HA -0.445 4.201 4.340 0.509 0.000 0.208 310 L C 2.212 179.214 176.870 0.220 0.000 1.085 310 L CA 3.155 58.251 54.840 0.426 0.000 0.755 310 L CB -0.266 42.076 42.059 0.471 0.000 0.904 310 L HN -0.387 8.107 8.230 0.440 0.000 0.435 311 I N -0.495 120.028 120.570 -0.078 0.000 2.142 311 I HA -0.578 3.345 4.170 -0.410 0.000 0.240 311 I C 2.005 178.085 176.117 -0.062 0.000 1.078 311 I CA 4.666 65.774 61.300 -0.319 0.000 1.343 311 I CB -0.229 37.435 38.000 -0.559 0.000 1.046 311 I HN -0.062 8.092 8.210 -0.095 0.000 0.405 312 L N -1.854 119.339 121.223 -0.050 0.000 2.083 312 L HA -0.490 3.881 4.340 0.052 0.000 0.209 312 L C 1.930 178.780 176.870 -0.033 0.000 1.083 312 L CA 3.260 58.089 54.840 -0.019 0.000 0.752 312 L CB -0.792 41.221 42.059 -0.076 0.000 0.899 312 L HN -0.179 8.014 8.230 -0.061 0.000 0.433 313 K N -0.341 120.035 120.400 -0.041 0.000 2.032 313 K HA -0.503 3.775 4.320 -0.070 0.000 0.209 313 K C 1.808 178.458 176.600 0.084 0.000 1.048 313 K CA 3.987 60.278 56.287 0.008 0.000 0.927 313 K CB -0.315 32.267 32.500 0.138 0.000 0.712 313 K HN 0.014 8.246 8.250 -0.030 0.000 0.441 314 E N -0.779 119.510 120.200 0.150 0.000 2.051 314 E HA -0.349 4.099 4.350 0.163 0.000 0.192 314 E C 2.581 179.281 176.600 0.167 0.000 0.991 314 E CA 3.192 59.701 56.400 0.182 0.000 0.799 314 E CB -0.171 29.703 29.700 0.289 0.000 0.748 314 E HN -0.527 7.935 8.360 0.169 0.000 0.449 315 R N -2.053 118.550 120.500 0.172 0.000 2.081 315 R HA -0.265 4.219 4.340 0.241 0.000 0.235 315 R C 2.478 178.954 176.300 0.294 0.000 1.131 315 R CA 1.704 57.946 56.100 0.237 0.000 0.960 315 R CB -0.903 29.521 30.300 0.207 0.000 0.856 315 R HN -0.175 8.182 8.270 0.146 0.000 0.436 316 A N -1.165 121.756 122.820 0.167 0.000 1.898 316 A HA -0.148 4.203 4.320 0.051 0.000 0.216 316 A C 1.948 179.587 177.584 0.092 0.000 1.181 316 A CA 2.893 54.923 52.037 -0.012 0.000 0.620 316 A CB -0.903 17.869 19.000 -0.380 0.000 0.819 316 A HN 0.153 8.363 8.150 0.100 0.000 0.442 317 A N -1.758 121.105 122.820 0.071 0.000 1.902 317 A HA -0.390 3.960 4.320 0.050 0.000 0.217 317 A C 1.543 179.160 177.584 0.055 0.000 1.181 317 A CA 2.981 55.056 52.037 0.063 0.000 0.623 317 A CB -0.486 18.554 19.000 0.066 0.000 0.818 317 A HN -0.242 7.948 8.150 0.068 0.000 0.443 318 A N -1.162 121.709 122.820 0.085 0.000 1.902 318 A HA -0.264 4.095 4.320 0.065 0.000 0.217 318 A C 1.658 179.125 177.584 -0.195 0.000 1.181 318 A CA 2.788 54.862 52.037 0.062 0.000 0.623 318 A CB -0.695 18.436 19.000 0.220 0.000 0.818 318 A HN -0.305 7.918 8.150 0.121 0.000 0.443 319 F N -0.406 119.256 119.950 -0.481 0.000 2.069 319 F HA -0.344 3.262 4.527 -1.535 0.000 0.298 319 F C 2.096 177.736 175.800 -0.267 0.000 1.113 319 F CA 2.763 60.353 58.000 -0.684 0.000 1.214 319 F CB 0.261 39.152 39.000 -0.180 0.000 0.978 319 F HN -0.308 8.018 8.300 0.042 0.000 0.474 320 R N -2.785 117.600 120.500 -0.193 0.000 2.115 320 R HA -0.267 3.814 4.340 -0.431 0.000 0.230 320 R C 0.995 177.185 176.300 -0.184 0.000 1.111 320 R CA 1.396 57.356 56.100 -0.233 0.000 0.976 320 R CB -0.550 29.732 30.300 -0.030 0.000 0.870 320 R HN -0.261 8.028 8.270 0.033 0.000 0.445 321 A N -3.235 119.515 122.820 -0.118 0.000 2.119 321 A HA 0.003 4.293 4.320 -0.051 0.000 0.216 321 A C -0.087 177.462 177.584 -0.059 0.000 1.152 321 A CA 0.231 52.232 52.037 -0.060 0.000 0.708 321 A CB 0.345 19.338 19.000 -0.011 0.000 0.805 321 A HN -0.571 7.490 8.150 -0.103 0.027 0.460 322 D N -0.048 120.292 120.400 -0.100 0.000 2.371 322 D HA 0.174 4.835 4.640 0.036 0.000 0.256 322 D C -1.329 174.952 176.300 -0.032 0.000 1.193 322 D CA -2.386 51.604 54.000 -0.017 0.000 0.881 322 D CB 0.580 41.415 40.800 0.060 0.000 1.143 322 D HN -0.730 7.478 8.370 -0.187 0.049 0.473 323 P HA -0.243 4.166 4.420 -0.018 0.000 0.217 323 P C 1.191 178.491 177.300 -0.001 0.000 1.148 323 P CA 2.034 65.131 63.100 -0.005 0.000 0.828 323 P CB 0.296 32.001 31.700 0.010 0.000 0.783 324 E N -2.670 117.544 120.200 0.024 0.000 2.152 324 E HA -0.247 4.121 4.350 0.029 0.000 0.192 324 E C 2.556 179.168 176.600 0.020 0.000 0.983 324 E CA 2.765 59.186 56.400 0.035 0.000 0.818 324 E CB -0.326 29.415 29.700 0.067 0.000 0.758 324 E HN -0.074 8.587 8.360 0.040 -0.277 0.467 325 V N 0.789 120.686 119.914 -0.029 0.000 2.358 325 V HA -0.512 3.576 4.120 -0.054 0.000 0.246 325 V C 1.683 177.699 176.094 -0.130 0.000 1.047 325 V CA 4.201 66.417 62.300 -0.141 0.000 1.035 325 V CB -0.186 31.351 31.823 -0.476 0.000 0.658 325 V HN -0.620 7.556 8.190 -0.024 0.000 0.452 326 Q N -0.900 118.833 119.800 -0.113 0.000 2.135 326 Q HA -0.437 3.853 4.340 -0.083 0.000 0.204 326 Q C 2.504 178.490 176.000 -0.024 0.000 0.981 326 Q CA 3.576 59.338 55.803 -0.069 0.000 0.856 326 Q CB -0.352 28.354 28.738 -0.053 0.000 0.902 326 Q HN -0.156 8.047 8.270 -0.112 0.000 0.425 327 E N -0.242 119.953 120.200 -0.009 0.000 2.072 327 E HA -0.282 4.074 4.350 0.009 0.000 0.191 327 E C 1.776 178.391 176.600 0.026 0.000 0.985 327 E CA 2.395 58.802 56.400 0.010 0.000 0.801 327 E CB -0.477 29.233 29.700 0.015 0.000 0.750 327 E HN -0.362 7.980 8.360 -0.013 0.010 0.452 328 A N -0.365 122.477 122.820 0.036 0.000 1.933 328 A HA -0.287 4.074 4.320 0.068 0.000 0.218 328 A C 2.225 179.859 177.584 0.084 0.000 1.175 328 A CA 3.173 55.252 52.037 0.070 0.000 0.628 328 A CB -0.570 18.492 19.000 0.103 0.000 0.814 328 A HN -0.327 7.838 8.150 0.026 0.000 0.444 329 L N -2.585 118.674 121.223 0.060 0.000 2.046 329 L HA -0.483 3.927 4.340 0.117 0.000 0.208 329 L C 2.347 179.257 176.870 0.067 0.000 1.077 329 L CA 3.192 58.077 54.840 0.075 0.000 0.747 329 L CB -0.534 41.546 42.059 0.035 0.000 0.896 329 L HN 0.055 8.302 8.230 0.028 0.000 0.432 330 R N -1.478 119.047 120.500 0.041 0.000 2.081 330 R HA -0.291 4.223 4.340 0.036 -0.153 0.235 330 R C 3.136 179.457 176.300 0.035 0.000 1.131 330 R CA 3.065 59.185 56.100 0.034 0.000 0.960 330 R CB -0.270 30.043 30.300 0.021 0.000 0.856 330 R HN -0.506 7.783 8.270 0.030 0.000 0.436 331 A N -0.338 122.504 122.820 0.036 0.000 1.978 331 A HA -0.254 4.073 4.320 0.013 0.000 0.220 331 A C 1.067 178.659 177.584 0.014 0.000 1.170 331 A CA 3.006 55.057 52.037 0.023 0.000 0.636 331 A CB -0.699 18.317 19.000 0.027 0.000 0.810 331 A HN 0.193 8.294 8.150 0.040 0.073 0.448 332 S N -3.993 111.741 115.700 0.056 0.000 2.575 332 S HA 0.221 4.839 4.470 -0.052 -0.179 0.215 332 S C -0.636 174.025 174.600 0.102 0.000 0.966 332 S CA 0.010 58.255 58.200 0.074 0.000 0.911 332 S CB 0.529 63.897 63.200 0.281 0.000 0.780 332 S HN -0.514 7.728 8.310 0.081 0.117 0.514 333 R N -3.115 117.426 120.500 0.069 0.000 3.656 333 R HA -0.412 4.118 4.340 0.046 -0.163 0.297 333 R C 0.361 176.710 176.300 0.082 0.000 1.166 333 R CA 0.695 56.832 56.100 0.061 0.000 0.799 333 R CB -3.076 27.248 30.300 0.040 0.000 1.285 333 R HN -0.376 7.733 8.270 0.056 0.195 0.477 334 L N -3.009 118.271 121.223 0.095 0.000 2.201 334 L HA -0.263 4.122 4.340 0.076 0.000 0.212 334 L C 0.856 177.753 176.870 0.046 0.000 1.105 334 L CA 2.675 57.560 54.840 0.074 0.000 0.775 334 L CB -1.184 40.919 42.059 0.073 0.000 0.913 334 L HN -0.259 7.999 8.230 0.104 0.033 0.440 335 D N -2.020 118.404 120.400 0.040 0.000 2.117 335 D HA -0.283 4.373 4.640 0.026 0.000 0.198 335 D C 2.188 178.503 176.300 0.026 0.000 0.982 335 D CA 2.761 56.778 54.000 0.028 0.000 0.828 335 D CB -1.245 39.569 40.800 0.024 0.000 0.967 335 D HN -0.038 8.339 8.370 0.044 0.020 0.464 336 E N 0.595 120.813 120.200 0.029 0.000 2.204 336 E HA -0.201 4.161 4.350 0.020 0.000 0.194 336 E C 2.110 178.724 176.600 0.023 0.000 0.989 336 E CA 1.973 58.388 56.400 0.025 0.000 0.824 336 E CB -0.088 29.628 29.700 0.026 0.000 0.756 336 E HN -0.275 8.106 8.360 0.034 0.000 0.477 337 L N -1.079 120.160 121.223 0.027 0.000 2.127 337 L HA -0.268 4.081 4.340 0.016 0.000 0.211 337 L C 0.475 177.352 176.870 0.012 0.000 1.089 337 L CA 2.191 57.042 54.840 0.018 0.000 0.757 337 L CB -0.051 42.019 42.059 0.018 0.000 0.899 337 L HN -0.580 7.648 8.230 0.035 0.023 0.434 338 A N -3.341 119.490 122.820 0.017 0.000 2.167 338 A HA -0.050 4.282 4.320 0.020 0.000 0.214 338 A C 0.145 177.740 177.584 0.019 0.000 1.151 338 A CA 0.296 52.345 52.037 0.019 0.000 0.735 338 A CB 0.219 19.232 19.000 0.022 0.000 0.802 338 A HN -0.702 7.432 8.150 0.020 0.028 0.467 339 Q N -0.070 119.739 119.800 0.015 0.000 2.332 339 Q HA 0.138 4.486 4.340 0.013 0.000 0.263 339 Q C -2.314 173.693 176.000 0.010 0.000 0.979 339 Q CA -2.058 53.753 55.803 0.012 0.000 0.885 339 Q CB -0.467 28.277 28.738 0.010 0.000 1.218 339 Q HN -0.668 7.457 8.270 0.015 0.154 0.405 340 P HA -0.034 4.393 4.420 0.013 0.000 0.265 340 P C 0.306 177.606 177.300 0.001 0.000 1.193 340 P CA 0.179 63.284 63.100 0.009 0.000 0.765 340 P CB 0.585 32.290 31.700 0.010 0.000 0.823 341 T N 3.097 117.649 114.554 -0.003 0.000 2.746 341 T HA -0.209 4.130 4.350 -0.018 0.000 0.267 341 T C -0.293 174.396 174.700 -0.018 0.000 1.039 341 T CA 1.867 63.958 62.100 -0.015 0.000 1.142 341 T CB 0.266 69.124 68.868 -0.018 0.000 0.866 341 T HN 0.069 8.310 8.240 0.000 0.000 0.444 342 A N -0.904 121.909 122.820 -0.012 0.000 3.474 342 A HA 0.367 4.831 4.320 -0.015 -0.153 0.251 342 A C -0.655 176.925 177.584 -0.007 0.000 1.062 342 A CA -0.315 51.714 52.037 -0.013 0.000 0.945 342 A CB 0.342 19.330 19.000 -0.019 0.000 1.296 342 A HN -0.472 7.674 8.150 -0.007 0.000 0.592 343 A N -0.074 122.744 122.820 -0.004 0.000 2.125 343 A HA -0.255 4.066 4.320 0.001 0.000 0.219 343 A C 0.284 177.867 177.584 -0.002 0.000 1.156 343 A CA 2.493 54.530 52.037 -0.001 0.000 0.671 343 A CB -0.481 18.520 19.000 0.002 0.000 0.794 343 A HN 0.539 8.687 8.150 -0.004 0.000 0.459 344 D N -4.827 115.571 120.400 -0.005 0.000 2.349 344 D HA 0.035 4.673 4.640 -0.003 0.000 0.215 344 D C 0.442 176.739 176.300 -0.006 0.000 1.016 344 D CA 0.046 54.043 54.000 -0.004 0.000 0.870 344 D CB 0.432 41.229 40.800 -0.004 0.000 0.917 344 D HN 0.133 8.463 8.370 -0.006 0.037 0.524 345 G N -0.558 108.237 108.800 -0.008 0.000 2.525 345 G HA2 -0.243 3.712 3.960 -0.009 0.000 0.685 345 G HA3 -0.243 3.712 3.960 -0.008 0.000 0.685 345 G C -0.370 174.522 174.900 -0.013 0.000 1.290 345 G CA -0.839 44.256 45.100 -0.009 0.000 0.915 345 G HN -0.475 7.637 8.290 -0.008 0.173 0.548 346 V N 1.509 121.415 119.914 -0.015 0.000 2.307 346 V HA -0.441 3.665 4.120 -0.024 0.000 0.245 346 V C 1.519 177.601 176.094 -0.020 0.000 1.045 346 V CA 3.416 65.704 62.300 -0.020 0.000 1.024 346 V CB -0.093 31.718 31.823 -0.020 0.000 0.651 346 V HN 0.291 8.473 8.190 -0.013 0.000 0.449 347 Q N -2.156 117.635 119.800 -0.015 0.000 2.079 347 Q HA -0.316 4.014 4.340 -0.016 0.000 0.200 347 Q C 2.422 178.415 176.000 -0.011 0.000 0.974 347 Q CA 3.264 59.059 55.803 -0.014 0.000 0.840 347 Q CB -1.262 27.470 28.738 -0.010 0.000 0.898 347 Q HN 0.173 8.435 8.270 -0.013 0.000 0.430 348 E N -0.107 120.087 120.200 -0.010 0.000 2.058 348 E HA -0.308 4.039 4.350 -0.004 0.000 0.194 348 E C 2.380 178.974 176.600 -0.009 0.000 0.997 348 E CA 2.486 58.881 56.400 -0.007 0.000 0.801 348 E CB -0.352 29.344 29.700 -0.006 0.000 0.746 348 E HN -0.314 8.040 8.360 -0.010 0.000 0.450 349 L N -0.417 120.796 121.223 -0.016 0.000 2.042 349 L HA -0.323 4.006 4.340 -0.020 0.000 0.210 349 L C 2.725 179.582 176.870 -0.022 0.000 1.076 349 L CA 2.911 57.738 54.840 -0.022 0.000 0.749 349 L CB -0.271 41.770 42.059 -0.030 0.000 0.893 349 L HN -0.511 7.709 8.230 -0.017 0.000 0.432 350 L N -4.285 116.921 121.223 -0.028 0.000 2.201 350 L HA -0.301 4.008 4.340 -0.050 0.000 0.212 350 L C 1.197 178.059 176.870 -0.012 0.000 1.105 350 L CA 2.121 56.941 54.840 -0.034 0.000 0.775 350 L CB -0.181 41.854 42.059 -0.039 0.000 0.913 350 L HN -0.133 8.073 8.230 -0.027 0.008 0.440 351 A N -5.678 117.140 122.820 -0.003 0.000 2.275 351 A HA -0.032 4.295 4.320 0.012 0.000 0.212 351 A C -1.103 176.492 177.584 0.019 0.000 1.201 351 A CA -0.340 51.702 52.037 0.009 0.000 0.843 351 A CB 0.942 19.945 19.000 0.005 0.000 0.873 351 A HN -0.704 7.315 8.150 -0.006 0.127 0.492 352 D N -0.917 119.494 120.400 0.019 0.000 2.393 352 D HA 0.037 4.692 4.640 0.025 0.000 0.232 352 D C 0.552 176.883 176.300 0.053 0.000 1.192 352 D CA -1.073 52.943 54.000 0.027 0.000 0.882 352 D CB -0.089 40.718 40.800 0.011 0.000 1.038 352 D HN -0.713 7.483 8.370 0.012 0.181 0.499 353 R N 6.115 126.652 120.500 0.061 0.000 2.193 353 R HA -0.259 4.385 4.340 0.116 -0.234 0.229 353 R C 1.911 178.269 176.300 0.098 0.000 1.110 353 R CA 2.749 58.901 56.100 0.088 0.000 0.988 353 R CB -0.099 30.243 30.300 0.070 0.000 0.871 353 R HN 0.111 8.411 8.270 0.049 0.000 0.458 354 T N -3.430 111.170 114.554 0.077 0.000 3.072 354 T HA -0.166 4.261 4.350 0.128 0.000 0.266 354 T C 0.835 175.575 174.700 0.067 0.000 1.127 354 T CA 2.475 64.632 62.100 0.094 0.000 1.107 354 T CB -0.124 68.786 68.868 0.071 0.000 0.910 354 T HN -0.223 8.246 8.240 0.059 -0.193 0.513 355 A N -0.920 121.919 122.820 0.031 0.000 2.238 355 A HA -0.033 4.149 4.320 -0.230 0.000 0.210 355 A C -0.855 176.794 177.584 0.108 0.000 1.179 355 A CA 1.428 53.434 52.037 -0.052 0.000 0.827 355 A CB 0.159 19.139 19.000 -0.032 0.000 0.856 355 A HN -0.232 7.786 8.150 0.055 0.165 0.488 356 F N -2.514 117.451 119.950 0.024 0.000 1.826 356 F HA 0.031 4.613 4.527 0.092 0.000 0.231 356 F C 1.048 176.913 175.800 0.109 0.000 1.252 356 F CA 1.460 59.500 58.000 0.068 0.000 1.294 356 F CB 1.133 40.147 39.000 0.023 0.000 1.951 356 F HN -0.465 7.809 8.300 0.211 0.153 0.188 357 E N -0.014 120.280 120.200 0.157 0.000 2.085 357 E HA -0.249 4.082 4.350 -0.033 0.000 0.194 357 E C 0.381 176.979 176.600 -0.005 0.000 0.994 357 E CA 3.014 59.443 56.400 0.048 0.000 0.801 357 E CB -0.060 29.714 29.700 0.123 0.000 0.743 357 E HN 0.272 8.820 8.360 0.313 0.000 0.453 358 D N -3.343 117.089 120.400 0.053 0.000 2.462 358 D HA 0.198 4.845 4.640 0.012 0.000 0.221 358 D C -1.239 175.121 176.300 0.100 0.000 1.173 358 D CA -0.194 53.835 54.000 0.049 0.000 0.831 358 D CB 0.333 41.166 40.800 0.054 0.000 1.001 358 D HN -0.251 8.153 8.370 0.092 0.021 0.499 359 F N 2.503 122.411 119.950 -0.070 0.000 2.438 359 F HA -0.051 4.456 4.527 -0.034 0.000 0.356 359 F C -0.581 175.172 175.800 -0.078 0.000 1.099 359 F CA -0.184 57.780 58.000 -0.059 0.000 1.185 359 F CB 0.956 39.926 39.000 -0.050 0.000 1.115 359 F HN -0.789 7.437 8.300 0.167 0.174 0.526 360 D N 10.227 130.299 120.400 -0.547 0.000 2.483 360 D HA 0.115 4.547 4.640 -0.348 0.000 0.220 360 D C 1.080 176.894 176.300 -0.810 0.000 1.173 360 D CA -1.843 51.854 54.000 -0.504 0.000 0.964 360 D CB -0.441 40.181 40.800 -0.296 0.000 1.046 360 D HN 0.377 8.483 8.370 -0.440 0.000 0.517 361 V N 1.915 121.437 119.914 -0.652 0.000 2.490 361 V HA -0.307 3.371 4.120 -0.738 0.000 0.250 361 V C 1.139 177.056 176.094 -0.296 0.000 1.061 361 V CA 3.158 65.159 62.300 -0.498 0.000 1.064 361 V CB -0.301 31.407 31.823 -0.191 0.000 0.670 361 V HN -0.255 7.653 8.190 -0.470 0.000 0.461 362 D N 1.181 121.441 120.400 -0.233 0.000 2.149 362 D HA -0.171 4.397 4.640 -0.119 0.000 0.201 362 D C 1.823 178.035 176.300 -0.148 0.000 0.972 362 D CA 3.275 57.185 54.000 -0.149 0.000 0.835 362 D CB -0.590 40.140 40.800 -0.117 0.000 0.966 362 D HN -0.414 7.886 8.370 -0.246 -0.077 0.476 363 A N -0.827 121.883 122.820 -0.185 0.000 1.930 363 A HA -0.164 4.092 4.320 -0.106 0.000 0.217 363 A C 1.768 179.271 177.584 -0.134 0.000 1.175 363 A CA 2.803 54.755 52.037 -0.142 0.000 0.627 363 A CB -0.574 18.340 19.000 -0.142 0.000 0.815 363 A HN -0.429 7.880 8.150 -0.224 -0.293 0.443 364 A N -2.371 120.331 122.820 -0.197 0.000 1.877 364 A HA -0.263 4.029 4.320 -0.046 0.000 0.216 364 A C 2.278 179.828 177.584 -0.056 0.000 1.186 364 A CA 2.582 54.560 52.037 -0.098 0.000 0.620 364 A CB -0.590 18.358 19.000 -0.088 0.000 0.822 364 A HN -0.461 7.500 8.150 -0.315 0.000 0.443 365 A N -1.765 121.009 122.820 -0.075 0.000 1.940 365 A HA -0.310 3.996 4.320 -0.023 0.000 0.219 365 A C 1.016 178.572 177.584 -0.047 0.000 1.176 365 A CA 2.431 54.441 52.037 -0.045 0.000 0.631 365 A CB -0.445 18.526 19.000 -0.047 0.000 0.814 365 A HN -0.224 7.855 8.150 -0.117 0.000 0.446 366 A N -3.711 119.075 122.820 -0.057 0.000 2.119 366 A HA -0.126 4.167 4.320 -0.044 0.000 0.217 366 A C 0.439 177.993 177.584 -0.049 0.000 1.153 366 A CA 0.555 52.562 52.037 -0.050 0.000 0.692 366 A CB 0.084 19.052 19.000 -0.052 0.000 0.799 366 A HN -0.597 7.487 8.150 -0.070 0.024 0.458 367 R N 0.394 120.864 120.500 -0.051 0.000 2.345 367 R HA -0.110 4.200 4.340 -0.050 0.000 0.331 367 R C 0.633 176.886 176.300 -0.078 0.000 1.067 367 R CA -0.615 55.453 56.100 -0.055 0.000 0.962 367 R CB -0.380 29.893 30.300 -0.044 0.000 0.987 367 R HN -0.734 7.454 8.270 -0.051 0.052 0.451 368 G N 4.607 113.357 108.800 -0.084 0.000 2.554 368 G HA2 -0.084 3.804 3.960 -0.119 0.000 0.238 368 G HA3 -0.084 3.815 3.960 -0.101 0.000 0.238 368 G C 0.316 175.096 174.900 -0.201 0.000 1.259 368 G CA -0.755 44.272 45.100 -0.121 0.000 0.843 368 G HN 0.406 8.655 8.290 -0.068 0.000 0.582 369 M N 1.691 121.079 119.600 -0.354 0.000 2.506 369 M HA -0.088 4.070 4.480 -0.536 0.000 0.260 369 M C 0.976 176.927 176.300 -0.581 0.000 1.104 369 M CA -0.449 54.434 55.300 -0.695 0.000 1.112 369 M CB -0.829 30.837 32.600 -1.557 0.000 1.401 369 M HN 0.451 8.549 8.290 -0.320 0.000 0.473 370 A N -3.661 118.990 122.820 -0.282 0.000 2.860 370 A HA -0.303 3.996 4.320 -0.035 0.000 0.267 370 A C 0.367 177.994 177.584 0.070 0.000 1.421 370 A CA 1.616 53.607 52.037 -0.076 0.000 0.831 370 A CB -2.506 16.473 19.000 -0.034 0.000 1.041 370 A HN 0.176 8.140 8.150 -0.242 0.041 0.623 371 F N -1.954 118.021 119.950 0.041 0.000 2.325 371 F HA -0.160 4.402 4.527 0.059 0.000 0.299 371 F C 1.321 177.159 175.800 0.063 0.000 1.090 371 F CA 0.491 58.520 58.000 0.049 0.000 1.392 371 F CB -0.447 38.572 39.000 0.030 0.000 1.053 371 F HN 0.102 8.323 8.300 -0.083 0.028 0.521 372 E N 0.040 120.378 120.200 0.230 0.000 2.072 372 E HA -0.204 4.242 4.350 0.161 0.000 0.191 372 E C 2.520 179.206 176.600 0.144 0.000 0.985 372 E CA 3.366 59.861 56.400 0.157 0.000 0.801 372 E CB -0.880 28.884 29.700 0.108 0.000 0.750 372 E HN 0.414 8.891 8.360 0.195 0.000 0.452 373 R N -0.400 120.179 120.500 0.133 0.000 2.081 373 R HA -0.241 4.164 4.340 0.108 0.000 0.235 373 R C 2.283 178.688 176.300 0.174 0.000 1.131 373 R CA 2.844 59.019 56.100 0.125 0.000 0.960 373 R CB -0.610 29.749 30.300 0.098 0.000 0.856 373 R HN -0.123 8.221 8.270 0.123 0.000 0.436 374 L N -1.539 119.813 121.223 0.216 0.000 2.012 374 L HA -0.312 4.198 4.340 0.283 0.000 0.210 374 L C 1.252 178.321 176.870 0.332 0.000 1.073 374 L CA 3.419 58.430 54.840 0.285 0.000 0.748 374 L CB -0.259 41.983 42.059 0.306 0.000 0.891 374 L HN -0.608 7.749 8.230 0.212 0.000 0.431 375 D N -2.449 118.106 120.400 0.259 0.000 2.219 375 D HA -0.303 4.519 4.640 0.305 0.000 0.205 375 D C 2.122 178.530 176.300 0.180 0.000 0.970 375 D CA 3.267 57.410 54.000 0.237 0.000 0.851 375 D CB 0.109 41.012 40.800 0.171 0.000 0.943 375 D HN -0.197 8.314 8.370 0.236 0.000 0.488 376 Q N 0.187 120.078 119.800 0.152 0.000 2.172 376 Q HA -0.175 4.207 4.340 0.070 0.000 0.200 376 Q C 2.169 178.244 176.000 0.126 0.000 0.964 376 Q CA 2.353 58.218 55.803 0.103 0.000 0.855 376 Q CB -0.433 28.353 28.738 0.080 0.000 0.918 376 Q HN -0.331 8.035 8.270 0.160 0.000 0.444 377 L N -0.958 120.393 121.223 0.214 0.000 2.042 377 L HA -0.351 4.128 4.340 0.231 0.000 0.210 377 L C 1.957 179.068 176.870 0.402 0.000 1.076 377 L CA 3.164 58.195 54.840 0.319 0.000 0.749 377 L CB -0.497 41.801 42.059 0.399 0.000 0.893 377 L HN -0.137 8.228 8.230 0.225 0.000 0.432 378 A N -1.464 121.540 122.820 0.307 0.000 1.902 378 A HA -0.387 3.718 4.320 -0.359 0.000 0.217 378 A C 1.587 178.986 177.584 -0.308 0.000 1.181 378 A CA 2.904 54.831 52.037 -0.185 0.000 0.623 378 A CB -0.650 18.209 19.000 -0.234 0.000 0.818 378 A HN -0.330 7.953 8.150 0.354 0.079 0.443 379 M N -0.900 118.606 119.600 -0.158 0.000 2.086 379 M HA -0.396 3.883 4.480 -0.334 0.000 0.261 379 M C 1.475 177.669 176.300 -0.178 0.000 1.067 379 M CA 2.800 57.976 55.300 -0.207 0.000 1.116 379 M CB -0.425 32.118 32.600 -0.094 0.000 1.348 379 M HN -0.165 8.102 8.290 -0.038 0.000 0.407 380 D N -0.800 119.553 120.400 -0.079 0.000 2.117 380 D HA -0.321 4.258 4.640 -0.103 0.000 0.197 380 D C 2.616 178.830 176.300 -0.143 0.000 0.987 380 D CA 3.726 57.667 54.000 -0.099 0.000 0.829 380 D CB -0.642 40.112 40.800 -0.077 0.000 0.961 380 D HN -0.127 8.228 8.370 -0.026 0.000 0.460 381 H N 0.486 119.520 119.070 -0.061 0.000 2.353 381 H HA -0.148 4.417 4.556 0.016 0.000 0.300 381 H C 2.993 178.219 175.328 -0.170 0.000 1.090 381 H CA 3.338 59.366 56.048 -0.034 0.000 1.327 381 H CB 0.365 30.202 29.762 0.126 0.000 1.383 381 H HN -0.317 8.017 8.280 0.089 0.000 0.508 382 L N 1.135 122.167 121.223 -0.317 0.000 2.042 382 L HA -0.272 3.817 4.340 -0.419 0.000 0.210 382 L C 1.368 178.088 176.870 -0.250 0.000 1.076 382 L CA 2.935 57.489 54.840 -0.477 0.000 0.749 382 L CB -0.137 41.380 42.059 -0.904 0.000 0.893 382 L HN -0.188 7.797 8.230 -0.407 0.000 0.432 383 L N -6.462 114.636 121.223 -0.207 0.000 2.599 383 L HA -0.068 4.186 4.340 -0.144 0.000 0.230 383 L C 0.583 177.396 176.870 -0.095 0.000 1.141 383 L CA -0.021 54.734 54.840 -0.142 0.000 0.877 383 L CB -0.362 41.619 42.059 -0.130 0.000 1.009 383 L HN -0.469 7.613 8.230 -0.224 0.014 0.447 384 G N -1.860 106.892 108.800 -0.081 0.000 2.221 384 G HA2 -0.305 3.797 3.960 -0.034 0.000 0.265 384 G HA3 -0.305 3.639 3.960 -0.026 0.000 0.265 384 G C -0.380 174.481 174.900 -0.065 0.000 1.041 384 G CA 0.387 45.458 45.100 -0.048 0.000 0.807 384 G HN -0.595 7.453 8.290 -0.090 0.188 0.502 385 A N -1.234 121.529 122.820 -0.095 0.000 3.113 385 A HA 0.319 4.600 4.320 -0.065 0.000 0.307 385 A C -1.729 175.791 177.584 -0.106 0.000 1.025 385 A CA -0.402 51.585 52.037 -0.084 0.000 1.012 385 A CB 0.910 19.866 19.000 -0.074 0.000 1.085 385 A HN -0.055 8.025 8.150 -0.116 0.000 0.519 386 R N 0.000 120.421 120.500 -0.132 0.000 2.786 386 R HA 0.000 4.272 4.340 -0.114 0.000 0.208 386 R CA 0.000 56.010 56.100 -0.150 0.000 0.921 386 R CB 0.000 30.116 30.300 -0.307 0.000 0.687 386 R HN 0.000 8.107 8.270 -0.121 0.091 0.535