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 1ln6_1_A DATA FIRST_RESID 40 DATA SEQUENCE LAAYMFLLIM LGFPINFLTL YVTVQHKKLR TPLNYILLNL AVADLFMVFG DATA SEQUENCE GFTTTLYTSL HGYFVFGPTG cNLEGFFATL GGEIALWSLV VLAIERYVVV DATA SEQUENCE CKPMSNFRFG ENHAIMGVAF TWVMALACAA PPLVGWSRYI PEGMQCScGI DATA SEQUENCE DYYTPHEETN NESFVIYMFV VHFIIPLIVI FFCYGQLVFT VKEAAAQQQE DATA SEQUENCE SATTQKAEKE VTRMVIIMVI AFLICWLPYA GVAFYIFTHQ GSDFGPIFMT DATA SEQUENCE IPAFFAKTSA VYNPVIYIMM NKQFRNCMVT TLCCGKNPLG DDEASTTVSK DATA SEQUENCE TETSQVAPA 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 40 L HA 0.000 4.378 4.340 0.063 0.000 0.249 40 L C 0.000 176.736 176.870 -0.223 0.000 1.165 40 L CA 0.000 54.818 54.840 -0.036 0.000 0.813 40 L CB 0.000 42.055 42.059 -0.007 0.000 0.961 41 A N 1.800 124.414 122.820 -0.342 0.000 1.830 41 A HA -0.268 3.467 4.320 -0.975 0.000 0.214 41 A C 1.330 178.243 177.584 -1.118 0.000 1.218 41 A CA 3.121 54.545 52.037 -1.023 0.000 0.628 41 A CB -0.824 17.591 19.000 -0.974 0.000 0.860 41 A HN -0.099 7.907 8.150 -0.239 0.000 0.454 42 A N -1.796 120.662 122.820 -0.604 0.000 1.944 42 A HA -0.398 3.951 4.320 0.047 0.000 0.222 42 A C 1.256 178.914 177.584 0.122 0.000 1.237 42 A CA 3.225 55.202 52.037 -0.100 0.000 0.668 42 A CB -1.344 17.644 19.000 -0.021 0.000 0.830 42 A HN 0.243 8.073 8.150 -0.533 0.000 0.471 43 Y N -0.939 119.323 120.300 -0.064 0.000 2.014 43 Y HA -0.354 4.274 4.550 0.130 0.000 0.272 43 Y C 2.097 177.981 175.900 -0.026 0.000 1.164 43 Y CA 2.045 60.106 58.100 -0.064 0.000 1.114 43 Y CB -0.453 37.835 38.460 -0.287 0.000 0.961 43 Y HN -0.120 8.230 8.280 0.117 0.000 0.489 44 M N -0.754 118.856 119.600 0.017 0.000 2.064 44 M HA -0.475 4.022 4.480 0.028 0.000 0.260 44 M C 1.757 178.239 176.300 0.304 0.000 1.073 44 M CA 2.264 57.610 55.300 0.077 0.000 1.124 44 M CB -0.606 31.984 32.600 -0.017 0.000 1.326 44 M HN -0.471 7.772 8.290 -0.078 0.000 0.410 45 F N -3.789 116.194 119.950 0.055 0.000 2.135 45 F HA -0.400 4.161 4.527 0.057 0.000 0.300 45 F C 2.122 177.981 175.800 0.097 0.000 1.074 45 F CA 2.893 60.935 58.000 0.071 0.000 1.262 45 F CB -0.561 38.480 39.000 0.068 0.000 1.013 45 F HN -0.003 8.491 8.300 0.485 0.098 0.489 46 L N -5.350 116.068 121.223 0.325 0.000 2.862 46 L HA -0.080 4.383 4.340 0.204 0.000 0.169 46 L C 2.004 179.019 176.870 0.242 0.000 1.164 46 L CA 1.383 56.367 54.840 0.240 0.000 0.858 46 L CB -0.051 42.135 42.059 0.212 0.000 1.329 46 L HN -0.274 8.140 8.230 0.346 0.024 0.514 47 L N -1.878 119.515 121.223 0.282 0.000 2.046 47 L HA -0.245 4.243 4.340 0.247 0.000 0.208 47 L C 1.202 178.228 176.870 0.261 0.000 1.077 47 L CA 3.188 58.211 54.840 0.306 0.000 0.747 47 L CB 0.060 42.401 42.059 0.469 0.000 0.896 47 L HN -0.551 7.866 8.230 0.312 0.000 0.432 48 I N -6.055 114.656 120.570 0.235 0.000 3.891 48 I HA 0.009 4.277 4.170 0.162 0.000 0.331 48 I C -1.227 175.084 176.117 0.323 0.000 1.406 48 I CA -1.965 59.444 61.300 0.182 0.000 1.139 48 I CB -0.638 37.365 38.000 0.005 0.000 1.056 48 I HN -0.068 8.284 8.210 0.235 0.000 0.399 49 M N 1.058 120.853 119.600 0.325 0.000 3.436 49 M HA 0.048 4.953 4.480 0.490 -0.131 0.240 49 M C -0.711 175.779 176.300 0.316 0.000 1.469 49 M CA -0.880 54.634 55.300 0.357 0.000 1.622 49 M CB -2.979 29.761 32.600 0.234 0.000 1.098 49 M HN -0.470 7.786 8.290 0.273 0.198 0.568 50 L N -0.204 121.250 121.223 0.386 0.000 1.537 50 L HA 0.193 4.613 4.340 0.132 0.000 0.162 50 L C 0.208 177.001 176.870 -0.128 0.000 1.295 50 L CA 1.917 56.849 54.840 0.154 0.000 1.245 50 L CB 0.850 42.973 42.059 0.107 0.000 2.567 50 L HN 0.099 8.606 8.230 0.609 0.088 0.494 51 G N 0.598 109.339 108.800 -0.099 0.000 2.545 51 G HA2 -0.306 3.281 3.960 -0.723 0.000 0.217 51 G HA3 -0.306 3.493 3.960 -0.326 -0.035 0.217 51 G C 0.005 171.762 174.900 -5.238 0.000 1.218 51 G CA 2.203 46.835 45.100 -0.779 0.000 0.787 51 G HN -0.791 7.490 8.290 0.157 0.104 0.571 52 F N -0.614 101.078 119.950 -30.431 0.000 2.484 52 F HA 0.069 -15.617 4.527 -33.689 0.000 0.360 52 F C -1.604 179.125 175.800 8.216 0.000 1.101 52 F CA -2.348 39.087 58.000 -27.608 0.000 1.251 52 F CB -0.269 36.205 39.000 -4.211 0.000 1.132 52 F HN -0.548 11.397 8.300 6.076 0.000 0.570 53 P HA 0.233 5.840 4.420 1.978 0.000 0.261 53 P C 0.514 177.894 177.300 0.133 0.000 1.268 53 P CA 0.199 64.517 63.100 2.031 0.000 0.833 53 P CB 0.741 32.817 31.700 0.626 0.000 1.231 54 I N 0.809 121.188 120.570 -0.318 0.000 2.053 54 I HA -0.615 3.498 4.170 -0.094 0.000 0.236 54 I C 1.781 177.719 176.117 -0.299 0.000 1.038 54 I CA 4.763 65.905 61.300 -0.263 0.000 1.304 54 I CB -0.710 37.137 38.000 -0.255 0.000 1.023 54 I HN -0.698 7.144 8.210 -0.512 0.061 0.395 55 N N -0.736 117.613 118.700 -0.584 0.000 2.043 55 N HA -0.332 4.432 4.740 -0.151 -0.115 0.193 55 N C 1.794 177.202 175.510 -0.170 0.000 1.037 55 N CA 2.867 55.690 53.050 -0.380 0.000 0.851 55 N CB -0.393 37.821 38.487 -0.455 0.000 1.027 55 N HN -0.493 7.369 8.380 -0.864 0.000 0.422 56 F N -1.749 118.202 119.950 0.003 0.000 2.024 56 F HA -0.448 4.150 4.527 0.118 0.000 0.296 56 F C 2.669 178.523 175.800 0.090 0.000 1.137 56 F CA 2.412 60.480 58.000 0.114 0.000 1.200 56 F CB -1.388 37.768 39.000 0.260 0.000 0.954 56 F HN 0.119 7.452 8.300 -1.427 0.111 0.497 57 L N -2.121 119.272 121.223 0.283 0.000 1.994 57 L HA -0.265 4.193 4.340 0.196 0.000 0.208 57 L C 2.409 179.367 176.870 0.147 0.000 1.071 57 L CA 3.088 58.041 54.840 0.188 0.000 0.745 57 L CB -0.484 41.664 42.059 0.150 0.000 0.892 57 L HN 0.238 8.568 8.230 0.329 0.098 0.431 58 T N 1.664 116.267 114.554 0.082 0.000 3.163 58 T HA -0.227 4.147 4.350 0.041 0.000 0.260 58 T C 1.982 176.711 174.700 0.047 0.000 1.156 58 T CA 3.198 65.323 62.100 0.042 0.000 1.072 58 T CB -0.991 67.883 68.868 0.009 0.000 0.937 58 T HN -0.511 7.770 8.240 0.069 0.000 0.528 59 L N 3.211 124.479 121.223 0.074 0.000 2.046 59 L HA -0.254 4.142 4.340 0.093 0.000 0.208 59 L C 0.973 177.887 176.870 0.074 0.000 1.077 59 L CA 3.571 58.451 54.840 0.067 0.000 0.747 59 L CB -0.058 42.014 42.059 0.021 0.000 0.896 59 L HN 0.526 8.737 8.230 0.090 0.073 0.432 60 Y N -1.507 118.801 120.300 0.014 0.000 2.200 60 Y HA -0.366 4.174 4.550 -0.016 0.000 0.290 60 Y C 1.364 177.273 175.900 0.014 0.000 1.137 60 Y CA 2.808 60.909 58.100 0.001 0.000 1.163 60 Y CB -0.442 38.017 38.460 -0.001 0.000 0.988 60 Y HN -0.480 7.781 8.280 0.180 0.127 0.518 61 V N -3.534 116.146 119.914 -0.389 0.000 2.380 61 V HA -0.442 3.301 4.120 -0.628 0.000 0.251 61 V C 1.692 177.639 176.094 -0.246 0.000 1.063 61 V CA 3.243 65.303 62.300 -0.400 0.000 1.055 61 V CB -1.215 30.509 31.823 -0.166 0.000 0.657 61 V HN -0.192 7.922 8.190 -0.126 0.000 0.455 62 T N -2.581 111.903 114.554 -0.117 0.000 3.401 62 T HA -0.194 4.127 4.350 -0.049 0.000 0.225 62 T C 1.458 176.146 174.700 -0.020 0.000 0.961 62 T CA 2.383 64.459 62.100 -0.040 0.000 1.429 62 T CB 0.169 69.055 68.868 0.030 0.000 1.213 62 T HN -0.412 7.601 8.240 -0.079 0.179 0.440 63 V N -0.442 119.492 119.914 0.033 0.000 2.215 63 V HA -0.409 3.757 4.120 0.075 0.000 0.249 63 V C -0.463 175.639 176.094 0.013 0.000 1.054 63 V CA 2.662 64.996 62.300 0.056 0.000 1.012 63 V CB -0.896 30.987 31.823 0.100 0.000 0.639 63 V HN -0.238 7.982 8.190 0.049 0.000 0.448 64 Q N -4.224 115.561 119.800 -0.025 0.000 2.374 64 Q HA -0.434 3.810 4.340 -0.160 0.000 0.336 64 Q C -1.458 174.539 176.000 -0.006 0.000 1.257 64 Q CA 0.459 56.233 55.803 -0.049 0.000 1.007 64 Q CB -1.536 27.227 28.738 0.041 0.000 1.106 64 Q HN 0.411 8.671 8.270 -0.016 0.000 0.297 65 H N -3.192 115.903 119.070 0.041 0.000 2.594 65 H HA -0.398 4.169 4.556 0.018 0.000 0.316 65 H C -1.225 174.116 175.328 0.022 0.000 1.107 65 H CA 0.815 56.877 56.048 0.024 0.000 1.133 65 H CB -2.229 27.543 29.762 0.017 0.000 1.459 65 H HN 0.371 8.290 8.280 -0.602 0.000 0.411 66 K N -6.886 113.559 120.400 0.074 0.000 5.294 66 K HA -0.484 3.986 4.320 0.049 -0.120 0.344 66 K C 0.474 177.110 176.600 0.059 0.000 0.909 66 K CA 0.517 56.840 56.287 0.060 0.000 1.081 66 K CB -1.476 31.058 32.500 0.057 0.000 1.814 66 K HN -0.010 8.238 8.250 0.030 0.019 0.407 67 K N 1.171 121.599 120.400 0.047 0.000 2.013 67 K HA -0.372 4.111 4.320 0.058 -0.127 0.225 67 K C 0.497 177.122 176.600 0.043 0.000 1.056 67 K CA 2.850 59.163 56.287 0.044 0.000 0.971 67 K CB 0.371 32.882 32.500 0.019 0.000 0.731 67 K HN 0.286 8.559 8.250 0.038 0.000 0.450 68 L N -0.828 120.414 121.223 0.032 0.000 2.454 68 L HA 0.155 4.515 4.340 0.032 0.000 0.258 68 L C -1.522 175.367 176.870 0.031 0.000 1.025 68 L CA -1.192 53.667 54.840 0.030 0.000 0.901 68 L CB 0.391 42.465 42.059 0.025 0.000 1.210 68 L HN -0.658 7.589 8.230 0.028 0.000 0.457 69 R N 4.560 125.080 120.500 0.033 0.000 2.641 69 R HA 0.022 4.381 4.340 0.032 0.000 0.269 69 R C -1.432 174.886 176.300 0.030 0.000 1.074 69 R CA -0.804 55.315 56.100 0.031 0.000 1.133 69 R CB 0.210 30.527 30.300 0.028 0.000 1.029 69 R HN -0.087 8.203 8.270 0.034 0.000 0.488 70 T N 0.517 115.090 114.554 0.032 0.000 3.624 70 T HA 0.349 4.718 4.350 0.031 0.000 0.244 70 T C -2.139 172.583 174.700 0.036 0.000 1.063 70 T CA -1.938 60.181 62.100 0.031 0.000 1.252 70 T CB -0.760 68.125 68.868 0.028 0.000 1.021 70 T HN 0.346 8.606 8.240 0.032 0.000 0.590 71 P HA 0.198 4.656 4.420 0.063 0.000 0.314 71 P C -0.860 176.491 177.300 0.085 0.000 1.306 71 P CA -2.345 60.792 63.100 0.061 0.000 0.782 71 P CB 1.572 33.306 31.700 0.056 0.000 1.337 72 L N -1.832 119.458 121.223 0.112 0.000 3.840 72 L HA -0.309 4.168 4.340 0.229 0.000 0.322 72 L C -1.145 175.798 176.870 0.120 0.000 1.166 72 L CA 1.092 56.026 54.840 0.157 0.000 1.160 72 L CB -0.821 41.313 42.059 0.125 0.000 1.623 72 L HN 0.342 8.632 8.230 0.100 0.000 0.381 73 N N -0.058 118.715 118.700 0.121 0.000 2.297 73 N HA -0.023 4.702 4.740 -0.027 0.000 0.244 73 N C 0.143 175.628 175.510 -0.042 0.000 1.412 73 N CA -0.567 52.492 53.050 0.015 0.000 0.837 73 N CB 0.870 39.365 38.487 0.013 0.000 1.336 73 N HN -0.154 8.325 8.380 0.185 0.013 0.508 74 Y N -2.074 118.243 120.300 0.028 0.000 2.073 74 Y HA -0.564 3.978 4.550 -0.014 0.000 0.270 74 Y C 1.374 177.301 175.900 0.046 0.000 1.226 74 Y CA 2.577 60.697 58.100 0.032 0.000 1.117 74 Y CB -1.670 36.852 38.460 0.103 0.000 0.939 74 Y HN 0.012 8.565 8.280 0.455 0.000 0.504 75 I N -4.217 116.024 120.570 -0.548 0.000 2.091 75 I HA -0.547 3.719 4.170 -0.117 -0.166 0.239 75 I C 1.437 177.467 176.117 -0.146 0.000 1.061 75 I CA 3.152 64.235 61.300 -0.362 0.000 1.317 75 I CB -0.530 37.126 38.000 -0.575 0.000 1.031 75 I HN -0.497 6.894 8.210 -1.335 0.018 0.401 76 L N -2.627 118.505 121.223 -0.152 0.000 2.465 76 L HA -0.168 4.167 4.340 -0.008 0.000 0.224 76 L C 1.797 178.676 176.870 0.015 0.000 1.145 76 L CA 1.692 56.506 54.840 -0.043 0.000 0.834 76 L CB -0.468 41.565 42.059 -0.043 0.000 0.944 76 L HN -0.317 7.763 8.230 -0.250 0.000 0.451 77 L N -1.931 119.303 121.223 0.018 0.000 2.049 77 L HA -0.161 4.203 4.340 0.041 0.000 0.203 77 L C -0.775 176.135 176.870 0.067 0.000 1.074 77 L CA 1.500 56.367 54.840 0.045 0.000 0.749 77 L CB 0.142 42.228 42.059 0.045 0.000 0.907 77 L HN -0.409 7.610 8.230 -0.007 0.208 0.439 78 N N -5.199 113.556 118.700 0.091 0.000 2.635 78 N HA 0.013 4.895 4.740 0.105 -0.078 0.260 78 N C -0.959 174.649 175.510 0.163 0.000 1.078 78 N CA -0.158 52.966 53.050 0.124 0.000 1.012 78 N CB 2.108 40.684 38.487 0.148 0.000 1.677 78 N HN -0.246 8.188 8.380 0.091 0.000 0.514 79 L N -0.706 120.601 121.223 0.141 0.000 2.156 79 L HA -0.120 4.319 4.340 0.166 0.000 0.208 79 L C 0.314 177.261 176.870 0.128 0.000 1.095 79 L CA 1.002 55.927 54.840 0.141 0.000 0.770 79 L CB 0.373 42.508 42.059 0.126 0.000 0.914 79 L HN 0.268 8.576 8.230 0.129 0.000 0.439 80 A N -0.782 122.104 122.820 0.110 0.000 3.132 80 A HA -0.254 4.638 4.320 0.256 -0.418 0.288 80 A C -1.179 176.503 177.584 0.164 0.000 1.959 80 A CA 1.498 53.644 52.037 0.183 0.000 1.374 80 A CB -1.997 17.116 19.000 0.189 0.000 0.918 80 A HN 0.037 8.219 8.150 0.054 0.000 0.594 81 V N -0.920 119.090 119.914 0.161 0.000 3.155 81 V HA 0.035 4.215 4.120 0.100 0.000 0.225 81 V C 0.262 176.465 176.094 0.182 0.000 1.462 81 V CA 1.544 63.917 62.300 0.121 0.000 1.270 81 V CB 1.364 33.220 31.823 0.054 0.000 1.112 81 V HN 0.478 8.899 8.190 0.172 -0.128 0.479 82 A N -0.433 122.498 122.820 0.185 0.000 1.903 82 A HA -0.091 4.373 4.320 0.241 0.000 0.217 82 A C 1.302 179.084 177.584 0.330 0.000 1.387 82 A CA 2.888 55.066 52.037 0.235 0.000 0.604 82 A CB -0.048 19.037 19.000 0.142 0.000 1.043 82 A HN -0.530 7.710 8.150 0.151 0.000 0.481 83 D N 1.252 121.810 120.400 0.263 0.000 3.048 83 D HA -0.438 4.328 4.640 0.209 0.000 0.192 83 D C 1.905 178.363 176.300 0.264 0.000 1.125 83 D CA 2.665 56.826 54.000 0.268 0.000 0.878 83 D CB -2.112 38.859 40.800 0.285 0.000 0.924 83 D HN 0.384 8.885 8.370 0.217 0.000 0.496 84 L N 0.279 121.687 121.223 0.308 0.000 2.021 84 L HA -0.343 3.845 4.340 -0.254 0.000 0.215 84 L C 1.105 178.067 176.870 0.152 0.000 1.074 84 L CA 2.548 57.478 54.840 0.150 0.000 0.760 84 L CB -0.553 41.647 42.059 0.235 0.000 0.889 84 L HN -0.082 8.335 8.230 0.342 0.018 0.433 85 F N -2.385 117.647 119.950 0.136 0.000 2.456 85 F HA -0.162 4.464 4.527 0.165 0.000 0.298 85 F C 0.564 176.541 175.800 0.296 0.000 1.104 85 F CA 0.350 58.489 58.000 0.231 0.000 1.435 85 F CB -0.193 38.930 39.000 0.205 0.000 1.078 85 F HN -0.333 8.069 8.300 0.431 0.157 0.546 86 M N -1.614 118.038 119.600 0.086 0.000 2.159 86 M HA -0.515 3.583 4.480 -0.637 0.000 0.263 86 M C 1.706 177.882 176.300 -0.206 0.000 1.063 86 M CA 4.024 59.166 55.300 -0.262 0.000 1.110 86 M CB -0.384 32.099 32.600 -0.195 0.000 1.374 86 M HN -0.580 7.644 8.290 0.177 0.172 0.411 87 V N -3.440 116.441 119.914 -0.055 0.000 2.515 87 V HA -0.267 3.836 4.120 -0.029 0.000 0.250 87 V C -0.061 176.198 176.094 0.275 0.000 1.058 87 V CA 3.201 65.526 62.300 0.042 0.000 1.064 87 V CB -0.246 31.563 31.823 -0.023 0.000 0.675 87 V HN -0.603 7.535 8.190 -0.021 0.040 0.461 88 F N -0.128 119.840 119.950 0.029 0.000 3.159 88 F HA -0.002 4.564 4.527 0.066 0.000 0.394 88 F C -0.685 175.202 175.800 0.146 0.000 1.214 88 F CA -0.378 57.680 58.000 0.097 0.000 1.241 88 F CB 0.591 39.695 39.000 0.173 0.000 2.238 88 F HN -0.537 7.686 8.300 0.166 0.177 0.658 89 G N 3.690 112.283 108.800 -0.344 0.000 2.496 89 G HA2 -0.398 3.163 3.960 -0.604 0.000 0.243 89 G HA3 -0.398 3.531 3.960 -0.315 -0.158 0.243 89 G C -0.105 174.605 174.900 -0.316 0.000 1.176 89 G CA -0.656 44.186 45.100 -0.429 0.000 0.940 89 G HN -0.525 7.533 8.290 -0.387 0.000 0.573 90 G N 1.612 110.251 108.800 -0.267 0.000 2.685 90 G HA2 -0.555 3.218 3.960 -0.313 0.000 0.357 90 G HA3 -0.555 3.504 3.960 -0.020 -0.111 0.357 90 G C 0.516 175.231 174.900 -0.307 0.000 1.272 90 G CA 1.422 46.388 45.100 -0.223 0.000 0.972 90 G HN -0.099 7.912 8.290 -0.293 0.103 0.550 91 F N 1.782 121.638 119.950 -0.157 0.000 2.046 91 F HA -0.334 4.127 4.527 -0.111 0.000 0.297 91 F C 2.024 177.691 175.800 -0.221 0.000 1.123 91 F CA 4.393 62.296 58.000 -0.162 0.000 1.199 91 F CB -0.479 38.428 39.000 -0.153 0.000 0.972 91 F HN 0.445 8.782 8.300 0.062 0.000 0.474 92 T N -3.502 110.933 114.554 -0.198 0.000 2.802 92 T HA -0.284 3.925 4.350 -0.235 0.000 0.269 92 T C 0.797 175.377 174.700 -0.199 0.000 1.062 92 T CA 2.224 64.143 62.100 -0.301 0.000 1.133 92 T CB -0.582 67.888 68.868 -0.663 0.000 0.852 92 T HN 0.304 8.387 8.240 -0.261 0.000 0.485 93 T N -2.330 112.096 114.554 -0.214 0.000 3.622 93 T HA 0.158 4.509 4.350 -0.255 -0.154 0.312 93 T C -1.678 172.896 174.700 -0.209 0.000 0.888 93 T CA -0.172 61.814 62.100 -0.190 0.000 0.957 93 T CB 1.669 70.499 68.868 -0.062 0.000 1.200 93 T HN -0.217 7.764 8.240 -0.244 0.112 0.633 94 T N 1.867 116.271 114.554 -0.251 0.000 4.734 94 T HA 0.287 4.675 4.350 -0.212 -0.166 0.261 94 T C -1.984 172.543 174.700 -0.289 0.000 0.927 94 T CA 0.521 62.459 62.100 -0.271 0.000 1.109 94 T CB 0.507 69.139 68.868 -0.393 0.000 0.866 94 T HN -0.144 7.952 8.240 -0.240 0.000 0.473 95 L N -0.165 120.890 121.223 -0.280 0.000 1.465 95 L HA 0.174 4.355 4.340 -0.266 0.000 0.144 95 L C -1.580 175.003 176.870 -0.479 0.000 1.333 95 L CA 2.049 56.688 54.840 -0.334 0.000 1.203 95 L CB 1.231 43.050 42.059 -0.400 0.000 2.504 95 L HN -0.392 7.683 8.230 -0.258 0.000 0.485 96 Y N -0.226 119.890 120.300 -0.306 0.000 2.153 96 Y HA -0.200 4.223 4.550 -0.211 0.000 0.289 96 Y C -0.397 175.327 175.900 -0.293 0.000 1.127 96 Y CA 2.945 60.908 58.100 -0.228 0.000 1.131 96 Y CB 1.905 40.310 38.460 -0.090 0.000 0.995 96 Y HN -0.733 7.547 8.280 -0.000 0.000 0.505 97 T N 0.590 114.981 114.554 -0.272 0.000 3.348 97 T HA 0.476 4.934 4.350 -0.248 -0.257 0.328 97 T C -2.126 172.341 174.700 -0.389 0.000 0.913 97 T CA -0.237 61.650 62.100 -0.354 0.000 1.043 97 T CB 1.068 69.695 68.868 -0.401 0.000 1.021 97 T HN -0.684 7.483 8.240 -0.122 0.000 0.461 98 S N 6.526 122.108 115.700 -0.196 0.000 4.583 98 S HA -0.004 4.392 4.470 -0.123 0.000 0.052 98 S C -1.087 173.491 174.600 -0.037 0.000 0.861 98 S CA 1.043 59.164 58.200 -0.130 0.000 0.874 98 S CB -0.205 62.874 63.200 -0.201 0.000 0.568 98 S HN 0.247 8.549 8.310 -0.012 0.000 0.786 99 L N -1.557 119.698 121.223 0.053 0.000 2.129 99 L HA -0.281 4.063 4.340 0.006 0.000 0.483 99 L C -2.733 174.171 176.870 0.056 0.000 0.714 99 L CA 3.106 57.964 54.840 0.030 0.000 3.307 99 L CB -0.891 41.181 42.059 0.021 0.000 0.592 99 L HN 0.025 8.343 8.230 0.146 0.000 0.792 100 H N -1.480 117.569 119.070 -0.035 0.000 2.895 100 H HA 0.373 5.030 4.556 0.025 -0.086 0.373 100 H C -1.605 173.707 175.328 -0.026 0.000 1.174 100 H CA -1.584 54.455 56.048 -0.015 0.000 1.144 100 H CB 3.467 33.204 29.762 -0.041 0.000 1.793 100 H HN -0.797 7.451 8.280 0.049 0.062 0.551 101 G N -0.990 107.557 108.800 -0.422 0.000 2.531 101 G HA2 0.133 4.280 3.960 0.245 0.000 0.281 101 G HA3 0.133 4.050 3.960 -0.072 0.000 0.281 101 G C 0.524 175.559 174.900 0.226 0.000 1.382 101 G CA -1.762 43.339 45.100 0.002 0.000 1.045 101 G HN 0.173 7.952 8.290 -0.629 0.134 0.533 102 Y N 0.036 120.534 120.300 0.329 0.000 2.040 102 Y HA -0.365 4.235 4.550 0.084 0.000 0.275 102 Y C 0.730 176.774 175.900 0.241 0.000 1.171 102 Y CA 3.982 62.225 58.100 0.240 0.000 1.123 102 Y CB 0.139 38.818 38.460 0.365 0.000 0.963 102 Y HN 0.285 9.018 8.280 0.755 0.000 0.493 103 F N -8.381 111.718 119.950 0.249 0.000 2.184 103 F HA -0.334 4.291 4.527 0.163 0.000 0.318 103 F C -2.122 173.776 175.800 0.163 0.000 0.667 103 F CA 0.483 58.620 58.000 0.228 0.000 0.912 103 F CB -0.551 38.684 39.000 0.391 0.000 4.135 103 F HN -0.769 7.684 8.300 0.256 0.000 0.137 104 V N -1.209 118.271 119.914 -0.724 0.000 0.978 104 V HA -0.192 2.161 4.120 -2.945 0.000 0.128 104 V C -2.057 175.021 176.094 1.641 0.000 0.847 104 V CA -0.163 59.517 62.300 -4.367 0.000 2.988 104 V CB 0.101 22.880 31.823 -15.073 0.000 0.342 104 V HN -0.023 7.857 8.190 -0.281 0.141 0.109 105 F N 0.103 116.548 119.950 -5.842 0.000 2.183 105 F HA -0.457 3.340 4.527 -1.216 0.000 0.318 105 F C -0.727 175.506 175.800 0.721 0.000 0.549 105 F CA 1.354 59.218 58.000 -0.227 0.000 0.912 105 F CB -0.115 39.039 39.000 0.257 0.000 4.135 105 F HN 0.014 -7.340 8.300 -26.090 0.000 0.137 106 G N -0.801 108.155 108.800 0.260 0.000 2.572 106 G HA2 0.030 5.146 3.960 1.523 0.000 0.214 106 G HA3 0.030 4.522 3.960 0.872 -0.009 0.214 106 G C -1.816 170.177 174.900 -4.845 0.000 1.246 106 G CA 1.009 47.078 45.100 1.615 0.000 0.835 106 G HN 0.330 8.739 8.290 0.199 0.000 0.551 107 P HA -0.069 3.724 4.420 -1.045 0.000 0.204 107 P C -0.086 177.176 177.300 -0.062 0.000 1.012 107 P CA 1.027 63.647 63.100 -0.799 0.000 0.835 107 P CB 0.165 31.662 31.700 -0.339 0.000 0.603 108 T N 0.533 115.091 114.554 0.007 0.000 2.750 108 T HA -0.246 4.126 4.350 0.038 0.000 0.286 108 T C 0.742 175.443 174.700 0.002 0.000 0.911 108 T CA 1.184 63.303 62.100 0.032 0.000 1.130 108 T CB -1.326 67.634 68.868 0.153 0.000 0.873 108 T HN 0.067 8.370 8.240 0.106 0.000 0.536 109 G N 6.710 115.550 108.800 0.067 0.000 2.351 109 G HA2 -0.385 3.637 3.960 0.077 0.000 0.297 109 G HA3 -0.385 3.659 3.960 0.140 0.000 0.297 109 G C -0.864 174.075 174.900 0.064 0.000 1.054 109 G CA 0.618 45.773 45.100 0.091 0.000 1.123 109 G HN 0.113 8.429 8.290 0.042 0.000 0.512 110 c N -7.019 111.632 118.600 0.084 0.000 5.897 110 c HA -0.214 4.412 4.570 0.094 0.000 0.325 110 c C -1.695 172.506 174.090 0.186 0.000 2.404 110 c CA 0.650 57.046 56.329 0.111 0.000 2.170 110 c CB -1.045 41.524 42.510 0.098 0.000 3.212 110 c HN -0.301 7.988 8.230 0.099 0.000 0.284 111 N N 3.942 122.702 118.700 0.101 0.000 2.671 111 N HA 0.081 4.876 4.740 -0.132 -0.134 0.303 111 N C 0.282 175.711 175.510 -0.134 0.000 1.351 111 N CA -0.397 52.526 53.050 -0.211 0.000 0.991 111 N CB -0.138 37.977 38.487 -0.621 0.000 1.307 111 N HN -0.137 8.354 8.380 0.185 0.000 0.512 112 L N 0.189 121.444 121.223 0.053 0.000 1.993 112 L HA -0.302 4.241 4.340 0.339 0.000 0.206 112 L C 0.589 177.582 176.870 0.206 0.000 1.074 112 L CA 3.118 58.055 54.840 0.162 0.000 0.746 112 L CB 0.237 42.328 42.059 0.054 0.000 0.896 112 L HN -0.210 7.984 8.230 0.065 0.074 0.435 113 E N -0.774 119.512 120.200 0.143 0.000 2.041 113 E HA -0.492 3.938 4.350 0.133 0.000 0.227 113 E C 2.407 179.123 176.600 0.193 0.000 1.039 113 E CA 2.835 59.338 56.400 0.171 0.000 0.904 113 E CB -1.130 28.704 29.700 0.224 0.000 0.808 113 E HN -0.114 8.321 8.360 0.127 0.000 0.510 114 G N -3.841 105.067 108.800 0.180 0.000 2.509 114 G HA2 -0.197 3.899 3.960 0.226 0.000 0.218 114 G HA3 -0.197 3.894 3.960 0.219 0.000 0.218 114 G C 0.982 176.082 174.900 0.334 0.000 1.124 114 G CA 1.157 46.391 45.100 0.224 0.000 0.776 114 G HN -0.345 8.023 8.290 0.131 0.000 0.547 115 F N 1.907 121.890 119.950 0.056 0.000 2.183 115 F HA -0.101 4.361 4.527 -0.108 0.000 0.270 115 F C 1.741 177.458 175.800 -0.139 0.000 1.251 115 F CA -0.126 57.805 58.000 -0.115 0.000 1.078 115 F CB -1.029 37.795 39.000 -0.293 0.000 0.998 115 F HN -0.802 7.541 8.300 0.240 0.101 0.526 116 F N -0.968 119.132 119.950 0.250 0.000 2.087 116 F HA -0.461 4.126 4.527 0.100 0.000 0.299 116 F C 2.291 178.081 175.800 -0.017 0.000 1.100 116 F CA 4.292 62.338 58.000 0.077 0.000 1.226 116 F CB -1.158 37.845 39.000 0.005 0.000 0.983 116 F HN -0.365 8.150 8.300 0.358 0.000 0.479 117 A N -5.459 117.472 122.820 0.184 0.000 2.277 117 A HA -0.167 4.153 4.320 0.001 0.000 0.208 117 A C -0.005 177.557 177.584 -0.036 0.000 1.202 117 A CA 1.569 53.643 52.037 0.061 0.000 0.762 117 A CB -0.874 18.176 19.000 0.082 0.000 0.770 117 A HN -0.089 8.222 8.150 0.268 0.000 0.487 118 T N -7.702 106.781 114.554 -0.118 0.000 3.168 118 T HA 0.093 4.075 4.350 -0.614 0.000 0.261 118 T C 1.066 175.547 174.700 -0.364 0.000 0.931 118 T CA 0.205 62.121 62.100 -0.307 0.000 0.949 118 T CB 2.058 70.896 68.868 -0.051 0.000 1.229 118 T HN -0.180 7.876 8.240 0.001 0.185 0.504 119 L N 3.273 124.394 121.223 -0.170 0.000 2.083 119 L HA -0.076 4.200 4.340 -0.107 0.000 0.209 119 L C 0.579 177.369 176.870 -0.134 0.000 1.083 119 L CA 2.091 56.852 54.840 -0.132 0.000 0.752 119 L CB -0.027 41.945 42.059 -0.146 0.000 0.899 119 L HN 0.130 8.311 8.230 -0.081 0.000 0.433 120 G N -3.138 105.589 108.800 -0.122 0.000 3.353 120 G HA2 -0.088 3.853 3.960 -0.032 0.000 0.247 120 G HA3 -0.088 3.887 3.960 -0.022 -0.028 0.247 120 G C -1.333 173.342 174.900 -0.374 0.000 1.025 120 G CA 0.306 45.340 45.100 -0.111 0.000 1.863 120 G HN -0.019 8.095 8.290 -0.094 0.120 0.635 121 G N -0.252 108.185 108.800 -0.606 0.000 3.183 121 G HA2 -0.036 3.548 3.960 -0.626 0.000 0.140 121 G HA3 -0.036 2.478 3.960 -2.423 -0.008 0.140 121 G C -0.608 174.013 174.900 -0.464 0.000 1.209 121 G CA 0.641 45.110 45.100 -1.052 0.000 1.438 121 G HN -0.690 7.136 8.290 -0.444 0.197 0.700 122 E N 2.201 122.109 120.200 -0.486 0.000 2.517 122 E HA -0.439 3.851 4.350 -0.100 0.000 0.251 122 E C 2.229 178.853 176.600 0.039 0.000 0.990 122 E CA 3.192 59.510 56.400 -0.138 0.000 1.133 122 E CB -0.502 29.157 29.700 -0.068 0.000 1.088 122 E HN -0.119 7.731 8.360 -0.850 0.000 0.516 123 I N -0.652 119.974 120.570 0.093 0.000 2.361 123 I HA -0.506 3.885 4.170 0.368 0.000 0.251 123 I C 2.054 178.234 176.117 0.105 0.000 1.133 123 I CA 3.596 64.992 61.300 0.160 0.000 1.413 123 I CB -0.439 37.584 38.000 0.039 0.000 1.073 123 I HN -0.586 7.614 8.210 -0.017 0.000 0.424 124 A N 0.781 123.632 122.820 0.052 0.000 1.883 124 A HA -0.300 4.074 4.320 0.090 0.000 0.217 124 A C 1.210 178.880 177.584 0.144 0.000 1.186 124 A CA 3.071 55.162 52.037 0.089 0.000 0.624 124 A CB -0.368 18.679 19.000 0.078 0.000 0.822 124 A HN -0.218 7.892 8.150 -0.002 0.038 0.444 125 L N -5.282 116.029 121.223 0.147 0.000 2.418 125 L HA -0.161 4.309 4.340 0.216 0.000 0.218 125 L C 1.114 178.092 176.870 0.179 0.000 1.125 125 L CA 1.408 56.356 54.840 0.180 0.000 0.835 125 L CB -0.046 42.130 42.059 0.193 0.000 0.953 125 L HN -0.357 7.834 8.230 0.090 0.093 0.454 126 W N -0.816 120.477 121.300 -0.013 0.000 2.576 126 W HA -0.029 4.574 4.660 -0.095 0.000 0.275 126 W C 1.874 178.357 176.519 -0.059 0.000 1.241 126 W CA 0.510 57.806 57.345 -0.082 0.000 1.328 126 W CB 0.353 29.715 29.460 -0.163 0.000 1.092 126 W HN 0.176 8.286 8.180 0.275 0.235 0.586 127 S N 0.459 116.287 115.700 0.214 0.000 2.488 127 S HA -0.274 4.215 4.470 0.031 0.000 0.246 127 S C 1.698 176.393 174.600 0.158 0.000 0.992 127 S CA 2.658 60.922 58.200 0.108 0.000 0.963 127 S CB -0.946 62.304 63.200 0.084 0.000 0.754 127 S HN -0.237 8.093 8.310 0.216 0.110 0.519 128 L N -0.260 121.104 121.223 0.235 0.000 2.633 128 L HA -0.106 4.395 4.340 0.267 0.000 0.235 128 L C 0.993 178.108 176.870 0.407 0.000 1.163 128 L CA 1.341 56.365 54.840 0.306 0.000 0.859 128 L CB -0.505 41.748 42.059 0.324 0.000 0.973 128 L HN 0.033 8.268 8.230 0.245 0.141 0.451 129 V N 1.769 121.875 119.914 0.321 0.000 2.594 129 V HA -0.391 3.996 4.120 0.445 0.000 0.253 129 V C 0.187 176.372 176.094 0.152 0.000 1.069 129 V CA 3.057 65.531 62.300 0.291 0.000 1.082 129 V CB -0.388 31.545 31.823 0.184 0.000 0.680 129 V HN -0.426 7.807 8.190 0.252 0.109 0.469 130 V N -1.887 118.090 119.914 0.104 0.000 3.636 130 V HA -0.177 3.958 4.120 0.026 0.000 0.279 130 V C 0.315 176.404 176.094 -0.008 0.000 1.263 130 V CA 1.577 63.900 62.300 0.038 0.000 1.182 130 V CB -2.135 29.708 31.823 0.034 0.000 0.955 130 V HN -0.304 7.951 8.190 0.122 0.008 0.443 131 L N -2.430 118.774 121.223 -0.032 0.000 2.717 131 L HA 0.252 4.324 4.340 -0.447 0.000 0.239 131 L C 0.324 176.599 176.870 -0.993 0.000 1.086 131 L CA 0.162 54.803 54.840 -0.331 0.000 0.897 131 L CB 1.648 43.784 42.059 0.128 0.000 1.214 131 L HN 0.123 8.227 8.230 0.111 0.193 0.508 132 A N -0.034 122.699 122.820 -0.144 0.000 1.933 132 A HA -0.190 4.511 4.320 0.635 0.000 0.218 132 A C 1.520 179.057 177.584 -0.079 0.000 1.175 132 A CA 2.499 54.495 52.037 -0.068 0.000 0.628 132 A CB 0.184 19.001 19.000 -0.306 0.000 0.814 132 A HN -0.312 7.730 8.150 0.059 0.143 0.444 133 I N -8.559 111.920 120.570 -0.152 0.000 2.293 133 I HA -0.049 4.107 4.170 -0.024 0.000 0.280 133 I C -1.468 174.528 176.117 -0.202 0.000 1.075 133 I CA -0.254 60.998 61.300 -0.079 0.000 1.702 133 I CB -2.320 35.708 38.000 0.047 0.000 1.477 133 I HN -0.589 7.523 8.210 -0.136 0.017 0.733 134 E N 3.028 123.014 120.200 -0.357 0.000 2.673 134 E HA 0.043 4.465 4.350 0.120 0.000 0.290 134 E C -1.254 176.844 176.600 2.496 0.000 1.090 134 E CA 0.303 56.686 56.400 -0.028 0.000 2.132 134 E CB 0.412 29.989 29.700 -0.205 0.000 2.151 134 E HN -0.219 7.951 8.360 -0.121 0.117 1.119 135 R N 3.492 123.818 120.500 -0.291 0.000 3.072 135 R HA -0.192 3.718 4.340 -0.717 0.000 0.220 135 R C -0.741 173.061 176.300 -4.163 0.000 1.627 135 R CA 1.474 54.851 56.100 -4.539 0.000 1.079 135 R CB -1.862 27.594 30.300 -1.407 0.000 1.217 135 R HN 0.217 9.278 8.270 1.319 0.000 0.615 136 Y N -2.226 118.076 120.300 0.003 0.000 1.431 136 Y HA -0.213 3.881 4.550 -0.759 0.000 0.171 136 Y C -0.686 175.081 175.900 -0.221 0.000 1.583 136 Y CA 0.264 58.173 58.100 -0.318 0.000 1.074 136 Y CB -0.302 38.057 38.460 -0.168 0.000 5.074 136 Y HN -0.447 7.639 8.280 -0.324 0.000 0.064 137 V N 2.401 122.375 119.914 0.100 0.000 2.800 137 V HA 0.103 4.209 4.120 -0.024 0.000 0.365 137 V C 0.245 176.388 176.094 0.081 0.000 1.527 137 V CA -0.007 62.312 62.300 0.032 0.000 1.623 137 V CB -2.583 29.247 31.823 0.013 0.000 1.407 137 V HN -0.071 8.299 8.190 0.285 -0.009 0.527 138 V N 4.478 124.441 119.914 0.082 0.000 2.490 138 V HA -0.208 4.065 4.120 0.085 -0.102 0.250 138 V C -0.761 175.371 176.094 0.064 0.000 1.061 138 V CA 2.485 64.828 62.300 0.072 0.000 1.064 138 V CB 0.068 31.919 31.823 0.046 0.000 0.670 138 V HN -0.212 7.891 8.190 0.040 0.112 0.461 139 V N -5.382 114.566 119.914 0.057 0.000 5.704 139 V HA 0.038 4.198 4.120 0.066 0.000 0.094 139 V C -0.566 175.538 176.094 0.017 0.000 0.856 139 V CA 0.351 62.692 62.300 0.068 0.000 1.342 139 V CB 2.167 34.083 31.823 0.155 0.000 2.430 139 V HN -0.666 7.477 8.190 0.033 0.066 0.384 140 C N -2.820 116.470 119.300 -0.016 0.000 4.712 140 C HA 0.005 4.439 4.460 -0.042 0.000 0.413 140 C C -1.514 173.428 174.990 -0.080 0.000 0.881 140 C CA 0.890 59.878 59.018 -0.050 0.000 2.306 140 C CB 2.242 29.948 27.740 -0.056 0.000 2.657 140 C HN -0.118 8.368 8.230 -0.007 -0.260 0.360 141 K N 0.384 120.732 120.400 -0.087 0.000 5.294 141 K HA -0.240 4.000 4.320 -0.133 0.000 0.344 141 K C -2.644 173.910 176.600 -0.078 0.000 0.909 141 K CA 0.413 56.640 56.287 -0.101 0.000 1.081 141 K CB -2.223 30.226 32.500 -0.085 0.000 1.814 141 K HN -0.287 7.972 8.250 -0.081 -0.058 0.407 142 P HA 0.034 4.422 4.420 -0.054 0.000 0.266 142 P C 0.622 177.892 177.300 -0.050 0.000 1.215 142 P CA 0.098 63.164 63.100 -0.056 0.000 0.763 142 P CB 0.320 31.991 31.700 -0.049 0.000 0.806 143 M N 0.422 119.992 119.600 -0.050 0.000 2.830 143 M HA -0.596 3.854 4.480 -0.052 0.000 0.157 143 M C 0.103 176.368 176.300 -0.059 0.000 0.684 143 M CA 2.480 57.749 55.300 -0.052 0.000 0.597 143 M CB -1.179 31.392 32.600 -0.048 0.000 2.184 143 M HN 0.730 8.989 8.290 -0.053 0.000 0.266 144 S N -3.772 111.895 115.700 -0.054 0.000 1.402 144 S HA -0.434 4.011 4.470 -0.041 0.000 0.247 144 S C -0.332 174.225 174.600 -0.071 0.000 0.661 144 S CA 2.317 60.485 58.200 -0.054 0.000 1.198 144 S CB -0.774 62.401 63.200 -0.043 0.000 1.282 144 S HN 0.400 8.588 8.310 -0.050 0.093 0.501 145 N N -1.262 117.365 118.700 -0.121 0.000 3.669 145 N HA 0.037 4.766 4.740 -0.018 0.000 0.357 145 N C -0.592 174.855 175.510 -0.105 0.000 1.397 145 N CA -0.198 52.791 53.050 -0.102 0.000 0.725 145 N CB 0.099 38.517 38.487 -0.116 0.000 2.980 145 N HN -0.775 7.467 8.380 -0.139 0.054 0.498 146 F N -1.273 118.642 119.950 -0.059 0.000 2.161 146 F HA -0.156 4.321 4.527 -0.083 0.000 0.300 146 F C -0.278 175.431 175.800 -0.153 0.000 1.089 146 F CA 1.746 59.693 58.000 -0.088 0.000 1.282 146 F CB -0.128 38.824 39.000 -0.079 0.000 1.010 146 F HN -0.025 8.405 8.300 0.216 0.000 0.485 147 R N -2.438 117.500 120.500 -0.935 0.000 3.003 147 R HA 0.060 4.116 4.340 -0.473 0.000 0.251 147 R C -1.451 174.596 176.300 -0.422 0.000 1.265 147 R CA -1.879 53.802 56.100 -0.699 0.000 1.026 147 R CB 1.658 31.310 30.300 -1.080 0.000 1.307 147 R HN -0.768 6.622 8.270 -1.420 0.029 0.475 148 F N -0.364 119.440 119.950 -0.243 0.000 2.411 148 F HA 0.212 4.651 4.527 -0.148 0.000 0.355 148 F C -0.057 175.665 175.800 -0.130 0.000 1.117 148 F CA 0.179 58.086 58.000 -0.154 0.000 1.139 148 F CB 1.552 40.493 39.000 -0.099 0.000 1.120 148 F HN 0.066 8.385 8.300 0.032 0.000 0.493 149 G N 2.592 111.400 108.800 0.012 0.000 2.850 149 G HA2 -0.069 3.877 3.960 -0.025 0.000 0.211 149 G HA3 -0.069 3.873 3.960 -0.050 -0.012 0.211 149 G C -0.268 174.608 174.900 -0.041 0.000 1.124 149 G CA 0.040 45.124 45.100 -0.027 0.000 0.769 149 G HN 0.453 8.718 8.290 -0.041 0.000 0.535 150 E N 1.915 122.115 120.200 0.001 0.000 2.214 150 E HA -0.229 4.012 4.350 -0.182 0.000 0.291 150 E C 0.094 176.567 176.600 -0.212 0.000 1.137 150 E CA -0.129 56.225 56.400 -0.077 0.000 1.175 150 E CB -2.713 27.028 29.700 0.067 0.000 1.071 150 E HN -0.072 8.319 8.360 0.052 0.000 0.467 151 N N -0.952 117.590 118.700 -0.262 0.000 2.069 151 N HA -0.508 4.204 4.740 -0.046 0.000 0.196 151 N C 0.257 175.713 175.510 -0.089 0.000 1.024 151 N CA 2.670 55.638 53.050 -0.136 0.000 0.869 151 N CB 0.594 38.992 38.487 -0.148 0.000 1.035 151 N HN -0.406 7.803 8.380 -0.214 0.042 0.434 152 H N -2.590 116.485 119.070 0.008 0.000 1.619 152 H HA -0.203 4.433 4.556 0.003 -0.079 0.280 152 H C 0.826 176.104 175.328 -0.082 0.000 1.892 152 H CA 0.567 56.610 56.048 -0.008 0.000 1.333 152 H CB 0.323 30.092 29.762 0.012 0.000 1.733 152 H HN -0.518 7.227 8.280 -0.856 0.021 0.485 153 A N -1.501 121.434 122.820 0.191 0.000 4.599 153 A HA -0.412 3.908 4.320 -0.000 0.000 0.336 153 A C 2.078 179.601 177.584 -0.102 0.000 1.823 153 A CA 2.383 54.397 52.037 -0.039 0.000 0.766 153 A CB -1.959 16.916 19.000 -0.207 0.000 1.419 153 A HN 0.370 8.638 8.150 0.196 0.000 0.464 154 I N -2.495 117.911 120.570 -0.274 0.000 2.163 154 I HA -0.185 3.911 4.170 -0.123 0.000 0.240 154 I C -0.108 175.987 176.117 -0.037 0.000 1.081 154 I CA 2.845 64.035 61.300 -0.183 0.000 1.353 154 I CB -0.143 37.707 38.000 -0.250 0.000 1.054 154 I HN -0.278 7.640 8.210 -0.487 0.000 0.407 155 M N -2.081 117.507 119.600 -0.019 0.000 2.944 155 M HA 0.298 4.905 4.480 0.084 -0.077 0.235 155 M C -0.895 175.476 176.300 0.118 0.000 1.188 155 M CA -0.610 54.721 55.300 0.051 0.000 0.688 155 M CB 0.384 32.974 32.600 -0.017 0.000 1.406 155 M HN -0.756 7.494 8.290 -0.066 0.000 0.479 156 G N -0.008 108.913 108.800 0.202 0.000 2.498 156 G HA2 -0.335 3.739 3.960 0.190 0.000 0.245 156 G HA3 -0.335 3.702 3.960 0.107 -0.013 0.245 156 G C 0.645 175.691 174.900 0.242 0.000 1.204 156 G CA -0.224 44.985 45.100 0.183 0.000 0.933 156 G HN -0.258 8.164 8.290 0.221 0.000 0.574 157 V N -1.306 118.740 119.914 0.220 0.000 2.427 157 V HA -0.229 4.137 4.120 0.410 0.000 0.248 157 V C 1.278 177.518 176.094 0.242 0.000 1.051 157 V CA 2.282 64.777 62.300 0.326 0.000 1.048 157 V CB -0.250 31.808 31.823 0.391 0.000 0.666 157 V HN -0.411 7.780 8.190 0.150 0.089 0.456 158 A N 1.397 124.290 122.820 0.122 0.000 3.074 158 A HA -0.041 4.295 4.320 0.026 0.000 0.251 158 A C -1.877 175.746 177.584 0.066 0.000 1.695 158 A CA 0.476 52.538 52.037 0.042 0.000 1.343 158 A CB -1.970 17.020 19.000 -0.017 0.000 1.078 158 A HN -0.089 8.121 8.150 0.099 0.000 0.644 159 F N -0.165 119.746 119.950 -0.065 0.000 1.814 159 F HA -0.045 4.330 4.527 -0.254 0.000 0.234 159 F C -0.630 175.156 175.800 -0.025 0.000 1.260 159 F CA 1.603 59.528 58.000 -0.125 0.000 1.272 159 F CB 1.051 39.977 39.000 -0.124 0.000 2.003 159 F HN -0.477 7.783 8.300 0.134 0.121 0.142 160 T N 2.467 117.052 114.554 0.051 0.000 2.777 160 T HA -0.142 4.132 4.350 -0.127 0.000 0.266 160 T C 1.298 175.961 174.700 -0.062 0.000 1.040 160 T CA 3.853 65.974 62.100 0.034 0.000 1.141 160 T CB -0.208 68.824 68.868 0.273 0.000 0.868 160 T HN 0.228 8.669 8.240 0.334 0.000 0.444 161 W N 1.713 122.977 121.300 -0.060 0.000 3.468 161 W HA 0.179 4.764 4.660 -0.357 -0.139 0.327 161 W C -0.136 176.279 176.519 -0.174 0.000 1.259 161 W CA -0.207 57.047 57.345 -0.151 0.000 1.706 161 W CB -1.991 27.470 29.460 0.002 0.000 1.007 161 W HN -0.063 8.168 8.180 0.260 0.105 0.764 162 V N -1.248 118.668 119.914 0.004 0.000 3.278 162 V HA -0.052 4.058 4.120 -0.017 0.000 0.215 162 V C 0.532 176.526 176.094 -0.166 0.000 1.287 162 V CA 1.195 63.437 62.300 -0.097 0.000 1.302 162 V CB 1.368 33.070 31.823 -0.201 0.000 1.228 162 V HN -0.917 7.104 8.190 -0.100 0.109 0.523 163 M N -0.972 118.478 119.600 -0.250 0.000 2.117 163 M HA -0.404 3.888 4.480 -0.314 0.000 0.262 163 M C 0.951 177.302 176.300 0.084 0.000 1.065 163 M CA 3.294 58.498 55.300 -0.161 0.000 1.114 163 M CB 0.514 32.973 32.600 -0.235 0.000 1.361 163 M HN -0.246 7.837 8.290 -0.345 0.000 0.408 164 A N -1.029 121.750 122.820 -0.069 0.000 2.506 164 A HA 0.129 4.495 4.320 0.076 0.000 0.320 164 A C -1.488 176.001 177.584 -0.159 0.000 1.424 164 A CA -0.566 51.372 52.037 -0.164 0.000 1.044 164 A CB -0.055 18.630 19.000 -0.524 0.000 1.140 164 A HN 0.179 8.119 8.150 -0.173 0.106 0.538 165 L N 2.844 124.160 121.223 0.155 0.000 3.174 165 L HA 0.194 4.600 4.340 0.111 0.000 0.283 165 L C -0.287 176.814 176.870 0.386 0.000 1.187 165 L CA 0.595 55.576 54.840 0.235 0.000 1.018 165 L CB 2.116 44.305 42.059 0.216 0.000 1.433 165 L HN -0.133 8.298 8.230 0.336 0.000 0.593 166 A N 0.155 123.353 122.820 0.631 0.000 2.247 166 A HA -0.091 4.555 4.320 0.544 0.000 0.205 166 A C 0.577 178.423 177.584 0.437 0.000 1.261 166 A CA 1.049 53.470 52.037 0.639 0.000 0.853 166 A CB -2.077 17.504 19.000 0.968 0.000 0.793 166 A HN -0.172 8.407 8.150 0.614 -0.061 0.487 167 C N -1.664 117.779 119.300 0.239 0.000 2.434 167 C HA -0.297 4.250 4.460 0.145 0.000 0.298 167 C C 0.752 175.862 174.990 0.201 0.000 1.495 167 C CA 1.987 61.091 59.018 0.145 0.000 1.756 167 C CB -1.232 26.495 27.740 -0.021 0.000 1.647 167 C HN 0.288 8.543 8.230 0.172 0.078 0.579 168 A N 0.396 123.356 122.820 0.234 0.000 2.067 168 A HA -0.139 4.287 4.320 0.176 0.000 0.217 168 A C 0.251 177.996 177.584 0.269 0.000 1.156 168 A CA 2.229 54.400 52.037 0.223 0.000 0.683 168 A CB -0.548 18.593 19.000 0.236 0.000 0.808 168 A HN -0.078 8.156 8.150 0.262 0.074 0.455 169 A N -0.165 122.853 122.820 0.330 0.000 1.855 169 A HA -0.271 4.327 4.320 0.349 -0.068 0.215 169 A C -1.318 176.433 177.584 0.277 0.000 1.191 169 A CA 4.227 56.471 52.037 0.344 0.000 0.613 169 A CB -2.652 16.604 19.000 0.427 0.000 0.829 169 A HN 0.322 8.561 8.150 0.363 0.129 0.442 170 P HA -0.251 4.290 4.420 0.202 0.000 0.219 170 P C -0.781 176.636 177.300 0.195 0.000 1.159 170 P CA 3.481 66.704 63.100 0.207 0.000 0.944 170 P CB -2.616 29.203 31.700 0.200 0.000 0.792 171 P HA -0.214 4.300 4.420 0.157 0.000 0.200 171 P C 1.780 179.215 177.300 0.225 0.000 1.007 171 P CA 2.357 65.562 63.100 0.175 0.000 0.916 171 P CB -0.140 31.641 31.700 0.136 0.000 0.696 172 L N -4.161 117.189 121.223 0.211 0.000 2.056 172 L HA -0.278 4.222 4.340 0.267 0.000 0.207 172 L C 2.501 179.570 176.870 0.331 0.000 1.078 172 L CA 2.862 57.846 54.840 0.239 0.000 0.749 172 L CB -0.197 41.934 42.059 0.119 0.000 0.901 172 L HN 0.173 8.514 8.230 0.186 0.000 0.433 173 V N -2.114 117.968 119.914 0.281 0.000 2.343 173 V HA -0.356 3.786 4.120 0.037 0.000 0.247 173 V C 1.651 177.874 176.094 0.214 0.000 1.051 173 V CA 3.405 65.849 62.300 0.241 0.000 1.036 173 V CB -0.789 31.275 31.823 0.402 0.000 0.654 173 V HN -0.087 8.281 8.190 0.295 0.000 0.451 174 G N -3.339 105.619 108.800 0.264 0.000 2.421 174 G HA2 -0.098 4.008 3.960 0.243 0.000 0.217 174 G HA3 -0.098 4.193 3.960 0.226 -0.196 0.217 174 G C 1.542 176.588 174.900 0.243 0.000 1.143 174 G CA 0.767 46.013 45.100 0.243 0.000 0.784 174 G HN -0.355 7.946 8.290 0.280 0.156 0.541 175 W N 4.177 125.535 121.300 0.097 0.000 2.374 175 W HA -0.276 4.458 4.660 0.123 0.000 0.288 175 W C 0.274 176.861 176.519 0.113 0.000 1.218 175 W CA 2.672 60.075 57.345 0.098 0.000 1.245 175 W CB 0.185 29.680 29.460 0.058 0.000 1.126 175 W HN 0.166 8.572 8.180 0.411 0.021 0.545 176 S N -0.704 114.946 115.700 -0.084 0.000 2.840 176 S HA 0.083 4.248 4.470 -0.718 -0.126 0.235 176 S C -0.549 174.005 174.600 -0.076 0.000 0.968 176 S CA 0.444 58.432 58.200 -0.354 0.000 1.026 176 S CB -0.885 62.002 63.200 -0.521 0.000 0.788 176 S HN -0.160 8.223 8.310 0.213 0.055 0.487 177 R N -1.632 118.869 120.500 0.000 0.000 2.629 177 R HA 0.361 4.816 4.340 -0.012 -0.122 0.408 177 R C -1.942 174.362 176.300 0.006 0.000 1.057 177 R CA -1.394 54.739 56.100 0.054 0.000 1.119 177 R CB 0.796 31.204 30.300 0.180 0.000 1.403 177 R HN -0.327 7.796 8.270 0.041 0.171 0.576 178 Y N -0.989 119.155 120.300 -0.260 0.000 2.782 178 Y HA -0.113 4.319 4.550 -0.197 0.000 0.264 178 Y C -2.243 173.407 175.900 -0.417 0.000 1.020 178 Y CA 0.128 58.086 58.100 -0.237 0.000 1.223 178 Y CB 0.583 38.992 38.460 -0.086 0.000 1.137 178 Y HN 0.009 7.988 8.280 -0.236 0.159 0.560 179 I N -2.493 117.810 120.570 -0.445 0.000 3.223 179 I HA 0.478 4.471 4.170 -0.414 -0.071 0.317 179 I C -2.055 173.792 176.117 -0.450 0.000 1.050 179 I CA -4.344 56.679 61.300 -0.462 0.000 1.069 179 I CB -0.576 37.091 38.000 -0.554 0.000 1.406 179 I HN -0.524 7.354 8.210 -0.553 0.000 0.596 180 P HA -0.011 4.247 4.420 -0.350 -0.049 0.258 180 P C -1.300 175.807 177.300 -0.321 0.000 1.187 180 P CA 0.039 62.907 63.100 -0.387 0.000 0.767 180 P CB -0.024 31.406 31.700 -0.450 0.000 0.770 181 E N 4.717 124.702 120.200 -0.359 0.000 2.324 181 E HA -0.162 3.914 4.350 -0.630 -0.105 0.271 181 E C 0.922 177.324 176.600 -0.331 0.000 1.028 181 E CA 0.571 56.672 56.400 -0.498 0.000 0.890 181 E CB 1.030 30.387 29.700 -0.572 0.000 1.004 181 E HN 0.261 8.413 8.360 -0.347 0.000 0.431 182 G N 4.543 113.175 108.800 -0.280 0.000 3.530 182 G HA2 0.093 4.002 3.960 -0.086 0.000 0.269 182 G HA3 0.093 4.039 3.960 -0.023 0.000 0.269 182 G C -1.434 173.434 174.900 -0.054 0.000 1.314 182 G CA 0.584 45.624 45.100 -0.100 0.000 1.441 182 G HN 0.606 8.689 8.290 -0.345 0.000 0.595 183 M N -2.356 117.183 119.600 -0.102 0.000 1.676 183 M HA 0.134 4.654 4.480 0.066 0.000 0.184 183 M C 0.617 176.884 176.300 -0.054 0.000 1.292 183 M CA 1.202 56.476 55.300 -0.043 0.000 0.847 183 M CB 2.681 35.224 32.600 -0.096 0.000 1.623 183 M HN 0.070 8.289 8.290 -0.189 -0.043 0.603 184 Q N -0.368 119.348 119.800 -0.141 0.000 2.167 184 Q HA -0.221 4.066 4.340 -0.087 0.000 0.202 184 Q C 1.407 177.354 176.000 -0.088 0.000 0.970 184 Q CA 2.473 58.207 55.803 -0.116 0.000 0.855 184 Q CB -0.186 28.465 28.738 -0.145 0.000 0.911 184 Q HN -0.001 8.432 8.270 -0.206 -0.286 0.438 185 C N -1.539 117.691 119.300 -0.116 0.000 2.448 185 C HA -0.241 4.156 4.460 -0.105 0.000 0.280 185 C C -0.072 174.881 174.990 -0.061 0.000 1.398 185 C CA 0.957 59.913 59.018 -0.104 0.000 1.774 185 C CB 0.808 28.461 27.740 -0.145 0.000 1.888 185 C HN -0.398 7.735 8.230 -0.162 0.000 0.519 186 S N -2.960 112.735 115.700 -0.008 0.000 1.405 186 S HA -0.317 4.406 4.470 0.259 -0.097 0.246 186 S C -1.258 173.298 174.600 -0.073 0.000 0.678 186 S CA 3.041 61.253 58.200 0.020 0.000 1.182 186 S CB -1.522 61.608 63.200 -0.117 0.000 1.355 186 S HN 0.110 8.252 8.310 -0.009 0.163 0.503 187 c N -0.641 117.898 118.600 -0.102 0.000 3.364 187 c HA 0.170 4.698 4.570 -0.069 0.000 0.298 187 c C -0.374 173.662 174.090 -0.090 0.000 2.497 187 c CA -1.853 54.434 56.329 -0.071 0.000 1.389 187 c CB 0.335 42.827 42.510 -0.029 0.000 2.592 187 c HN -0.354 7.771 8.230 -0.115 0.035 0.509 188 G N 3.131 111.854 108.800 -0.129 0.000 2.915 188 G HA2 -0.334 3.522 3.960 -0.172 0.000 0.337 188 G HA3 -0.334 3.516 3.960 -0.182 0.000 0.337 188 G C -0.467 174.361 174.900 -0.119 0.000 1.477 188 G CA 0.364 45.370 45.100 -0.156 0.000 0.916 188 G HN -0.511 7.700 8.290 -0.131 0.000 0.550 189 I N -3.866 116.641 120.570 -0.105 0.000 2.882 189 I HA -0.040 4.040 4.170 -0.150 0.000 0.286 189 I C -1.956 174.082 176.117 -0.131 0.000 1.139 189 I CA 0.311 61.542 61.300 -0.116 0.000 1.379 189 I CB 1.467 39.425 38.000 -0.070 0.000 1.410 189 I HN 0.144 8.301 8.210 -0.089 0.000 0.594 190 D N 2.089 122.402 120.400 -0.145 0.000 4.449 190 D HA 0.142 4.645 4.640 -0.228 0.000 0.298 190 D C -2.315 173.883 176.300 -0.171 0.000 1.684 190 D CA -0.413 53.487 54.000 -0.168 0.000 0.981 190 D CB 2.737 43.493 40.800 -0.074 0.000 1.459 190 D HN -0.117 8.165 8.370 -0.147 0.000 0.673 191 Y N -4.131 116.007 120.300 -0.270 0.000 4.095 191 Y HA -0.344 4.127 4.550 -0.132 0.000 0.240 191 Y C -2.661 173.080 175.900 -0.264 0.000 1.276 191 Y CA 0.503 58.461 58.100 -0.236 0.000 2.014 191 Y CB -1.887 36.416 38.460 -0.261 0.000 1.616 191 Y HN 0.227 8.449 8.280 -0.097 0.000 0.703 192 Y N -3.727 116.508 120.300 -0.108 0.000 3.106 192 Y HA -0.022 4.435 4.550 -0.155 0.000 0.438 192 Y C 1.083 176.853 175.900 -0.217 0.000 1.222 192 Y CA -0.695 57.326 58.100 -0.132 0.000 1.563 192 Y CB 0.975 39.439 38.460 0.007 0.000 1.450 192 Y HN -0.676 7.536 8.280 -0.113 0.000 0.842 193 T N -5.047 109.572 114.554 0.109 0.000 14.161 193 T HA -0.262 4.115 4.350 0.045 0.000 0.419 193 T C -2.480 172.192 174.700 -0.047 0.000 1.441 193 T CA 0.481 62.579 62.100 -0.002 0.000 2.332 193 T CB -3.218 65.618 68.868 -0.053 0.000 2.758 193 T HN 0.060 8.453 8.240 0.254 0.000 0.253 194 P HA -0.214 3.684 4.420 -0.869 0.000 0.255 194 P C -1.353 175.862 177.300 -0.143 0.000 1.161 194 P CA 1.020 63.794 63.100 -0.544 0.000 0.768 194 P CB -0.154 31.067 31.700 -0.798 0.000 0.746 195 H N 4.698 123.856 119.070 0.148 0.000 2.488 195 H HA 0.287 5.061 4.556 0.080 -0.170 0.237 195 H C 0.833 176.245 175.328 0.140 0.000 1.395 195 H CA -0.852 55.262 56.048 0.111 0.000 1.491 195 H CB -0.093 29.727 29.762 0.096 0.000 1.567 195 H HN 0.117 8.588 8.280 0.319 0.000 0.508 196 E N 2.198 122.537 120.200 0.232 0.000 2.267 196 E HA -0.415 4.124 4.350 0.314 0.000 0.197 196 E C -0.047 176.677 176.600 0.207 0.000 0.998 196 E CA 3.649 60.191 56.400 0.236 0.000 0.830 196 E CB 0.041 29.862 29.700 0.202 0.000 0.751 196 E HN -0.023 8.443 8.360 0.176 0.000 0.491 197 E N -3.770 116.529 120.200 0.165 0.000 2.011 197 E HA -0.171 4.234 4.350 0.092 0.000 0.191 197 E C 2.175 178.838 176.600 0.105 0.000 0.980 197 E CA 1.909 58.375 56.400 0.110 0.000 0.814 197 E CB -0.626 29.119 29.700 0.076 0.000 0.775 197 E HN -0.064 8.359 8.360 0.195 0.055 0.454 198 T N -3.905 110.696 114.554 0.078 0.000 3.007 198 T HA -0.156 4.161 4.350 -0.054 0.000 0.270 198 T C 1.253 175.960 174.700 0.013 0.000 1.107 198 T CA 1.936 64.008 62.100 -0.046 0.000 1.118 198 T CB -0.363 68.277 68.868 -0.380 0.000 0.889 198 T HN 0.205 8.536 8.240 0.152 0.000 0.506 199 N N 2.069 120.836 118.700 0.111 0.000 2.806 199 N HA 0.249 5.025 4.740 0.059 0.000 0.315 199 N C -0.255 175.367 175.510 0.185 0.000 1.738 199 N CA -0.896 52.226 53.050 0.120 0.000 0.993 199 N CB 0.683 39.259 38.487 0.149 0.000 1.324 199 N HN -0.180 8.311 8.380 0.185 0.000 0.493 200 N N -0.879 117.918 118.700 0.162 0.000 2.512 200 N HA -0.197 4.804 4.740 0.243 -0.115 0.183 200 N C 0.386 176.018 175.510 0.204 0.000 1.073 200 N CA 1.218 54.386 53.050 0.197 0.000 0.911 200 N CB 0.388 38.984 38.487 0.182 0.000 0.964 200 N HN -0.240 8.150 8.380 0.120 0.062 0.447 201 E N 1.171 121.447 120.200 0.126 0.000 2.702 201 E HA -0.277 4.212 4.350 0.233 0.000 0.362 201 E C 0.723 177.264 176.600 -0.099 0.000 0.828 201 E CA 2.180 58.583 56.400 0.003 0.000 2.126 201 E CB 0.210 29.817 29.700 -0.155 0.000 0.917 201 E HN -0.113 8.246 8.360 0.090 0.055 0.571 202 S N 1.569 117.081 115.700 -0.313 0.000 2.700 202 S HA -0.013 4.322 4.470 -0.225 0.000 0.321 202 S C -1.243 173.495 174.600 0.230 0.000 1.161 202 S CA 1.618 59.709 58.200 -0.181 0.000 1.078 202 S CB -0.782 62.264 63.200 -0.256 0.000 1.302 202 S HN -0.342 8.013 8.310 -0.298 -0.224 0.540 203 F N 4.063 124.119 119.950 0.176 0.000 4.691 203 F HA 0.079 4.762 4.527 0.260 0.000 0.326 203 F C -1.818 174.152 175.800 0.284 0.000 0.930 203 F CA 0.044 58.184 58.000 0.234 0.000 0.817 203 F CB 1.486 40.599 39.000 0.189 0.000 2.040 203 F HN -0.209 8.305 8.300 0.428 0.042 0.449 204 V N -1.392 118.673 119.914 0.250 0.000 2.999 204 V HA 0.139 4.404 4.120 0.241 0.000 0.307 204 V C 0.554 176.817 176.094 0.282 0.000 1.084 204 V CA -0.340 62.060 62.300 0.167 0.000 1.155 204 V CB 0.117 31.925 31.823 -0.024 0.000 0.975 204 V HN -0.138 7.940 8.190 -0.187 0.000 0.490 205 I N -2.563 118.173 120.570 0.277 0.000 3.793 205 I HA 0.112 4.398 4.170 0.194 0.000 0.315 205 I C 0.811 177.094 176.117 0.276 0.000 1.275 205 I CA 0.390 61.817 61.300 0.212 0.000 1.214 205 I CB -0.442 37.608 38.000 0.082 0.000 1.018 205 I HN -0.181 8.191 8.210 0.269 0.000 0.439 206 Y N 2.880 123.293 120.300 0.189 0.000 2.241 206 Y HA -0.445 4.187 4.550 0.136 0.000 0.286 206 Y C 1.175 177.202 175.900 0.212 0.000 1.166 206 Y CA 4.109 62.316 58.100 0.179 0.000 1.203 206 Y CB -0.445 38.127 38.460 0.186 0.000 0.977 206 Y HN -0.920 7.532 8.280 0.492 0.124 0.529 207 M N -4.359 115.443 119.600 0.337 0.000 2.267 207 M HA -0.314 4.402 4.480 0.393 0.000 0.263 207 M C 1.344 177.740 176.300 0.160 0.000 1.063 207 M CA 1.333 56.811 55.300 0.297 0.000 1.090 207 M CB -0.748 32.044 32.600 0.319 0.000 1.392 207 M HN -0.737 7.767 8.290 0.402 0.027 0.422 208 F N -3.026 116.879 119.950 -0.075 0.000 2.274 208 F HA -0.024 4.450 4.527 -0.087 0.000 0.288 208 F C 0.727 176.496 175.800 -0.052 0.000 1.069 208 F CA 1.101 59.047 58.000 -0.091 0.000 1.343 208 F CB 1.945 40.864 39.000 -0.136 0.000 1.089 208 F HN -0.538 7.876 8.300 0.236 0.028 0.517 209 V N -0.203 119.677 119.914 -0.058 0.000 0.686 209 V HA -0.580 3.498 4.120 -0.070 0.000 0.092 209 V C -0.165 175.639 176.094 -0.484 0.000 0.859 209 V CA 2.886 65.032 62.300 -0.256 0.000 3.114 209 V CB -0.694 30.806 31.823 -0.540 0.000 0.237 209 V HN -0.392 7.898 8.190 0.166 0.000 0.175 210 V N -6.768 112.817 119.914 -0.549 0.000 3.398 210 V HA 0.422 3.960 4.120 -0.970 0.000 0.298 210 V C 1.195 176.994 176.094 -0.491 0.000 1.496 210 V CA -0.274 61.645 62.300 -0.635 0.000 1.044 210 V CB 0.463 32.099 31.823 -0.311 0.000 0.880 210 V HN -0.162 7.759 8.190 -0.448 0.000 0.443 211 H N 5.119 123.892 119.070 -0.494 0.000 2.261 211 H HA -0.356 4.028 4.556 -0.286 0.000 0.290 211 H C 0.484 175.654 175.328 -0.264 0.000 1.081 211 H CA 3.256 59.112 56.048 -0.319 0.000 1.196 211 H CB 0.215 29.839 29.762 -0.230 0.000 1.350 211 H HN 0.458 8.388 8.280 -0.398 0.112 0.498 212 F N -0.685 118.891 119.950 -0.624 0.000 2.859 212 F HA 0.058 4.253 4.527 -0.554 0.000 0.315 212 F C -0.422 175.234 175.800 -0.240 0.000 1.207 212 F CA -0.169 57.561 58.000 -0.450 0.000 1.370 212 F CB -0.788 38.084 39.000 -0.213 0.000 1.314 212 F HN -0.572 7.545 8.300 -0.305 0.000 0.555 213 I N 0.260 120.680 120.570 -0.249 0.000 3.860 213 I HA -0.124 4.078 4.170 0.054 0.000 0.319 213 I C 1.638 177.682 176.117 -0.121 0.000 1.279 213 I CA -0.960 60.275 61.300 -0.108 0.000 1.220 213 I CB -0.563 37.345 38.000 -0.155 0.000 1.027 213 I HN -0.277 7.495 8.210 -0.366 0.219 0.428 214 I N -0.052 120.349 120.570 -0.282 0.000 2.130 214 I HA -0.395 3.617 4.170 -0.263 0.000 0.241 214 I C -1.374 174.616 176.117 -0.212 0.000 1.023 214 I CA 5.597 66.697 61.300 -0.333 0.000 1.293 214 I CB -3.523 34.136 38.000 -0.568 0.000 1.001 214 I HN -0.559 7.354 8.210 -0.415 0.048 0.407 215 P HA 0.024 4.420 4.420 -0.101 -0.037 0.245 215 P C 0.505 177.887 177.300 0.137 0.000 1.212 215 P CA 1.318 64.426 63.100 0.013 0.000 0.774 215 P CB -0.466 31.370 31.700 0.227 0.000 0.999 216 L N -0.939 120.352 121.223 0.113 0.000 2.062 216 L HA -0.227 4.229 4.340 0.193 0.000 0.202 216 L C 1.791 178.757 176.870 0.160 0.000 1.079 216 L CA 2.959 57.886 54.840 0.146 0.000 0.755 216 L CB 0.032 42.157 42.059 0.110 0.000 0.913 216 L HN -0.219 7.876 8.230 0.059 0.171 0.445 217 I N -2.924 117.681 120.570 0.058 0.000 2.202 217 I HA -0.424 3.823 4.170 0.129 0.000 0.242 217 I C 1.229 177.367 176.117 0.034 0.000 1.091 217 I CA 2.993 64.329 61.300 0.059 0.000 1.368 217 I CB 1.037 39.032 38.000 -0.008 0.000 1.058 217 I HN -0.521 7.688 8.210 -0.003 0.000 0.410 218 V N -9.416 110.362 119.914 -0.227 0.000 3.161 218 V HA 0.212 3.694 4.120 -1.063 0.000 0.228 218 V C -0.234 175.299 176.094 -0.934 0.000 1.415 218 V CA 0.130 62.020 62.300 -0.684 0.000 1.285 218 V CB 2.350 33.925 31.823 -0.412 0.000 1.100 218 V HN -0.673 7.408 8.190 -0.181 0.000 0.478 219 I N 0.118 120.411 120.570 -0.463 0.000 2.638 219 I HA -0.015 3.883 4.170 -0.455 0.000 0.286 219 I C 0.611 176.616 176.117 -0.186 0.000 1.088 219 I CA -0.167 60.903 61.300 -0.383 0.000 1.397 219 I CB -0.787 36.995 38.000 -0.364 0.000 1.414 219 I HN -0.368 7.646 8.210 -0.327 0.000 0.566 220 F N 5.881 125.677 119.950 -0.257 0.000 2.473 220 F HA -0.220 4.114 4.527 -0.322 0.000 0.294 220 F C 1.117 176.896 175.800 -0.035 0.000 1.103 220 F CA 2.455 60.318 58.000 -0.230 0.000 1.442 220 F CB 1.130 39.972 39.000 -0.264 0.000 1.097 220 F HN 0.403 8.836 8.300 0.220 0.000 0.547 221 F N -1.616 118.428 119.950 0.156 0.000 2.154 221 F HA -0.292 4.446 4.527 0.194 -0.095 0.301 221 F C 1.031 176.884 175.800 0.087 0.000 1.087 221 F CA 1.082 59.163 58.000 0.134 0.000 1.274 221 F CB -1.576 37.489 39.000 0.108 0.000 1.009 221 F HN -0.413 8.037 8.300 0.314 0.038 0.485 222 C N -2.920 116.171 119.300 -0.348 0.000 2.496 222 C HA -0.305 4.144 4.460 -0.017 0.000 0.294 222 C C 0.831 175.781 174.990 -0.066 0.000 1.490 222 C CA 1.256 60.121 59.018 -0.255 0.000 1.672 222 C CB -1.217 26.209 27.740 -0.524 0.000 1.580 222 C HN -0.041 7.641 8.230 -0.869 0.026 0.598 223 Y N 2.611 122.867 120.300 -0.073 0.000 2.511 223 Y HA -0.008 4.485 4.550 -0.095 0.000 0.279 223 Y C 1.279 177.164 175.900 -0.025 0.000 1.157 223 Y CA 0.814 58.863 58.100 -0.084 0.000 1.300 223 Y CB 0.750 39.123 38.460 -0.143 0.000 1.052 223 Y HN -0.545 7.674 8.280 0.116 0.131 0.529 224 G N -1.266 107.653 108.800 0.198 0.000 3.444 224 G HA2 -0.581 3.466 3.960 0.146 0.000 0.222 224 G HA3 -0.581 3.441 3.960 0.104 0.000 0.222 224 G C 1.264 176.244 174.900 0.133 0.000 1.358 224 G CA 1.552 46.737 45.100 0.142 0.000 0.880 224 G HN -0.208 8.169 8.290 0.215 0.042 0.555 225 Q N 3.349 123.205 119.800 0.093 0.000 2.311 225 Q HA -0.001 4.385 4.340 0.077 0.000 0.203 225 Q C 1.189 177.276 176.000 0.144 0.000 0.954 225 Q CA 1.923 57.765 55.803 0.065 0.000 0.885 225 Q CB -0.194 28.505 28.738 -0.065 0.000 0.963 225 Q HN -0.307 7.962 8.270 0.069 0.042 0.471 226 L N -3.375 117.951 121.223 0.172 0.000 2.612 226 L HA 0.109 4.568 4.340 0.199 0.000 0.230 226 L C -0.257 176.785 176.870 0.286 0.000 1.140 226 L CA 0.357 55.340 54.840 0.238 0.000 0.896 226 L CB -0.972 41.277 42.059 0.317 0.000 1.065 226 L HN 0.028 8.347 8.230 0.193 0.026 0.447 227 V N -1.271 118.803 119.914 0.266 0.000 2.955 227 V HA 0.066 4.298 4.120 0.186 0.000 0.379 227 V C -0.778 175.488 176.094 0.287 0.000 1.288 227 V CA 0.157 62.594 62.300 0.228 0.000 1.358 227 V CB -1.437 30.512 31.823 0.210 0.000 1.406 227 V HN -0.690 7.455 8.190 0.246 0.192 0.569 228 F N -1.508 118.475 119.950 0.055 0.000 2.420 228 F HA 0.015 4.694 4.527 0.022 -0.139 0.353 228 F C -2.291 173.523 175.800 0.023 0.000 1.306 228 F CA 0.097 58.113 58.000 0.028 0.000 0.991 228 F CB 1.145 40.156 39.000 0.018 0.000 1.563 228 F HN -0.791 7.553 8.300 0.233 0.096 0.481 229 T N -0.647 113.903 114.554 -0.007 0.000 2.893 229 T HA 0.368 4.651 4.350 -0.112 0.000 0.337 229 T C -0.831 173.859 174.700 -0.016 0.000 1.587 229 T CA -0.482 61.599 62.100 -0.032 0.000 1.066 229 T CB 2.612 71.509 68.868 0.049 0.000 1.414 229 T HN -0.817 7.557 8.240 0.039 -0.110 0.488 230 V N -0.503 119.385 119.914 -0.043 0.000 0.586 230 V HA -0.607 3.480 4.120 -0.056 0.000 0.092 230 V C -0.011 176.056 176.094 -0.045 0.000 1.846 230 V CA 3.447 65.723 62.300 -0.038 0.000 3.407 230 V CB -1.632 30.186 31.823 -0.010 0.000 0.695 230 V HN 0.608 8.760 8.190 -0.064 0.000 0.719 231 K N 0.663 121.051 120.400 -0.021 0.000 2.152 231 K HA -0.283 4.020 4.320 -0.029 0.000 0.206 231 K C 0.546 177.103 176.600 -0.070 0.000 1.048 231 K CA 1.761 58.029 56.287 -0.032 0.000 0.933 231 K CB 0.115 32.609 32.500 -0.011 0.000 0.721 231 K HN -0.014 8.207 8.250 0.015 0.039 0.447 232 E N 0.322 120.452 120.200 -0.118 0.000 2.105 232 E HA -0.014 4.247 4.350 -0.148 0.000 0.285 232 E C -0.897 175.589 176.600 -0.190 0.000 1.055 232 E CA -1.153 55.128 56.400 -0.197 0.000 0.843 232 E CB -0.625 28.815 29.700 -0.433 0.000 1.067 232 E HN -0.759 7.526 8.360 -0.102 0.014 0.398 233 A N 4.622 127.362 122.820 -0.133 0.000 2.225 233 A HA -0.230 4.024 4.320 -0.109 0.000 0.215 233 A C 0.915 178.414 177.584 -0.142 0.000 1.164 233 A CA 1.651 53.619 52.037 -0.115 0.000 0.710 233 A CB 0.039 18.993 19.000 -0.077 0.000 0.780 233 A HN 0.570 8.656 8.150 -0.107 0.000 0.473 234 A N -1.240 121.452 122.820 -0.214 0.000 2.081 234 A HA -0.109 4.113 4.320 -0.163 0.000 0.213 234 A C -1.218 176.165 177.584 -0.334 0.000 1.374 234 A CA 0.622 52.489 52.037 -0.283 0.000 1.203 234 A CB -1.789 16.970 19.000 -0.402 0.000 0.786 234 A HN 0.336 8.345 8.150 -0.230 0.003 0.535 235 A N -4.753 117.939 122.820 -0.213 0.000 2.586 235 A HA 0.065 4.355 4.320 -0.114 -0.038 0.291 235 A C -0.763 176.766 177.584 -0.092 0.000 1.062 235 A CA -0.155 51.791 52.037 -0.151 0.000 0.666 235 A CB 1.435 20.326 19.000 -0.182 0.000 1.281 235 A HN -0.551 7.383 8.150 -0.165 0.116 0.421 236 Q N -4.191 115.574 119.800 -0.058 0.000 2.755 236 Q HA -0.560 3.997 4.340 -0.029 -0.235 0.190 236 Q C 1.706 177.684 176.000 -0.037 0.000 2.840 236 Q CA 2.835 58.613 55.803 -0.042 0.000 0.265 236 Q CB -2.050 26.657 28.738 -0.052 0.000 0.240 236 Q HN 0.446 9.026 8.270 -0.043 -0.336 0.447 237 Q N -0.500 119.273 119.800 -0.045 0.000 1.703 237 Q HA -0.450 3.869 4.340 -0.035 0.000 0.380 237 Q C 1.929 177.912 176.000 -0.027 0.000 1.022 237 Q CA 2.670 58.450 55.803 -0.038 0.000 0.888 237 Q CB -0.745 27.966 28.738 -0.045 0.000 0.960 237 Q HN -0.091 8.069 8.270 -0.055 0.078 0.404 238 Q N -1.918 117.866 119.800 -0.027 0.000 2.152 238 Q HA -0.316 4.018 4.340 -0.010 0.000 0.206 238 Q C 0.459 176.457 176.000 -0.005 0.000 0.985 238 Q CA 2.586 58.381 55.803 -0.013 0.000 0.863 238 Q CB -0.712 28.019 28.738 -0.013 0.000 0.904 238 Q HN 0.604 8.853 8.270 -0.035 0.000 0.422 239 E N -2.638 117.557 120.200 -0.008 0.000 2.561 239 E HA 0.085 4.488 4.350 0.014 -0.044 0.225 239 E C -1.476 175.126 176.600 0.003 0.000 1.035 239 E CA -0.760 55.643 56.400 0.006 0.000 0.904 239 E CB -1.696 28.014 29.700 0.017 0.000 1.291 239 E HN -0.197 8.151 8.360 -0.021 -0.001 0.444 240 S N 0.381 116.084 115.700 0.005 0.000 2.709 240 S HA -0.046 4.433 4.470 0.015 0.000 0.121 240 S C 0.003 174.600 174.600 -0.005 0.000 0.686 240 S CA 0.658 58.859 58.200 0.002 0.000 1.635 240 S CB 0.029 63.223 63.200 -0.010 0.000 0.964 240 S HN -0.151 8.201 8.310 0.007 -0.038 0.538 241 A N 3.002 125.818 122.820 -0.007 0.000 1.972 241 A HA -0.161 4.149 4.320 -0.017 0.000 0.219 241 A C -0.285 177.304 177.584 0.007 0.000 1.169 241 A CA 2.899 54.932 52.037 -0.007 0.000 0.635 241 A CB 0.337 19.333 19.000 -0.007 0.000 0.810 241 A HN -0.084 8.060 8.150 -0.010 0.000 0.446 242 T N -4.731 109.834 114.554 0.018 0.000 5.378 242 T HA 0.016 4.394 4.350 0.047 0.000 0.275 242 T C -2.185 172.536 174.700 0.034 0.000 0.919 242 T CA 0.149 62.269 62.100 0.033 0.000 0.507 242 T CB -0.474 68.412 68.868 0.030 0.000 0.520 242 T HN -0.633 7.674 8.240 0.015 -0.058 0.234 243 T N 3.834 118.407 114.554 0.032 0.000 3.032 243 T HA 0.306 4.679 4.350 0.038 0.000 0.312 243 T C -1.745 172.979 174.700 0.039 0.000 1.078 243 T CA -0.069 62.052 62.100 0.035 0.000 1.028 243 T CB 2.548 71.434 68.868 0.030 0.000 1.091 243 T HN -0.479 7.859 8.240 0.029 -0.080 0.457 244 Q N 2.051 121.877 119.800 0.043 0.000 5.585 244 Q HA -0.435 3.931 4.340 0.042 0.000 0.279 244 Q C -1.771 174.261 176.000 0.052 0.000 2.184 244 Q CA 2.624 58.455 55.803 0.046 0.000 0.437 244 Q CB -0.369 28.398 28.738 0.048 0.000 0.260 244 Q HN 0.517 8.812 8.270 0.041 0.000 0.712 245 K N -2.358 118.075 120.400 0.056 0.000 2.197 245 K HA 0.259 4.620 4.320 0.068 0.000 0.247 245 K C -1.287 175.359 176.600 0.076 0.000 1.077 245 K CA -1.886 54.441 56.287 0.068 0.000 0.882 245 K CB 2.180 34.723 32.500 0.071 0.000 1.396 245 K HN -0.629 7.508 8.250 0.051 0.143 0.482 246 A N 0.035 122.909 122.820 0.090 0.000 2.520 246 A HA -0.114 4.291 4.320 0.141 0.000 0.235 246 A C 0.275 177.899 177.584 0.067 0.000 1.065 246 A CA 0.450 52.551 52.037 0.106 0.000 0.764 246 A CB 0.392 19.458 19.000 0.109 0.000 1.002 246 A HN 0.349 8.553 8.150 0.091 0.000 0.502 247 E N 3.811 124.042 120.200 0.052 0.000 3.400 247 E HA -0.166 4.303 4.350 0.022 -0.106 0.525 247 E C 1.928 178.508 176.600 -0.035 0.000 0.243 247 E CA 0.380 56.783 56.400 0.006 0.000 3.036 247 E CB -0.482 29.218 29.700 0.000 0.000 2.308 247 E HN 0.210 8.621 8.360 0.084 0.000 0.376 248 K N 1.314 121.668 120.400 -0.078 0.000 2.207 248 K HA -0.420 3.861 4.320 -0.065 0.000 0.208 248 K C 1.950 178.495 176.600 -0.092 0.000 1.046 248 K CA 3.662 59.899 56.287 -0.084 0.000 0.929 248 K CB -0.349 32.083 32.500 -0.113 0.000 0.720 248 K HN 0.441 8.631 8.250 -0.101 0.000 0.463 249 E N -3.267 116.873 120.200 -0.100 0.000 2.122 249 E HA -0.136 4.099 4.350 -0.192 0.000 0.190 249 E C 2.171 178.733 176.600 -0.064 0.000 0.977 249 E CA 2.873 59.194 56.400 -0.133 0.000 0.820 249 E CB -0.567 29.040 29.700 -0.155 0.000 0.770 249 E HN -0.091 8.174 8.360 -0.085 0.044 0.462 250 V N -5.882 114.021 119.914 -0.019 0.000 2.867 250 V HA -0.217 3.915 4.120 0.021 0.000 0.260 250 V C 1.613 177.694 176.094 -0.021 0.000 1.099 250 V CA 2.745 65.048 62.300 0.004 0.000 1.122 250 V CB -1.836 30.006 31.823 0.033 0.000 0.708 250 V HN 0.023 8.121 8.190 -0.015 0.083 0.490 251 T N 2.923 117.455 114.554 -0.037 0.000 2.777 251 T HA -0.173 4.359 4.350 -0.034 -0.202 0.266 251 T C 2.170 176.839 174.700 -0.053 0.000 1.040 251 T CA 3.590 65.665 62.100 -0.042 0.000 1.141 251 T CB -0.571 68.272 68.868 -0.042 0.000 0.868 251 T HN -0.035 7.985 8.240 -0.039 0.196 0.444 252 R N 1.062 121.521 120.500 -0.069 0.000 2.200 252 R HA -0.268 4.031 4.340 -0.067 0.000 0.234 252 R C 1.967 178.223 176.300 -0.074 0.000 1.127 252 R CA 2.880 58.933 56.100 -0.078 0.000 0.989 252 R CB -0.328 29.901 30.300 -0.117 0.000 0.869 252 R HN -0.487 7.692 8.270 -0.078 0.044 0.459 253 M N -0.557 119.001 119.600 -0.068 0.000 2.686 253 M HA -0.058 4.513 4.480 -0.097 -0.149 0.216 253 M C 0.557 176.804 176.300 -0.089 0.000 1.221 253 M CA 1.008 56.257 55.300 -0.087 0.000 0.992 253 M CB -0.828 31.716 32.600 -0.093 0.000 1.739 253 M HN -0.486 7.755 8.290 -0.057 0.015 0.461 254 V N 0.843 120.714 119.914 -0.072 0.000 2.913 254 V HA -0.271 3.810 4.120 -0.066 0.000 0.260 254 V C -0.115 175.935 176.094 -0.074 0.000 1.098 254 V CA 2.527 64.787 62.300 -0.068 0.000 1.121 254 V CB 0.312 32.100 31.823 -0.058 0.000 0.714 254 V HN 0.245 8.316 8.190 -0.065 0.079 0.487 255 I N -2.910 117.609 120.570 -0.086 0.000 5.007 255 I HA 0.066 4.181 4.170 -0.091 0.000 0.323 255 I C 1.002 177.050 176.117 -0.114 0.000 1.195 255 I CA 0.943 62.189 61.300 -0.090 0.000 1.407 255 I CB 2.408 40.369 38.000 -0.065 0.000 1.544 255 I HN -0.232 7.764 8.210 -0.083 0.164 0.505 256 I N 1.835 122.344 120.570 -0.102 0.000 2.399 256 I HA -0.485 3.631 4.170 -0.090 0.000 0.254 256 I C 2.057 178.072 176.117 -0.169 0.000 1.146 256 I CA 2.869 64.109 61.300 -0.100 0.000 1.412 256 I CB -1.677 36.291 38.000 -0.054 0.000 1.076 256 I HN -0.277 7.881 8.210 -0.087 0.000 0.432 257 M N 1.257 120.725 119.600 -0.219 0.000 2.151 257 M HA -0.483 3.783 4.480 -0.358 0.000 0.256 257 M C 1.261 177.180 176.300 -0.635 0.000 1.072 257 M CA 3.240 58.334 55.300 -0.342 0.000 1.090 257 M CB -0.488 31.964 32.600 -0.247 0.000 1.294 257 M HN -0.140 8.089 8.290 -0.173 -0.043 0.415 258 V N -2.933 116.635 119.914 -0.577 0.000 3.041 258 V HA -0.234 2.839 4.120 -1.745 0.000 0.260 258 V C 2.072 177.682 176.094 -0.806 0.000 1.105 258 V CA 3.025 64.774 62.300 -0.918 0.000 1.125 258 V CB -0.766 30.828 31.823 -0.383 0.000 0.730 258 V HN -0.576 7.401 8.190 -0.356 0.000 0.479 259 I N -1.290 119.025 120.570 -0.424 0.000 3.680 259 I HA -0.143 3.909 4.170 -0.196 0.000 0.306 259 I C -0.201 175.834 176.117 -0.138 0.000 1.260 259 I CA 0.730 61.900 61.300 -0.217 0.000 1.201 259 I CB -1.224 36.707 38.000 -0.115 0.000 1.009 259 I HN -0.254 7.534 8.210 -0.378 0.195 0.467 260 A N -0.372 122.297 122.820 -0.251 0.000 2.014 260 A HA 0.126 4.534 4.320 0.146 0.000 0.210 260 A C 0.272 177.957 177.584 0.167 0.000 1.188 260 A CA 1.577 53.631 52.037 0.029 0.000 0.731 260 A CB 1.120 20.182 19.000 0.104 0.000 0.858 260 A HN -0.472 7.160 8.150 -0.626 0.142 0.464 261 F N -7.201 112.808 119.950 0.098 0.000 2.729 261 F HA 0.244 4.914 4.527 0.239 0.000 0.315 261 F C -0.573 175.359 175.800 0.219 0.000 1.102 261 F CA -1.426 56.685 58.000 0.186 0.000 1.204 261 F CB 1.303 40.392 39.000 0.148 0.000 1.052 261 F HN -0.831 7.144 8.300 -0.542 0.000 0.551 262 L N -3.327 118.028 121.223 0.220 0.000 3.289 262 L HA 0.323 4.802 4.340 0.232 0.000 0.291 262 L C -0.906 176.015 176.870 0.084 0.000 1.279 262 L CA -0.670 54.284 54.840 0.190 0.000 1.025 262 L CB -0.219 41.968 42.059 0.213 0.000 1.413 262 L HN -0.809 7.431 8.230 0.018 0.000 0.593 263 I N -1.184 119.447 120.570 0.102 0.000 2.428 263 I HA 0.166 4.380 4.170 0.074 0.000 0.296 263 I C 1.076 177.286 176.117 0.155 0.000 0.985 263 I CA -0.466 60.894 61.300 0.099 0.000 1.260 263 I CB 1.290 39.343 38.000 0.088 0.000 1.389 263 I HN -0.525 7.689 8.210 0.157 0.090 0.484 264 C N 5.671 125.080 119.300 0.182 0.000 5.885 264 C HA -0.511 4.167 4.460 0.363 0.000 0.328 264 C C 0.823 176.014 174.990 0.335 0.000 2.433 264 C CA 3.423 62.616 59.018 0.291 0.000 2.197 264 C CB -1.404 26.478 27.740 0.238 0.000 3.236 264 C HN 0.494 8.817 8.230 0.154 0.000 0.260 265 W N 0.441 121.739 121.300 -0.004 0.000 2.333 265 W HA -0.415 4.225 4.660 -0.033 0.000 0.316 265 W C 2.161 178.517 176.519 -0.271 0.000 1.215 265 W CA 2.469 59.738 57.345 -0.127 0.000 1.278 265 W CB 0.134 29.502 29.460 -0.153 0.000 1.154 265 W HN -0.344 8.037 8.180 0.360 0.014 0.486 266 L N -0.346 120.548 121.223 -0.548 0.000 1.965 266 L HA -0.321 3.303 4.340 -1.192 0.000 0.226 266 L C -0.842 175.771 176.870 -0.428 0.000 1.083 266 L CA 4.931 59.390 54.840 -0.636 0.000 0.790 266 L CB -2.161 39.809 42.059 -0.149 0.000 0.898 266 L HN -0.545 7.526 8.230 -0.265 0.000 0.439 267 P HA -0.080 3.974 4.420 -0.610 0.000 0.242 267 P C 0.905 178.002 177.300 -0.338 0.000 1.197 267 P CA 1.393 64.267 63.100 -0.376 0.000 0.765 267 P CB -0.817 30.733 31.700 -0.250 0.000 0.936 268 Y N 0.895 120.990 120.300 -0.342 0.000 2.457 268 Y HA -0.342 4.163 4.550 -0.076 0.000 0.292 268 Y C 0.358 176.163 175.900 -0.158 0.000 1.125 268 Y CA 3.205 61.198 58.100 -0.178 0.000 1.254 268 Y CB -0.105 38.338 38.460 -0.029 0.000 1.012 268 Y HN -0.429 7.559 8.280 -0.169 0.190 0.555 269 A N -1.267 121.443 122.820 -0.183 0.000 1.948 269 A HA -0.419 3.926 4.320 0.042 0.000 0.220 269 A C 1.969 179.540 177.584 -0.022 0.000 1.177 269 A CA 3.056 55.058 52.037 -0.058 0.000 0.636 269 A CB -1.028 17.984 19.000 0.021 0.000 0.815 269 A HN -0.224 7.668 8.150 -0.334 0.058 0.449 270 G N -4.826 103.881 108.800 -0.155 0.000 2.534 270 G HA2 -0.177 3.751 3.960 -0.053 0.000 0.217 270 G HA3 -0.177 3.675 3.960 -0.180 0.000 0.217 270 G C 1.037 175.993 174.900 0.094 0.000 1.128 270 G CA 1.259 46.323 45.100 -0.059 0.000 0.784 270 G HN -0.488 7.601 8.290 -0.286 0.029 0.542 271 V N 1.992 121.881 119.914 -0.042 0.000 2.446 271 V HA -0.264 3.866 4.120 0.017 0.000 0.244 271 V C 1.368 177.512 176.094 0.082 0.000 1.039 271 V CA 2.204 64.474 62.300 -0.050 0.000 1.045 271 V CB -0.667 30.892 31.823 -0.440 0.000 0.681 271 V HN -0.233 7.667 8.190 -0.095 0.232 0.459 272 A N -0.908 121.991 122.820 0.132 0.000 1.898 272 A HA -0.319 4.103 4.320 0.170 0.000 0.216 272 A C 1.334 178.973 177.584 0.091 0.000 1.181 272 A CA 2.805 54.938 52.037 0.159 0.000 0.620 272 A CB -0.371 18.752 19.000 0.205 0.000 0.819 272 A HN -0.353 7.879 8.150 0.137 0.000 0.442 273 F N -0.756 119.180 119.950 -0.023 0.000 2.045 273 F HA -0.404 4.076 4.527 -0.078 0.000 0.297 273 F C -0.116 175.685 175.800 0.002 0.000 1.114 273 F CA 3.337 61.323 58.000 -0.023 0.000 1.207 273 F CB 0.414 39.429 39.000 0.025 0.000 0.964 273 F HN -0.635 7.827 8.300 0.270 0.000 0.486 274 Y N -0.339 119.810 120.300 -0.250 0.000 2.646 274 Y HA 0.095 4.366 4.550 -0.465 0.000 0.334 274 Y C -2.070 173.753 175.900 -0.128 0.000 1.004 274 Y CA -0.127 57.748 58.100 -0.376 0.000 1.301 274 Y CB 1.239 39.442 38.460 -0.429 0.000 1.093 274 Y HN -0.939 7.473 8.280 0.220 0.000 0.530 275 I N 4.425 124.845 120.570 -0.249 0.000 2.908 275 I HA 0.334 4.417 4.170 -0.476 -0.198 0.300 275 I C -2.700 173.366 176.117 -0.084 0.000 1.385 275 I CA -0.705 60.303 61.300 -0.487 0.000 1.004 275 I CB 4.167 41.473 38.000 -1.155 0.000 1.309 275 I HN -0.346 7.842 8.210 -0.036 0.000 0.449 276 F N 4.725 124.472 119.950 -0.338 0.000 2.598 276 F HA 0.256 4.677 4.527 -0.177 0.000 0.397 276 F C -2.515 173.118 175.800 -0.279 0.000 1.402 276 F CA 0.375 58.254 58.000 -0.201 0.000 1.072 276 F CB 1.849 40.828 39.000 -0.035 0.000 2.048 276 F HN -0.178 7.940 8.300 -0.304 0.000 0.492 277 T N -1.982 112.247 114.554 -0.542 0.000 3.159 277 T HA 0.250 4.373 4.350 -0.378 0.000 0.343 277 T C -1.478 172.708 174.700 -0.857 0.000 1.364 277 T CA -1.177 60.563 62.100 -0.601 0.000 1.102 277 T CB 2.092 70.523 68.868 -0.729 0.000 1.263 277 T HN -0.633 7.235 8.240 -0.620 0.000 0.477 278 H N 3.416 122.392 119.070 -0.155 0.000 2.523 278 H HA -0.421 4.128 4.556 -0.011 0.000 0.303 278 H C -0.761 174.487 175.328 -0.134 0.000 1.605 278 H CA 1.711 57.704 56.048 -0.092 0.000 1.344 278 H CB -0.745 28.972 29.762 -0.075 0.000 1.446 278 H HN 0.032 8.349 8.280 -0.145 -0.125 0.738 279 Q N -0.436 119.441 119.800 0.128 0.000 7.948 279 Q HA -0.126 4.281 4.340 0.111 0.000 0.369 279 Q C -1.657 174.380 176.000 0.061 0.000 0.948 279 Q CA 0.416 56.259 55.803 0.066 0.000 0.540 279 Q CB 0.645 29.356 28.738 -0.044 0.000 0.156 279 Q HN 0.529 8.908 8.270 0.183 0.000 0.899 280 G N 0.854 109.687 108.800 0.056 0.000 1.885 280 G HA2 0.031 4.025 3.960 0.057 0.000 0.309 280 G HA3 0.031 4.034 3.960 0.073 0.000 0.309 280 G C -2.139 172.796 174.900 0.060 0.000 1.751 280 G CA 0.434 45.572 45.100 0.064 0.000 0.949 280 G HN -0.612 7.621 8.290 0.027 0.072 0.564 281 S N 5.487 121.212 115.700 0.041 0.000 2.558 281 S HA -0.323 4.142 4.470 -0.008 0.000 0.287 281 S C 0.252 174.864 174.600 0.020 0.000 1.321 281 S CA 1.464 59.672 58.200 0.014 0.000 1.048 281 S CB 0.599 63.807 63.200 0.013 0.000 0.844 281 S HN 0.119 8.457 8.310 0.047 0.000 0.512 282 D N 3.300 123.698 120.400 -0.003 0.000 3.979 282 D HA -0.300 4.328 4.640 -0.020 0.000 0.197 282 D C -1.498 174.851 176.300 0.081 0.000 0.939 282 D CA 2.636 56.649 54.000 0.022 0.000 2.262 282 D CB -0.490 40.335 40.800 0.042 0.000 1.166 282 D HN 0.602 8.949 8.370 -0.039 0.000 0.467 283 F N 4.289 124.240 119.950 0.002 0.000 2.515 283 F HA -0.154 4.401 4.527 0.046 0.000 0.353 283 F C -0.818 175.014 175.800 0.053 0.000 1.213 283 F CA 0.235 58.258 58.000 0.037 0.000 1.194 283 F CB -0.509 38.519 39.000 0.047 0.000 1.488 283 F HN -0.454 7.929 8.300 0.207 0.042 0.619 284 G N 6.017 114.702 108.800 -0.192 0.000 2.846 284 G HA2 -0.270 3.677 3.960 -0.171 0.000 0.254 284 G HA3 -0.270 3.553 3.960 -0.229 0.000 0.254 284 G C -2.891 171.896 174.900 -0.189 0.000 1.017 284 G CA -0.861 44.109 45.100 -0.217 0.000 1.188 284 G HN -0.166 7.947 8.290 -0.112 0.110 0.518 285 P HA 0.324 4.574 4.420 -0.422 -0.083 0.282 285 P C -1.377 175.777 177.300 -0.243 0.000 1.274 285 P CA -1.121 61.734 63.100 -0.409 0.000 0.770 285 P CB 0.160 31.452 31.700 -0.679 0.000 0.867 286 I N 0.859 121.320 120.570 -0.182 0.000 2.388 286 I HA 0.251 4.298 4.170 -0.204 0.000 0.281 286 I C -1.202 174.906 176.117 -0.015 0.000 1.046 286 I CA -2.576 58.669 61.300 -0.091 0.000 1.187 286 I CB -0.068 37.941 38.000 0.015 0.000 1.351 286 I HN -0.078 8.053 8.210 -0.132 0.000 0.472 287 F N 9.791 129.724 119.950 -0.029 0.000 2.606 287 F HA 0.229 4.541 4.527 -0.358 0.000 0.347 287 F C -1.410 174.410 175.800 0.033 0.000 1.207 287 F CA -1.319 56.607 58.000 -0.124 0.000 1.306 287 F CB -0.521 38.360 39.000 -0.199 0.000 1.657 287 F HN 0.171 8.678 8.300 0.346 0.000 0.606 288 M N 0.542 120.059 119.600 -0.138 0.000 2.254 288 M HA -0.191 4.253 4.480 -0.059 0.000 0.265 288 M C 1.574 177.730 176.300 -0.240 0.000 1.066 288 M CA 1.035 56.261 55.300 -0.123 0.000 1.123 288 M CB -0.461 32.089 32.600 -0.083 0.000 1.388 288 M HN -0.377 7.761 8.290 -0.146 0.064 0.425 289 T N 2.020 116.330 114.554 -0.407 0.000 1.920 289 T HA -0.341 3.834 4.350 -0.291 0.000 0.149 289 T C 1.968 176.448 174.700 -0.366 0.000 1.935 289 T CA 3.538 65.362 62.100 -0.461 0.000 1.062 289 T CB 0.079 68.477 68.868 -0.784 0.000 0.857 289 T HN 0.138 8.088 8.240 -0.483 0.000 0.380 290 I N 0.626 120.983 120.570 -0.355 0.000 2.110 290 I HA -0.104 3.855 4.170 -0.352 0.000 0.236 290 I C 0.053 175.944 176.117 -0.377 0.000 1.068 290 I CA 4.460 65.612 61.300 -0.247 0.000 1.333 290 I CB -2.413 35.600 38.000 0.022 0.000 1.054 290 I HN 0.104 7.986 8.210 -0.548 0.000 0.402 291 P HA -0.240 4.145 4.420 -0.059 0.000 0.222 291 P C -0.123 177.127 177.300 -0.083 0.000 1.142 291 P CA 2.332 65.395 63.100 -0.061 0.000 0.788 291 P CB -1.167 30.597 31.700 0.107 0.000 0.767 292 A N -4.191 118.525 122.820 -0.172 0.000 2.303 292 A HA 0.167 4.492 4.320 0.009 0.000 0.217 292 A C 0.372 177.888 177.584 -0.114 0.000 1.205 292 A CA 0.406 52.384 52.037 -0.099 0.000 0.875 292 A CB -0.117 18.805 19.000 -0.130 0.000 0.910 292 A HN -0.608 7.357 8.150 -0.225 0.051 0.501 293 F N 0.504 120.127 119.950 -0.546 0.000 2.367 293 F HA -0.190 4.016 4.527 -0.534 0.000 0.298 293 F C 0.719 176.440 175.800 -0.131 0.000 1.094 293 F CA 3.431 61.108 58.000 -0.537 0.000 1.409 293 F CB 0.930 39.478 39.000 -0.754 0.000 1.064 293 F HN -0.076 7.759 8.300 -0.510 0.159 0.528 294 F N -2.007 118.134 119.950 0.317 0.000 2.128 294 F HA -0.093 4.601 4.527 0.278 0.000 0.295 294 F C 2.621 178.582 175.800 0.268 0.000 1.100 294 F CA 0.869 59.041 58.000 0.287 0.000 1.260 294 F CB -1.737 37.415 39.000 0.253 0.000 1.009 294 F HN -0.371 7.607 8.300 -0.407 0.078 0.476 295 A N -1.269 121.811 122.820 0.434 0.000 2.014 295 A HA -0.172 4.302 4.320 0.256 0.000 0.218 295 A C 0.092 177.743 177.584 0.112 0.000 1.163 295 A CA 2.163 54.322 52.037 0.203 0.000 0.652 295 A CB -0.146 18.795 19.000 -0.098 0.000 0.808 295 A HN -0.473 8.031 8.150 0.591 0.000 0.449 296 K N -4.322 116.137 120.400 0.100 0.000 2.446 296 K HA 0.412 4.696 4.320 -0.059 0.000 0.203 296 K C 0.845 177.459 176.600 0.023 0.000 1.027 296 K CA -0.315 55.966 56.287 -0.010 0.000 1.166 296 K CB -0.418 32.011 32.500 -0.118 0.000 0.869 296 K HN -0.447 7.812 8.250 0.126 0.067 0.504 297 T N 3.255 117.894 114.554 0.142 0.000 3.072 297 T HA -0.038 4.368 4.350 0.093 0.000 0.266 297 T C 1.472 176.223 174.700 0.085 0.000 1.127 297 T CA 2.640 64.820 62.100 0.132 0.000 1.107 297 T CB -1.011 67.989 68.868 0.220 0.000 0.910 297 T HN -0.348 7.820 8.240 0.206 0.196 0.513 298 S N 3.275 119.030 115.700 0.092 0.000 2.428 298 S HA -0.395 4.162 4.470 0.145 0.000 0.240 298 S C 0.731 175.406 174.600 0.125 0.000 1.036 298 S CA 3.335 61.610 58.200 0.125 0.000 1.009 298 S CB -0.263 63.018 63.200 0.135 0.000 0.803 298 S HN -0.251 8.077 8.310 0.095 0.039 0.486 299 A N -1.561 121.253 122.820 -0.011 0.000 2.186 299 A HA -0.139 4.115 4.320 -0.110 0.000 0.219 299 A C 0.503 178.026 177.584 -0.101 0.000 1.159 299 A CA 0.866 52.842 52.037 -0.102 0.000 0.680 299 A CB 0.229 19.095 19.000 -0.224 0.000 0.787 299 A HN -0.553 7.536 8.150 -0.044 0.035 0.467 300 V N -0.237 119.666 119.914 -0.019 0.000 2.149 300 V HA -0.096 3.931 4.120 -0.155 0.000 0.245 300 V C -0.508 175.640 176.094 0.089 0.000 1.349 300 V CA -0.962 61.317 62.300 -0.036 0.000 1.289 300 V CB -2.778 29.035 31.823 -0.017 0.000 1.401 300 V HN -0.245 7.784 8.190 0.039 0.184 0.501 301 Y N 8.486 128.701 120.300 -0.141 0.000 2.518 301 Y HA -0.093 4.421 4.550 -0.060 0.000 0.337 301 Y C -1.551 174.281 175.900 -0.113 0.000 1.261 301 Y CA -0.191 57.851 58.100 -0.098 0.000 1.856 301 Y CB -2.571 35.843 38.460 -0.078 0.000 1.798 301 Y HN -0.250 8.023 8.280 0.079 0.055 0.440 302 N N 2.034 120.736 118.700 0.003 0.000 2.801 302 N HA 0.207 4.934 4.740 -0.022 0.000 0.280 302 N C -1.724 173.788 175.510 0.004 0.000 0.835 302 N CA 1.585 54.618 53.050 -0.028 0.000 1.145 302 N CB -0.388 38.054 38.487 -0.075 0.000 1.516 302 N HN -0.358 7.993 8.380 0.001 0.030 1.122 303 P HA 0.057 4.588 4.420 0.185 0.000 0.230 303 P C 1.249 178.579 177.300 0.051 0.000 1.168 303 P CA 1.573 64.727 63.100 0.091 0.000 0.793 303 P CB 0.041 31.782 31.700 0.068 0.000 0.851 304 V N 0.212 120.104 119.914 -0.036 0.000 2.214 304 V HA -0.483 3.575 4.120 -0.104 0.000 0.247 304 V C 2.031 178.009 176.094 -0.193 0.000 1.051 304 V CA 4.390 66.598 62.300 -0.154 0.000 1.003 304 V CB -0.710 30.926 31.823 -0.312 0.000 0.635 304 V HN -0.709 7.471 8.190 -0.016 0.000 0.447 305 I N -6.094 114.352 120.570 -0.207 0.000 2.567 305 I HA -0.484 3.519 4.170 -0.278 0.000 0.257 305 I C 0.689 176.778 176.117 -0.047 0.000 1.184 305 I CA 2.459 63.651 61.300 -0.180 0.000 1.451 305 I CB -0.564 37.356 38.000 -0.134 0.000 1.089 305 I HN -0.617 7.497 8.210 -0.159 0.000 0.441 306 Y N 1.186 121.419 120.300 -0.112 0.000 2.193 306 Y HA -0.280 4.232 4.550 -0.065 0.000 0.285 306 Y C 1.078 176.943 175.900 -0.057 0.000 1.166 306 Y CA 0.996 59.054 58.100 -0.071 0.000 1.181 306 Y CB 0.197 38.625 38.460 -0.054 0.000 0.976 306 Y HN -0.643 7.516 8.280 0.113 0.189 0.520 307 I N -1.865 118.572 120.570 -0.221 0.000 2.410 307 I HA 0.048 4.023 4.170 -0.324 0.000 0.288 307 I C -0.539 175.497 176.117 -0.134 0.000 1.106 307 I CA -2.133 59.023 61.300 -0.240 0.000 1.389 307 I CB -2.968 34.922 38.000 -0.184 0.000 1.561 307 I HN -0.691 7.419 8.210 -0.129 0.023 0.605 308 M N 1.637 121.172 119.600 -0.109 0.000 2.472 308 M HA -0.321 4.044 4.480 -0.193 0.000 0.267 308 M C 0.607 176.920 176.300 0.022 0.000 1.126 308 M CA 3.984 59.235 55.300 -0.083 0.000 1.082 308 M CB 0.692 33.267 32.600 -0.042 0.000 1.177 308 M HN -0.272 7.846 8.290 -0.097 0.114 0.485 309 M N -10.786 108.839 119.600 0.042 0.000 4.866 309 M HA -0.197 4.319 4.480 0.061 0.000 0.569 309 M C -0.447 175.911 176.300 0.098 0.000 1.721 309 M CA 1.373 56.720 55.300 0.079 0.000 0.938 309 M CB -1.348 31.331 32.600 0.132 0.000 3.322 309 M HN -0.471 7.836 8.290 0.029 0.000 0.516 310 N N 3.202 121.963 118.700 0.102 0.000 2.396 310 N HA -0.280 4.532 4.740 0.120 0.000 0.180 310 N C -0.285 175.276 175.510 0.086 0.000 1.028 310 N CA 2.213 55.323 53.050 0.100 0.000 0.893 310 N CB 0.252 38.791 38.487 0.087 0.000 0.967 310 N HN 0.206 8.573 8.380 0.111 0.079 0.440 311 K N -4.030 116.413 120.400 0.072 0.000 2.618 311 K HA 0.225 4.757 4.320 0.051 -0.181 0.207 311 K C -1.906 174.728 176.600 0.057 0.000 1.058 311 K CA -1.916 54.403 56.287 0.053 0.000 1.086 311 K CB -0.461 32.060 32.500 0.035 0.000 0.827 311 K HN -0.274 7.954 8.250 0.071 0.065 0.481 312 Q N 0.178 120.031 119.800 0.089 0.000 2.464 312 Q HA 0.089 4.489 4.340 0.101 0.000 0.256 312 Q C -1.985 174.161 176.000 0.243 0.000 1.020 312 Q CA -0.663 55.210 55.803 0.117 0.000 0.716 312 Q CB 1.428 30.215 28.738 0.081 0.000 1.230 312 Q HN -0.395 7.787 8.270 0.112 0.155 0.494 313 F N 4.923 124.880 119.950 0.012 0.000 2.160 313 F HA -0.430 4.104 4.527 0.012 0.000 0.526 313 F C -1.794 174.014 175.800 0.014 0.000 1.295 313 F CA 0.862 58.870 58.000 0.014 0.000 1.687 313 F CB 0.404 39.415 39.000 0.019 0.000 2.704 313 F HN 0.389 8.794 8.300 0.175 0.000 0.722 314 R N 0.263 120.654 120.500 -0.181 0.000 3.332 314 R HA -0.497 3.855 4.340 -0.183 -0.122 0.263 314 R C -0.742 175.542 176.300 -0.027 0.000 1.053 314 R CA 0.774 56.812 56.100 -0.103 0.000 0.705 314 R CB -2.014 28.264 30.300 -0.037 0.000 1.166 314 R HN 0.101 8.333 8.270 -0.485 -0.254 0.427 315 N N -0.749 117.932 118.700 -0.032 0.000 2.368 315 N HA -0.107 4.642 4.740 0.016 0.000 0.178 315 N C 0.459 175.960 175.510 -0.015 0.000 1.021 315 N CA 1.512 54.561 53.050 -0.001 0.000 0.875 315 N CB 1.616 40.111 38.487 0.014 0.000 1.020 315 N HN -0.347 8.475 8.380 -0.074 -0.485 0.433 316 C N -4.811 114.469 119.300 -0.033 0.000 0.168 316 C HA -0.553 3.886 4.460 -0.035 0.000 0.017 316 C C -0.662 174.315 174.990 -0.023 0.000 0.171 316 C CA 1.332 60.333 59.018 -0.028 0.000 0.499 316 C CB -1.507 26.223 27.740 -0.017 0.000 3.212 316 C HN 0.192 8.682 8.230 -0.052 -0.291 1.118 317 M N 4.761 124.350 119.600 -0.018 0.000 2.390 317 M HA -0.070 4.399 4.480 -0.018 0.000 0.353 317 M C -0.970 175.300 176.300 -0.050 0.000 1.623 317 M CA 1.546 56.831 55.300 -0.025 0.000 1.065 317 M CB -0.375 32.216 32.600 -0.014 0.000 2.025 317 M HN 0.385 8.668 8.290 -0.012 0.000 0.461 318 V N 0.963 120.843 119.914 -0.057 0.000 6.868 318 V HA -0.258 3.799 4.120 -0.105 0.000 0.372 318 V C -0.592 175.477 176.094 -0.043 0.000 0.343 318 V CA 0.697 62.944 62.300 -0.088 0.000 0.747 318 V CB -2.209 29.527 31.823 -0.146 0.000 0.246 318 V HN 0.432 8.599 8.190 -0.038 0.000 1.469 319 T N 2.174 116.716 114.554 -0.021 0.000 3.829 319 T HA -0.115 4.241 4.350 0.011 0.000 0.251 319 T C -0.554 174.158 174.700 0.019 0.000 1.030 319 T CA 1.598 63.699 62.100 0.001 0.000 0.954 319 T CB -1.764 67.100 68.868 -0.007 0.000 1.120 319 T HN 0.234 8.461 8.240 -0.022 0.000 0.633 320 T N 3.730 118.292 114.554 0.013 0.000 3.658 320 T HA 0.475 5.042 4.350 0.030 -0.199 0.245 320 T C -1.200 173.512 174.700 0.019 0.000 1.292 320 T CA -0.034 62.077 62.100 0.018 0.000 1.598 320 T CB -0.071 68.800 68.868 0.006 0.000 0.861 320 T HN -0.020 8.086 8.240 -0.003 0.133 0.663 321 L N -1.499 119.749 121.223 0.042 0.000 2.322 321 L HA 0.485 4.843 4.340 0.030 0.000 0.252 321 L C -1.312 175.598 176.870 0.067 0.000 1.055 321 L CA -2.632 52.238 54.840 0.050 0.000 0.849 321 L CB 4.414 46.511 42.059 0.062 0.000 1.446 321 L HN -0.281 7.984 8.230 0.058 0.000 0.416 322 C N -0.104 119.238 119.300 0.070 0.000 2.662 322 C HA -0.045 4.570 4.460 0.041 -0.130 0.420 322 C C 0.501 175.535 174.990 0.072 0.000 1.314 322 C CA 1.545 60.609 59.018 0.076 0.000 1.963 322 C CB -0.050 27.767 27.740 0.128 0.000 2.686 322 C HN 0.351 8.629 8.230 0.079 0.000 0.609 323 C N 0.128 119.436 119.300 0.013 0.000 3.707 323 C HA 0.226 4.574 4.460 -0.188 0.000 0.226 323 C C -1.833 173.025 174.990 -0.220 0.000 4.922 323 C CA -0.973 57.969 59.018 -0.126 0.000 1.308 323 C CB 0.561 28.353 27.740 0.086 0.000 4.793 323 C HN 0.767 9.343 8.230 0.014 -0.337 0.452 324 G N -1.175 107.528 108.800 -0.161 0.000 2.482 324 G HA2 -0.001 3.899 3.960 -0.099 0.000 0.184 324 G HA3 -0.001 4.016 3.960 -0.118 -0.128 0.184 324 G C 0.127 175.038 174.900 0.018 0.000 1.331 324 G CA 0.870 45.916 45.100 -0.090 0.000 0.668 324 G HN -0.062 8.216 8.290 -0.020 0.000 0.631 325 K N 1.583 122.041 120.400 0.097 0.000 2.026 325 K HA -0.256 4.102 4.320 0.063 0.000 0.208 325 K C 0.588 177.221 176.600 0.055 0.000 1.048 325 K CA 1.392 57.728 56.287 0.082 0.000 0.929 325 K CB 0.537 33.099 32.500 0.103 0.000 0.713 325 K HN -0.446 7.911 8.250 0.179 0.000 0.439 326 N N -3.260 115.481 118.700 0.068 0.000 4.102 326 N HA -0.243 4.528 4.740 0.052 0.000 0.315 326 N C -1.755 173.771 175.510 0.026 0.000 2.203 326 N CA 0.108 53.182 53.050 0.041 0.000 2.949 326 N CB -0.011 38.485 38.487 0.015 0.000 0.308 326 N HN -0.600 7.843 8.380 0.104 0.000 0.727 327 P HA -0.055 4.458 4.420 0.024 -0.078 0.255 327 P C -2.333 174.990 177.300 0.039 0.000 1.427 327 P CA 0.386 63.501 63.100 0.025 0.000 0.863 327 P CB 0.670 32.375 31.700 0.009 0.000 1.444 328 L N -2.249 119.004 121.223 0.050 0.000 2.476 328 L HA 0.239 4.756 4.340 0.059 -0.142 0.269 328 L C -0.281 176.635 176.870 0.077 0.000 0.965 328 L CA -0.531 54.341 54.840 0.055 0.000 0.845 328 L CB 2.489 44.569 42.059 0.036 0.000 1.259 328 L HN -0.762 7.458 8.230 0.052 0.041 0.403 329 G N 5.247 114.102 108.800 0.092 0.000 2.552 329 G HA2 -0.443 3.565 3.960 0.044 0.000 0.265 329 G HA3 -0.443 3.545 3.960 0.046 0.000 0.265 329 G C -1.827 173.174 174.900 0.169 0.000 1.234 329 G CA -0.242 44.905 45.100 0.079 0.000 0.944 329 G HN -0.222 8.121 8.290 0.089 0.000 0.568 330 D N 1.910 122.380 120.400 0.117 0.000 2.389 330 D HA -0.144 4.498 4.640 0.003 0.000 0.263 330 D C -1.521 174.702 176.300 -0.129 0.000 1.255 330 D CA 0.860 54.866 54.000 0.011 0.000 0.914 330 D CB 0.422 41.231 40.800 0.014 0.000 1.116 330 D HN -0.089 8.381 8.370 0.166 0.000 0.502 331 D N 1.341 121.660 120.400 -0.134 0.000 2.472 331 D HA 0.058 4.483 4.640 -0.358 0.000 0.248 331 D C 0.354 176.579 176.300 -0.124 0.000 1.271 331 D CA -1.084 52.781 54.000 -0.224 0.000 0.888 331 D CB 0.933 41.599 40.800 -0.223 0.000 1.337 331 D HN -0.142 8.187 8.370 -0.069 0.000 0.526 332 E N 4.390 124.522 120.200 -0.112 0.000 2.058 332 E HA -0.302 4.015 4.350 -0.055 0.000 0.194 332 E C -0.137 176.419 176.600 -0.074 0.000 0.997 332 E CA 1.930 58.285 56.400 -0.075 0.000 0.801 332 E CB 0.101 29.766 29.700 -0.058 0.000 0.746 332 E HN 0.459 8.747 8.360 -0.119 0.000 0.450 333 A N -2.868 119.892 122.820 -0.100 0.000 3.569 333 A HA -0.159 4.106 4.320 -0.092 0.000 0.160 333 A C -1.689 175.852 177.584 -0.071 0.000 1.298 333 A CA -0.237 51.752 52.037 -0.080 0.000 1.177 333 A CB -0.728 18.243 19.000 -0.048 0.000 0.820 333 A HN -0.229 7.841 8.150 -0.134 0.000 0.394 334 S N 0.403 116.076 115.700 -0.045 0.000 4.114 334 S HA -0.389 4.066 4.470 -0.024 0.000 0.618 334 S C -0.844 173.740 174.600 -0.027 0.000 1.937 334 S CA 1.988 60.169 58.200 -0.032 0.000 4.228 334 S CB -0.844 62.338 63.200 -0.030 0.000 0.216 334 S HN 0.308 8.594 8.310 -0.041 0.000 0.528 335 T N -4.493 110.047 114.554 -0.024 0.000 3.843 335 T HA -0.020 4.326 4.350 -0.007 0.000 0.149 335 T C -0.624 174.074 174.700 -0.002 0.000 0.481 335 T CA 0.177 62.272 62.100 -0.009 0.000 0.886 335 T CB -0.675 68.191 68.868 -0.002 0.000 1.405 335 T HN 0.025 8.247 8.240 -0.030 0.000 0.527 336 T N -1.911 112.641 114.554 -0.003 0.000 3.732 336 T HA 0.362 4.715 4.350 0.006 0.000 0.234 336 T C -0.616 174.091 174.700 0.012 0.000 1.146 336 T CA -0.730 61.372 62.100 0.003 0.000 1.454 336 T CB -0.478 68.387 68.868 -0.006 0.000 0.910 336 T HN -0.106 8.130 8.240 -0.007 0.000 0.640 337 V N 0.328 120.255 119.914 0.020 0.000 0.689 337 V HA -0.455 3.686 4.120 0.036 0.000 0.092 337 V C -0.440 175.682 176.094 0.047 0.000 0.795 337 V CA 0.790 63.110 62.300 0.034 0.000 3.102 337 V CB -0.978 30.865 31.823 0.033 0.000 0.199 337 V HN -0.139 8.018 8.190 0.018 0.043 0.108 338 S N 2.390 118.127 115.700 0.062 0.000 2.596 338 S HA 0.051 4.584 4.470 0.105 0.000 0.262 338 S C -1.348 173.332 174.600 0.133 0.000 1.218 338 S CA 0.257 58.516 58.200 0.098 0.000 0.998 338 S CB 1.089 64.344 63.200 0.091 0.000 1.060 338 S HN 0.065 8.409 8.310 0.056 0.000 0.552 339 K N -0.229 120.334 120.400 0.272 0.000 2.318 339 K HA 0.204 4.649 4.320 0.208 0.000 0.249 339 K C -0.188 176.709 176.600 0.494 0.000 0.942 339 K CA -1.377 55.199 56.287 0.482 0.000 0.808 339 K CB 2.865 36.120 32.500 1.258 0.000 1.189 339 K HN 0.042 8.446 8.250 0.257 0.000 0.428 340 T N 3.536 118.338 114.554 0.413 0.000 2.793 340 T HA 0.076 4.535 4.350 0.182 0.000 0.299 340 T C -0.029 174.890 174.700 0.365 0.000 1.038 340 T CA -0.885 61.384 62.100 0.281 0.000 0.948 340 T CB 0.567 69.532 68.868 0.162 0.000 1.231 340 T HN -0.053 8.347 8.240 0.267 0.000 0.538 341 E N -0.115 120.186 120.200 0.168 0.000 2.490 341 E HA 0.226 4.659 4.350 0.138 0.000 0.232 341 E C -0.494 176.206 176.600 0.166 0.000 1.091 341 E CA -0.223 56.254 56.400 0.130 0.000 1.050 341 E CB -0.459 29.213 29.700 -0.046 0.000 1.342 341 E HN 0.255 8.680 8.360 0.109 0.000 0.454 342 T N 0.785 115.488 114.554 0.249 0.000 2.812 342 T HA 0.177 5.383 4.350 1.183 -0.147 0.137 342 T C -0.175 174.661 174.700 0.226 0.000 0.815 342 T CA -0.204 62.197 62.100 0.501 0.000 0.763 342 T CB 0.614 69.705 68.868 0.372 0.000 2.198 342 T HN -0.390 7.945 8.240 0.159 0.000 0.333 343 S N 5.383 121.105 115.700 0.036 0.000 3.864 343 S HA -0.077 4.295 4.470 -0.195 -0.018 0.202 343 S C -0.864 173.723 174.600 -0.022 0.000 1.402 343 S CA 0.595 58.751 58.200 -0.074 0.000 1.072 343 S CB -1.337 61.827 63.200 -0.061 0.000 1.383 343 S HN 0.175 8.524 8.310 0.066 0.000 0.458 344 Q N 1.568 121.375 119.800 0.012 0.000 3.105 344 Q HA 0.165 4.510 4.340 0.007 0.000 0.280 344 Q C -0.600 175.412 176.000 0.019 0.000 1.042 344 Q CA -1.495 54.321 55.803 0.022 0.000 0.857 344 Q CB 2.914 31.680 28.738 0.047 0.000 1.468 344 Q HN -0.476 7.728 8.270 0.008 0.071 0.494 345 V N -6.502 113.430 119.914 0.029 0.000 5.720 345 V HA -0.387 3.752 4.120 0.032 0.000 0.167 345 V C -1.896 174.216 176.094 0.031 0.000 0.719 345 V CA 0.793 63.115 62.300 0.036 0.000 0.518 345 V CB -2.815 29.046 31.823 0.063 0.000 0.203 345 V HN 0.248 8.454 8.190 0.027 0.000 0.402 346 A N 2.728 125.552 122.820 0.007 0.000 2.398 346 A HA 0.552 4.798 4.320 0.000 0.074 0.301 346 A C -2.829 174.740 177.584 -0.024 0.000 1.041 346 A CA -2.927 49.108 52.037 -0.003 0.000 0.711 346 A CB 2.236 21.238 19.000 0.003 0.000 1.240 346 A HN -0.486 7.663 8.150 -0.001 0.000 0.420 347 P HA 0.089 4.484 4.420 -0.042 0.000 0.268 347 P C -1.100 176.190 177.300 -0.017 0.000 1.204 347 P CA -0.303 62.777 63.100 -0.033 0.000 0.768 347 P CB 0.460 32.140 31.700 -0.033 0.000 0.842 348 A N 0.000 122.811 122.820 -0.015 0.000 2.254 348 A HA 0.000 4.303 4.320 -0.029 0.000 0.244 348 A CA 0.000 52.025 52.037 -0.020 0.000 0.836 348 A CB 0.000 18.992 19.000 -0.014 0.000 0.831 348 A HN 0.000 8.144 8.150 -0.010 0.000 0.486