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 2yvk_1_C DATA FIRST_RESID 1 DATA SEQUENCE MTHSFAVPRS VEWKETAITI LNQQKLPDET EYLELTTKED VFDAIVTLKV DATA SEQUENCE RGAPAIGITA AFGLALAAKD IETDNVTEFR RRLEDIKQYL NSSRPTAINL DATA SEQUENCE SWALERLSHS VENAISVNEA KTNLVHEAIQ IQVEDEETCR LIGQNALQLF DATA SEQUENCE KKGDRIMTIC NAGSIATSRY GTALAPFYLA KQKDLGLHIY ACETRPVLQG DATA SEQUENCE SRLTAWELMQ GGIDVTLITD SMAAHTMKEK QISAVIVGAD RIAKNGDTAN DATA SEQUENCE KIGTYGLAIL ANAFDIPFFV AAPLSTFDTK VKCGADIPIE ERDPEEVRQI DATA SEQUENCE SGVRTAPSNV PVFNPAFDIT PHDLISGIIT EKGIMTGNYE EEIEQLFKG 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 M HA 0.000 4.480 4.480 0.000 0.000 0.227 1 M C 0.000 176.270 176.300 -0.050 0.000 1.140 1 M CA 0.000 55.250 55.300 -0.083 0.000 0.988 1 M CB 0.000 32.561 32.600 -0.065 0.000 1.302 2 T N -1.904 112.588 114.554 -0.103 0.000 3.169 2 T HA 0.159 4.510 4.350 0.001 0.000 0.250 2 T C 0.924 175.828 174.700 0.340 0.000 1.111 2 T CA 0.790 62.931 62.100 0.069 0.000 1.010 2 T CB -0.515 68.381 68.868 0.046 0.000 0.984 2 T HN 0.337 8.577 8.240 0.000 0.000 0.537 3 H N 0.124 119.259 119.070 0.109 0.000 2.705 3 H HA 0.452 5.009 4.556 0.001 0.000 0.269 3 H C 2.194 177.431 175.328 -0.151 0.000 0.998 3 H CA -0.628 55.426 56.048 0.010 0.000 1.193 3 H CB 0.019 29.753 29.762 -0.045 0.000 1.485 3 H HN 0.307 8.587 8.280 0.000 0.000 0.521 4 S N 1.335 117.073 115.700 0.063 0.000 2.423 4 S HA -0.183 4.288 4.470 0.001 0.000 0.238 4 S C 1.782 176.325 174.600 -0.095 0.000 1.028 4 S CA 1.464 59.653 58.200 -0.019 0.000 1.000 4 S CB -0.520 62.682 63.200 0.003 0.000 0.797 4 S HN 0.617 8.927 8.310 0.000 0.000 0.487 5 F N 1.438 121.263 119.950 -0.208 0.000 2.407 5 F HA 0.287 4.815 4.527 0.001 0.000 0.299 5 F C 1.935 177.509 175.800 -0.378 0.000 1.097 5 F CA 0.380 58.164 58.000 -0.359 0.000 1.422 5 F CB -0.707 37.768 39.000 -0.876 0.000 1.067 5 F HN 0.109 8.409 8.300 0.000 0.000 0.539 6 A N 0.882 122.899 122.820 -1.338 0.000 2.235 6 A HA 0.331 4.652 4.320 0.001 0.000 0.208 6 A C 0.707 177.876 177.584 -0.690 0.000 1.172 6 A CA 0.723 52.080 52.037 -1.133 0.000 0.786 6 A CB -1.231 17.253 19.000 -0.860 0.000 0.804 6 A HN 0.378 8.528 8.150 0.000 0.000 0.479 7 V N -3.553 116.086 119.914 -0.458 0.000 2.823 7 V HA 0.610 4.731 4.120 0.001 0.000 0.312 7 V C -3.040 172.938 176.094 -0.192 0.000 1.072 7 V CA -2.943 59.191 62.300 -0.277 0.000 0.937 7 V CB 1.918 33.646 31.823 -0.158 0.000 1.013 7 V HN 0.110 8.300 8.190 0.000 0.000 0.430 8 P HA 0.251 4.671 4.420 0.000 0.000 0.264 8 P C -0.527 176.798 177.300 0.041 0.000 1.193 8 P CA 0.188 63.267 63.100 -0.035 0.000 0.763 8 P CB 1.084 32.783 31.700 -0.001 0.000 0.810 9 R N 1.497 122.068 120.500 0.118 0.000 2.551 9 R HA 0.013 4.353 4.340 0.001 0.000 0.202 9 R C 2.472 178.935 176.300 0.270 0.000 0.861 9 R CA 0.727 56.983 56.100 0.259 0.000 1.018 9 R CB -0.538 29.932 30.300 0.284 0.000 1.435 9 R HN 0.554 8.824 8.270 0.000 0.000 0.659 10 S N 0.720 116.527 115.700 0.179 0.000 2.359 10 S HA -0.081 4.390 4.470 0.001 0.000 0.222 10 S C 0.985 175.684 174.600 0.165 0.000 1.038 10 S CA 1.149 59.439 58.200 0.151 0.000 1.051 10 S CB -0.207 63.074 63.200 0.136 0.000 0.944 10 S HN 0.103 8.413 8.310 0.000 0.000 0.433 11 V N 0.391 120.411 119.914 0.176 0.000 2.924 11 V HA 0.696 4.817 4.120 0.001 0.000 0.300 11 V C -2.211 173.971 176.094 0.147 0.000 1.227 11 V CA -0.646 61.764 62.300 0.183 0.000 0.954 11 V CB 2.284 34.251 31.823 0.240 0.000 1.055 11 V HN 0.365 8.555 8.190 0.000 0.000 0.429 12 E N 4.872 125.110 120.200 0.064 0.000 2.292 12 E HA 0.345 4.696 4.350 0.001 0.000 0.272 12 E C -1.524 174.971 176.600 -0.175 0.000 0.881 12 E CA -0.444 55.933 56.400 -0.038 0.000 0.754 12 E CB 2.170 31.854 29.700 -0.027 0.000 1.201 12 E HN 0.779 9.139 8.360 0.000 0.000 0.425 13 W N 4.666 125.617 121.300 -0.581 0.000 2.316 13 W HA 0.301 4.962 4.660 0.003 0.000 0.321 13 W C -0.300 176.046 176.519 -0.289 0.000 1.203 13 W CA -0.168 56.781 57.345 -0.660 0.000 1.214 13 W CB 0.787 29.649 29.460 -0.997 0.000 1.169 13 W HN 0.395 8.575 8.180 0.000 0.000 0.561 14 K N 4.142 123.927 120.400 -1.024 0.000 2.734 14 K HA -0.030 4.291 4.320 0.001 0.000 0.200 14 K C 0.321 176.377 176.600 -0.906 0.000 1.120 14 K CA -0.214 55.632 56.287 -0.735 0.000 1.067 14 K CB 1.058 33.312 32.500 -0.410 0.000 0.771 14 K HN 0.554 8.804 8.250 0.000 0.000 0.481 15 E N -0.284 118.880 120.200 -1.726 0.000 5.080 15 E HA -0.266 4.085 4.350 0.001 0.000 0.168 15 E C 1.102 177.316 176.600 -0.643 0.000 1.286 15 E CA 2.874 58.751 56.400 -0.872 0.000 2.223 15 E CB -1.226 28.360 29.700 -0.189 0.000 1.857 15 E HN 0.276 8.636 8.360 0.000 0.000 0.388 16 T N -1.019 113.230 114.554 -0.508 0.000 3.039 16 T HA 0.596 4.947 4.350 0.001 0.000 0.250 16 T C 0.314 174.836 174.700 -0.297 0.000 1.052 16 T CA 0.762 62.685 62.100 -0.294 0.000 1.125 16 T CB 0.281 69.040 68.868 -0.182 0.000 0.908 16 T HN 0.448 8.688 8.240 0.000 0.000 0.473 17 A N 0.301 122.887 122.820 -0.390 0.000 2.567 17 A HA 0.805 5.125 4.320 0.001 0.000 0.289 17 A C -1.822 175.582 177.584 -0.300 0.000 1.177 17 A CA -0.755 51.127 52.037 -0.258 0.000 0.694 17 A CB 1.020 19.932 19.000 -0.147 0.000 1.292 17 A HN 0.259 8.409 8.150 0.000 0.000 0.425 18 I N 1.058 121.556 120.570 -0.120 0.000 2.410 18 I HA 0.363 4.534 4.170 0.001 0.000 0.286 18 I C -0.538 175.577 176.117 -0.002 0.000 1.009 18 I CA -0.273 60.998 61.300 -0.049 0.000 1.111 18 I CB 2.141 40.199 38.000 0.097 0.000 1.262 18 I HN 0.515 8.725 8.210 0.000 0.000 0.443 19 T N 7.462 122.013 114.554 -0.005 0.000 2.767 19 T HA 0.637 4.988 4.350 0.001 0.000 0.284 19 T C -0.155 174.629 174.700 0.140 0.000 0.973 19 T CA -0.303 61.836 62.100 0.065 0.000 0.996 19 T CB 0.803 69.694 68.868 0.038 0.000 0.927 19 T HN 0.489 8.729 8.240 0.000 0.000 0.456 20 I N 0.773 121.440 120.570 0.161 0.000 2.785 20 I HA 0.711 4.882 4.170 0.001 0.000 0.302 20 I C -0.959 175.198 176.117 0.067 0.000 1.069 20 I CA -1.661 59.724 61.300 0.142 0.000 1.045 20 I CB 1.566 39.619 38.000 0.088 0.000 1.236 20 I HN 0.332 8.542 8.210 0.000 0.000 0.429 21 L N 4.102 125.298 121.223 -0.046 0.000 2.360 21 L HA 0.326 4.667 4.340 0.001 0.000 0.276 21 L C 0.236 176.954 176.870 -0.252 0.000 1.121 21 L CA 0.326 54.917 54.840 -0.416 0.000 0.845 21 L CB 0.309 42.183 42.059 -0.309 0.000 1.143 21 L HN 0.732 8.962 8.230 0.000 0.000 0.452 22 N N 3.889 122.414 118.700 -0.292 0.000 2.605 22 N HA 0.012 4.753 4.740 0.001 0.000 0.282 22 N C 0.679 176.072 175.510 -0.195 0.000 1.206 22 N CA 0.388 53.331 53.050 -0.179 0.000 1.074 22 N CB 0.250 38.646 38.487 -0.152 0.000 1.434 22 N HN 0.750 9.130 8.380 0.000 0.000 0.506 23 Q N 1.085 120.792 119.800 -0.154 0.000 2.297 23 Q HA -0.235 4.106 4.340 0.001 0.000 0.208 23 Q C 1.323 177.234 176.000 -0.147 0.000 0.981 23 Q CA 1.144 56.852 55.803 -0.158 0.000 0.876 23 Q CB 0.034 28.720 28.738 -0.087 0.000 0.921 23 Q HN 0.788 9.058 8.270 0.000 0.000 0.446 24 Q N -0.041 119.691 119.800 -0.113 0.000 2.515 24 Q HA -0.052 4.289 4.340 0.001 0.000 0.212 24 Q C 1.045 176.976 176.000 -0.115 0.000 0.970 24 Q CA 0.658 56.403 55.803 -0.096 0.000 0.941 24 Q CB 0.200 28.898 28.738 -0.067 0.000 0.998 24 Q HN 0.010 8.280 8.270 0.000 0.000 0.518 25 K N 0.352 120.659 120.400 -0.156 0.000 2.353 25 K HA 0.275 4.596 4.320 0.001 0.000 0.195 25 K C 0.422 176.885 176.600 -0.228 0.000 1.031 25 K CA 0.006 56.194 56.287 -0.165 0.000 1.079 25 K CB 0.522 32.926 32.500 -0.159 0.000 0.857 25 K HN 0.246 8.496 8.250 0.000 0.000 0.535 26 L N 2.842 123.879 121.223 -0.310 0.000 2.452 26 L HA 0.085 4.426 4.340 0.001 0.000 0.267 26 L C -1.025 175.677 176.870 -0.281 0.000 1.188 26 L CA -1.100 53.465 54.840 -0.458 0.000 0.821 26 L CB 0.462 42.122 42.059 -0.665 0.000 1.102 26 L HN -0.097 8.133 8.230 0.000 0.000 0.470 27 P HA -0.005 4.415 4.420 0.000 0.000 0.245 27 P C 0.376 177.530 177.300 -0.244 0.000 1.203 27 P CA 0.327 63.190 63.100 -0.395 0.000 0.792 27 P CB 0.473 32.133 31.700 -0.067 0.000 0.997 28 D N 0.885 121.198 120.400 -0.146 0.000 2.092 28 D HA -0.091 4.550 4.640 0.001 0.000 0.193 28 D C 0.629 176.881 176.300 -0.079 0.000 0.994 28 D CA 1.385 55.339 54.000 -0.076 0.000 0.828 28 D CB 0.039 40.804 40.800 -0.058 0.000 0.963 28 D HN 0.390 8.760 8.370 0.000 0.000 0.450 29 E N -1.385 118.737 120.200 -0.131 0.000 2.299 29 E HA 0.477 4.828 4.350 0.001 0.000 0.265 29 E C -0.861 175.635 176.600 -0.173 0.000 0.911 29 E CA -0.503 55.834 56.400 -0.105 0.000 0.789 29 E CB 2.175 31.825 29.700 -0.082 0.000 1.246 29 E HN -0.266 8.094 8.360 0.000 0.000 0.427 30 T N 1.722 116.216 114.554 -0.101 0.000 3.250 30 T HA 0.153 4.504 4.350 0.001 0.000 0.391 30 T C -0.771 173.867 174.700 -0.104 0.000 1.502 30 T CA -0.549 61.472 62.100 -0.132 0.000 1.320 30 T CB 0.011 68.906 68.868 0.045 0.000 1.102 30 T HN 0.464 8.704 8.240 0.000 0.000 0.610 31 E N 2.312 122.397 120.200 -0.191 0.000 2.214 31 E HA 0.425 4.775 4.350 0.001 0.000 0.274 31 E C -1.417 175.024 176.600 -0.266 0.000 0.977 31 E CA -0.795 55.540 56.400 -0.108 0.000 0.827 31 E CB 1.193 30.852 29.700 -0.068 0.000 1.130 31 E HN 0.374 8.734 8.360 0.000 0.000 0.394 32 Y N 2.290 122.585 120.300 -0.008 0.000 2.328 32 Y HA 0.340 4.890 4.550 0.000 0.000 0.337 32 Y C -0.333 175.563 175.900 -0.006 0.000 0.966 32 Y CA -0.727 57.371 58.100 -0.004 0.000 1.136 32 Y CB 1.513 39.973 38.460 -0.000 0.000 1.170 32 Y HN 0.383 8.663 8.280 0.000 0.000 0.470 33 L N 3.334 124.610 121.223 0.089 0.000 2.322 33 L HA 0.490 4.830 4.340 0.001 0.000 0.279 33 L C -0.362 176.550 176.870 0.070 0.000 1.036 33 L CA -0.840 54.036 54.840 0.061 0.000 0.807 33 L CB 1.620 43.695 42.059 0.026 0.000 1.226 33 L HN 0.538 8.768 8.230 0.000 0.000 0.433 34 E N 2.736 122.963 120.200 0.045 0.000 2.134 34 E HA 0.451 4.802 4.350 0.001 0.000 0.278 34 E C -1.186 175.431 176.600 0.027 0.000 0.959 34 E CA -0.337 56.078 56.400 0.025 0.000 0.783 34 E CB 1.299 31.000 29.700 0.001 0.000 1.095 34 E HN 0.364 8.724 8.360 0.000 0.000 0.399 35 L N 3.453 124.697 121.223 0.034 0.000 2.272 35 L HA 0.334 4.675 4.340 0.001 0.000 0.289 35 L C 1.158 178.052 176.870 0.040 0.000 1.032 35 L CA -0.321 54.552 54.840 0.055 0.000 0.810 35 L CB 1.260 43.372 42.059 0.088 0.000 1.205 35 L HN 0.673 8.903 8.230 0.000 0.000 0.422 36 T N -2.526 112.053 114.554 0.041 0.000 2.975 36 T HA 0.184 4.535 4.350 0.001 0.000 0.257 36 T C 0.599 175.333 174.700 0.056 0.000 1.003 36 T CA 0.018 62.135 62.100 0.028 0.000 0.932 36 T CB 0.395 69.269 68.868 0.010 0.000 1.087 36 T HN 0.524 8.764 8.240 0.000 0.000 0.512 37 T N 1.303 115.905 114.554 0.081 0.000 2.887 37 T HA 0.397 4.748 4.350 0.001 0.000 0.292 37 T C 0.745 175.533 174.700 0.147 0.000 1.087 37 T CA -1.001 61.156 62.100 0.095 0.000 1.009 37 T CB 2.382 71.291 68.868 0.068 0.000 1.203 37 T HN 0.175 8.415 8.240 0.000 0.000 0.518 38 K N 0.409 120.909 120.400 0.166 0.000 2.280 38 K HA -0.084 4.237 4.320 0.001 0.000 0.202 38 K C 1.056 177.894 176.600 0.396 0.000 1.047 38 K CA 1.480 57.933 56.287 0.276 0.000 0.942 38 K CB -0.003 32.665 32.500 0.280 0.000 0.739 38 K HN 0.382 8.632 8.250 0.000 0.000 0.457 39 E N 1.390 121.751 120.200 0.269 0.000 2.158 39 E HA -0.089 4.262 4.350 0.001 0.000 0.191 39 E C 1.420 178.177 176.600 0.260 0.000 0.982 39 E CA 1.091 57.660 56.400 0.282 0.000 0.823 39 E CB 0.030 29.806 29.700 0.126 0.000 0.766 39 E HN 0.351 8.711 8.360 0.000 0.000 0.468 40 D N -0.243 120.269 120.400 0.187 0.000 2.183 40 D HA -0.085 4.556 4.640 0.001 0.000 0.203 40 D C 1.871 178.267 176.300 0.160 0.000 0.969 40 D CA 0.685 54.775 54.000 0.149 0.000 0.842 40 D CB -0.005 40.859 40.800 0.107 0.000 0.957 40 D HN 0.061 8.431 8.370 0.000 0.000 0.484 41 V N 0.926 120.953 119.914 0.188 0.000 2.323 41 V HA -0.184 3.936 4.120 0.001 0.000 0.244 41 V C 2.176 178.356 176.094 0.144 0.000 1.041 41 V CA 1.048 63.447 62.300 0.164 0.000 1.025 41 V CB -0.623 31.310 31.823 0.184 0.000 0.656 41 V HN 0.054 8.244 8.190 0.000 0.000 0.451 42 F N 1.840 121.805 119.950 0.026 0.000 2.095 42 F HA -0.258 4.269 4.527 -0.000 0.000 0.298 42 F C 2.214 178.001 175.800 -0.022 0.000 1.104 42 F CA 2.395 60.350 58.000 -0.075 0.000 1.232 42 F CB -0.258 38.643 39.000 -0.166 0.000 0.987 42 F HN 0.304 8.604 8.300 0.000 0.000 0.475 43 D N 0.001 120.563 120.400 0.271 0.000 2.144 43 D HA -0.132 4.508 4.640 0.001 0.000 0.200 43 D C 2.209 178.527 176.300 0.031 0.000 0.978 43 D CA 1.258 55.351 54.000 0.155 0.000 0.833 43 D CB -0.262 40.651 40.800 0.190 0.000 0.961 43 D HN 0.309 8.679 8.370 0.000 0.000 0.470 44 A N 0.266 123.112 122.820 0.043 0.000 1.908 44 A HA -0.141 4.180 4.320 0.001 0.000 0.218 44 A C 2.376 179.947 177.584 -0.021 0.000 1.181 44 A CA 1.373 53.422 52.037 0.019 0.000 0.627 44 A CB -0.800 18.227 19.000 0.046 0.000 0.818 44 A HN 0.398 8.548 8.150 0.000 0.000 0.445 45 I N -1.107 119.426 120.570 -0.061 0.000 2.233 45 I HA -0.159 4.012 4.170 0.001 0.000 0.243 45 I C 2.347 178.377 176.117 -0.145 0.000 1.093 45 I CA 0.891 62.131 61.300 -0.099 0.000 1.380 45 I CB -0.397 37.520 38.000 -0.139 0.000 1.067 45 I HN 0.146 8.356 8.210 0.000 0.000 0.413 46 V N 0.627 120.390 119.914 -0.251 0.000 2.490 46 V HA -0.271 3.850 4.120 0.001 0.000 0.250 46 V C 2.314 178.346 176.094 -0.103 0.000 1.061 46 V CA 2.353 64.511 62.300 -0.236 0.000 1.064 46 V CB -0.540 31.073 31.823 -0.351 0.000 0.670 46 V HN 0.468 8.658 8.190 0.000 0.000 0.461 47 T N -0.699 113.815 114.554 -0.066 0.000 3.081 47 T HA 0.213 4.564 4.350 0.001 0.000 0.255 47 T C 0.964 175.644 174.700 -0.034 0.000 1.113 47 T CA 0.325 62.405 62.100 -0.034 0.000 1.082 47 T CB -0.016 68.845 68.868 -0.012 0.000 0.939 47 T HN 0.375 8.615 8.240 0.000 0.000 0.506 48 L N -0.246 120.955 121.223 -0.036 0.000 4.236 48 L HA -0.216 4.125 4.340 0.001 0.000 0.399 48 L C 1.215 178.067 176.870 -0.029 0.000 1.146 48 L CA 0.290 55.113 54.840 -0.028 0.000 0.947 48 L CB -1.586 40.454 42.059 -0.031 0.000 2.149 48 L HN 0.228 8.458 8.230 0.000 0.000 0.705 49 K N -0.185 120.199 120.400 -0.027 0.000 2.288 49 K HA 0.183 4.503 4.320 0.001 0.000 0.201 49 K C 0.594 177.180 176.600 -0.024 0.000 1.048 49 K CA 0.851 57.118 56.287 -0.034 0.000 0.956 49 K CB 0.518 33.005 32.500 -0.021 0.000 0.746 49 K HN 0.214 8.464 8.250 0.000 0.000 0.461 50 V N 2.064 121.975 119.914 -0.004 0.000 2.686 50 V HA 0.329 4.450 4.120 0.001 0.000 0.306 50 V C -0.973 175.134 176.094 0.021 0.000 1.065 50 V CA -1.016 61.296 62.300 0.019 0.000 0.894 50 V CB 1.804 33.653 31.823 0.042 0.000 1.004 50 V HN 0.314 8.504 8.190 0.000 0.000 0.424 51 R N 2.309 122.831 120.500 0.036 0.000 2.762 51 R HA 0.923 5.264 4.340 0.001 0.000 0.271 51 R C -0.186 176.154 176.300 0.066 0.000 1.038 51 R CA -0.507 55.621 56.100 0.046 0.000 0.906 51 R CB 0.684 31.004 30.300 0.034 0.000 1.259 51 R HN 1.761 10.031 8.270 0.000 0.000 0.457 52 G N -0.698 108.149 108.800 0.079 0.000 3.421 52 G HA2 0.358 4.318 3.960 0.001 0.000 0.686 52 G HA3 0.358 4.318 3.960 0.001 0.000 0.686 52 G C 0.599 175.543 174.900 0.073 0.000 1.056 52 G CA 0.045 45.196 45.100 0.084 0.000 0.891 52 G HN 1.193 9.483 8.290 0.000 0.000 0.514 53 A N 4.146 127.003 122.820 0.062 0.000 1.894 53 A HA -0.081 4.240 4.320 0.001 0.000 0.220 53 A C 0.738 178.348 177.584 0.044 0.000 1.237 53 A CA 2.999 55.056 52.037 0.033 0.000 0.660 53 A CB -1.235 17.761 19.000 -0.007 0.000 0.835 53 A HN 0.624 8.774 8.150 0.000 0.000 0.461 54 P HA -0.095 4.325 4.420 0.000 0.000 0.215 54 P C 1.784 179.141 177.300 0.096 0.000 1.157 54 P CA 1.987 65.125 63.100 0.063 0.000 0.863 54 P CB -0.176 31.558 31.700 0.057 0.000 0.787 55 A N -0.792 122.087 122.820 0.098 0.000 1.933 55 A HA -0.184 4.136 4.320 0.001 0.000 0.218 55 A C 2.195 179.846 177.584 0.111 0.000 1.175 55 A CA 1.428 53.535 52.037 0.115 0.000 0.628 55 A CB -1.653 17.413 19.000 0.109 0.000 0.814 55 A HN 0.111 8.261 8.150 0.000 0.000 0.444 56 I N -0.437 120.186 120.570 0.088 0.000 2.179 56 I HA -0.199 3.972 4.170 0.001 0.000 0.242 56 I C 2.692 178.858 176.117 0.082 0.000 1.088 56 I CA 1.235 62.578 61.300 0.073 0.000 1.357 56 I CB -0.677 37.352 38.000 0.048 0.000 1.051 56 I HN 0.395 8.605 8.210 0.000 0.000 0.409 57 G N 0.784 109.647 108.800 0.106 0.000 2.448 57 G HA2 -0.146 3.815 3.960 0.001 0.000 0.219 57 G HA3 -0.146 3.815 3.960 0.001 0.000 0.219 57 G C 1.665 176.618 174.900 0.088 0.000 1.127 57 G CA 0.498 45.684 45.100 0.142 0.000 0.766 57 G HN 0.316 8.606 8.290 0.000 0.000 0.552 58 I N 0.346 120.966 120.570 0.083 0.000 2.296 58 I HA -0.079 4.092 4.170 0.001 0.000 0.242 58 I C 2.914 179.068 176.117 0.061 0.000 1.087 58 I CA 1.172 62.473 61.300 0.001 0.000 1.393 58 I CB -0.454 37.608 38.000 0.104 0.000 1.093 58 I HN 0.023 8.233 8.210 0.000 0.000 0.421 59 T N 1.074 115.741 114.554 0.189 0.000 2.759 59 T HA -0.179 4.172 4.350 0.001 0.000 0.269 59 T C 2.037 176.857 174.700 0.201 0.000 1.042 59 T CA 1.495 63.754 62.100 0.266 0.000 1.140 59 T CB -0.320 68.661 68.868 0.188 0.000 0.864 59 T HN 0.452 8.692 8.240 0.000 0.000 0.455 60 A N 1.518 124.402 122.820 0.107 0.000 1.877 60 A HA 0.135 4.456 4.320 0.001 0.000 0.216 60 A C 2.668 180.281 177.584 0.048 0.000 1.186 60 A CA 1.909 53.991 52.037 0.075 0.000 0.620 60 A CB -1.227 17.798 19.000 0.041 0.000 0.822 60 A HN 0.509 8.659 8.150 0.000 0.000 0.443 61 A N -0.785 122.006 122.820 -0.048 0.000 1.851 61 A HA -0.056 4.265 4.320 0.001 0.000 0.216 61 A C 1.915 179.452 177.584 -0.078 0.000 1.195 61 A CA 1.759 53.705 52.037 -0.152 0.000 0.622 61 A CB -0.944 17.850 19.000 -0.343 0.000 0.831 61 A HN 0.457 8.607 8.150 0.000 0.000 0.444 62 F N 0.631 120.618 119.950 0.062 0.000 2.202 62 F HA -0.078 4.450 4.527 0.002 0.000 0.301 62 F C 2.607 178.550 175.800 0.237 0.000 1.082 62 F CA 0.690 58.771 58.000 0.135 0.000 1.313 62 F CB -1.193 37.998 39.000 0.319 0.000 1.024 62 F HN 0.270 8.570 8.300 0.000 0.000 0.495 63 G N 0.040 109.051 108.800 0.352 0.000 2.459 63 G HA2 -0.266 3.695 3.960 0.001 0.000 0.217 63 G HA3 -0.266 3.695 3.960 0.001 0.000 0.217 63 G C 1.705 176.739 174.900 0.224 0.000 1.183 63 G CA 0.969 46.233 45.100 0.274 0.000 0.776 63 G HN 0.347 8.637 8.290 0.000 0.000 0.552 64 L N 1.297 122.612 121.223 0.153 0.000 2.083 64 L HA 0.143 4.484 4.340 0.001 0.000 0.209 64 L C 3.054 180.000 176.870 0.127 0.000 1.083 64 L CA 2.139 57.045 54.840 0.110 0.000 0.752 64 L CB -0.555 41.532 42.059 0.046 0.000 0.899 64 L HN 0.244 8.474 8.230 0.000 0.000 0.433 65 A N -0.755 122.151 122.820 0.144 0.000 1.902 65 A HA -0.178 4.143 4.320 0.001 0.000 0.217 65 A C 2.204 179.962 177.584 0.291 0.000 1.181 65 A CA 1.842 53.971 52.037 0.155 0.000 0.623 65 A CB -0.934 18.077 19.000 0.019 0.000 0.818 65 A HN 0.469 8.619 8.150 0.000 0.000 0.443 66 L N -0.254 121.218 121.223 0.415 0.000 2.027 66 L HA 0.023 4.364 4.340 0.001 0.000 0.206 66 L C 2.615 179.627 176.870 0.235 0.000 1.074 66 L CA 2.243 57.325 54.840 0.403 0.000 0.745 66 L CB -0.870 41.415 42.059 0.377 0.000 0.898 66 L HN 0.310 8.540 8.230 0.000 0.000 0.433 67 A N -0.502 122.434 122.820 0.194 0.000 1.969 67 A HA -0.022 4.299 4.320 0.001 0.000 0.218 67 A C 2.367 180.019 177.584 0.113 0.000 1.169 67 A CA 1.447 53.564 52.037 0.133 0.000 0.635 67 A CB -1.052 18.022 19.000 0.123 0.000 0.810 67 A HN 0.565 8.715 8.150 0.000 0.000 0.445 68 A N -0.104 122.795 122.820 0.132 0.000 2.121 68 A HA -0.070 4.251 4.320 0.001 0.000 0.218 68 A C 1.987 179.715 177.584 0.241 0.000 1.154 68 A CA 1.348 53.469 52.037 0.140 0.000 0.679 68 A CB -0.286 18.815 19.000 0.167 0.000 0.795 68 A HN 0.529 8.679 8.150 0.000 0.000 0.458 69 K N -0.017 120.505 120.400 0.203 0.000 2.155 69 K HA -0.081 4.240 4.320 0.001 0.000 0.203 69 K C 0.544 177.226 176.600 0.137 0.000 1.052 69 K CA 1.215 57.610 56.287 0.179 0.000 0.948 69 K CB -0.206 32.398 32.500 0.172 0.000 0.728 69 K HN 0.352 8.602 8.250 0.000 0.000 0.448 70 D N 0.925 121.393 120.400 0.113 0.000 2.347 70 D HA -0.044 4.596 4.640 0.001 0.000 0.215 70 D C 0.684 177.031 176.300 0.078 0.000 0.976 70 D CA 0.305 54.352 54.000 0.079 0.000 0.884 70 D CB 0.040 40.874 40.800 0.057 0.000 0.915 70 D HN 0.058 8.428 8.370 0.000 0.000 0.526 71 I N 2.305 122.941 120.570 0.110 0.000 2.452 71 I HA 0.016 4.187 4.170 0.001 0.000 0.287 71 I C 0.139 176.341 176.117 0.142 0.000 1.079 71 I CA -0.074 61.292 61.300 0.109 0.000 1.387 71 I CB 0.089 38.148 38.000 0.099 0.000 1.404 71 I HN -0.028 8.182 8.210 0.000 0.000 0.522 72 E N 6.626 126.882 120.200 0.093 0.000 2.145 72 E HA 0.508 4.859 4.350 0.001 0.000 0.262 72 E C -1.194 175.450 176.600 0.073 0.000 0.883 72 E CA -0.508 55.939 56.400 0.079 0.000 0.748 72 E CB 1.449 31.178 29.700 0.048 0.000 1.140 72 E HN 0.602 8.962 8.360 0.000 0.000 0.417 73 T N 1.924 116.528 114.554 0.083 0.000 2.827 73 T HA 0.112 4.462 4.350 0.001 0.000 0.328 73 T C -1.240 173.488 174.700 0.047 0.000 1.598 73 T CA -0.533 61.608 62.100 0.069 0.000 1.043 73 T CB 1.670 70.595 68.868 0.095 0.000 1.447 73 T HN 0.475 8.715 8.240 0.000 0.000 0.491 74 D N 1.404 121.820 120.400 0.027 0.000 2.433 74 D HA 0.180 4.821 4.640 0.001 0.000 0.211 74 D C 0.137 176.441 176.300 0.005 0.000 1.114 74 D CA -0.094 53.906 54.000 -0.000 0.000 0.837 74 D CB 0.267 41.064 40.800 -0.006 0.000 0.984 74 D HN 0.393 8.763 8.370 0.000 0.000 0.505 75 N N 1.183 119.904 118.700 0.034 0.000 2.602 75 N HA -0.028 4.713 4.740 0.001 0.000 0.238 75 N C 1.249 176.802 175.510 0.072 0.000 1.084 75 N CA -0.056 53.017 53.050 0.039 0.000 0.952 75 N CB 1.076 39.588 38.487 0.041 0.000 1.244 75 N HN -0.098 8.282 8.380 0.000 0.000 0.512 76 V N 3.559 123.497 119.914 0.040 0.000 2.660 76 V HA -0.234 3.887 4.120 0.001 0.000 0.257 76 V C 1.591 177.758 176.094 0.121 0.000 1.088 76 V CA 2.241 64.577 62.300 0.061 0.000 1.106 76 V CB -0.394 31.426 31.823 -0.006 0.000 0.686 76 V HN 0.673 8.863 8.190 0.000 0.000 0.481 77 T N -0.443 114.156 114.554 0.076 0.000 2.896 77 T HA -0.094 4.257 4.350 0.001 0.000 0.263 77 T C 1.748 176.489 174.700 0.067 0.000 1.050 77 T CA 1.346 63.482 62.100 0.060 0.000 1.140 77 T CB -0.104 68.782 68.868 0.031 0.000 0.877 77 T HN 0.592 8.832 8.240 0.000 0.000 0.457 78 E N 1.141 121.386 120.200 0.076 0.000 2.106 78 E HA -0.065 4.286 4.350 0.001 0.000 0.192 78 E C 1.713 178.362 176.600 0.081 0.000 0.984 78 E CA 0.887 57.324 56.400 0.062 0.000 0.806 78 E CB -0.586 29.149 29.700 0.059 0.000 0.750 78 E HN 0.465 8.825 8.360 0.000 0.000 0.458 79 F N 1.145 121.089 119.950 -0.010 0.000 2.126 79 F HA -0.156 4.372 4.527 0.001 0.000 0.299 79 F C 2.142 177.936 175.800 -0.009 0.000 1.096 79 F CA 1.880 59.875 58.000 -0.008 0.000 1.255 79 F CB -0.115 38.879 39.000 -0.011 0.000 0.997 79 F HN -0.051 8.249 8.300 0.000 0.000 0.479 80 R N -0.126 120.388 120.500 0.024 0.000 2.075 80 R HA -0.105 4.235 4.340 0.001 0.000 0.232 80 R C 2.432 178.660 176.300 -0.121 0.000 1.126 80 R CA 1.504 57.558 56.100 -0.077 0.000 0.963 80 R CB -0.386 29.926 30.300 0.020 0.000 0.858 80 R HN 0.266 8.536 8.270 0.000 0.000 0.435 81 R N 0.243 120.703 120.500 -0.067 0.000 2.094 81 R HA -0.112 4.228 4.340 0.001 0.000 0.239 81 R C 2.298 178.541 176.300 -0.093 0.000 1.137 81 R CA 1.442 57.506 56.100 -0.060 0.000 0.943 81 R CB -0.175 30.107 30.300 -0.031 0.000 0.850 81 R HN 0.167 8.437 8.270 0.000 0.000 0.433 82 R N 0.626 121.049 120.500 -0.129 0.000 2.115 82 R HA -0.058 4.283 4.340 0.001 0.000 0.230 82 R C 2.233 178.407 176.300 -0.209 0.000 1.111 82 R CA 0.620 56.631 56.100 -0.147 0.000 0.976 82 R CB -0.679 29.537 30.300 -0.141 0.000 0.870 82 R HN 0.283 8.553 8.270 0.000 0.000 0.445 83 L N 1.602 122.622 121.223 -0.339 0.000 2.141 83 L HA -0.144 4.197 4.340 0.001 0.000 0.209 83 L C 1.979 178.751 176.870 -0.163 0.000 1.094 83 L CA 1.866 56.496 54.840 -0.349 0.000 0.763 83 L CB -0.438 41.305 42.059 -0.527 0.000 0.908 83 L HN 0.066 8.296 8.230 0.000 0.000 0.437 84 E N 0.493 120.619 120.200 -0.122 0.000 2.077 84 E HA -0.223 4.128 4.350 0.001 0.000 0.193 84 E C 1.681 178.266 176.600 -0.025 0.000 0.989 84 E CA 1.675 58.039 56.400 -0.059 0.000 0.800 84 E CB -0.061 29.611 29.700 -0.047 0.000 0.746 84 E HN 0.414 8.774 8.360 0.000 0.000 0.452 85 D N -0.526 119.855 120.400 -0.031 0.000 2.224 85 D HA -0.035 4.605 4.640 0.001 0.000 0.205 85 D C 1.819 178.143 176.300 0.040 0.000 0.965 85 D CA 0.606 54.605 54.000 -0.001 0.000 0.852 85 D CB 0.000 40.785 40.800 -0.025 0.000 0.947 85 D HN 0.304 8.674 8.370 0.000 0.000 0.494 86 I N 0.325 120.908 120.570 0.021 0.000 2.333 86 I HA -0.165 4.006 4.170 0.001 0.000 0.246 86 I C 2.402 178.601 176.117 0.136 0.000 1.106 86 I CA 0.683 62.036 61.300 0.089 0.000 1.411 86 I CB -0.035 37.986 38.000 0.036 0.000 1.082 86 I HN -0.087 8.123 8.210 0.000 0.000 0.420 87 K N 0.743 121.178 120.400 0.058 0.000 2.057 87 K HA -0.265 4.056 4.320 0.001 0.000 0.207 87 K C 2.142 178.783 176.600 0.068 0.000 1.049 87 K CA 1.707 58.023 56.287 0.048 0.000 0.931 87 K CB -0.012 32.491 32.500 0.005 0.000 0.714 87 K HN 0.146 8.396 8.250 0.000 0.000 0.440 88 Q N -0.470 119.375 119.800 0.075 0.000 2.167 88 Q HA -0.165 4.175 4.340 0.001 0.000 0.202 88 Q C 1.767 177.852 176.000 0.142 0.000 0.970 88 Q CA 1.429 57.282 55.803 0.084 0.000 0.855 88 Q CB -0.343 28.435 28.738 0.067 0.000 0.911 88 Q HN 0.407 8.677 8.270 0.000 0.000 0.438 89 Y N -0.077 120.249 120.300 0.044 0.000 2.130 89 Y HA -0.139 4.411 4.550 0.000 0.000 0.287 89 Y C 1.567 177.587 175.900 0.200 0.000 1.124 89 Y CA 1.588 59.729 58.100 0.068 0.000 1.118 89 Y CB -0.426 38.035 38.460 0.001 0.000 0.994 89 Y HN 0.083 8.363 8.280 0.000 0.000 0.497 90 L N 0.513 121.734 121.223 -0.003 0.000 2.042 90 L HA -0.269 4.072 4.340 0.001 0.000 0.210 90 L C 2.219 179.072 176.870 -0.028 0.000 1.076 90 L CA 1.946 56.761 54.840 -0.040 0.000 0.749 90 L CB -0.829 41.267 42.059 0.061 0.000 0.893 90 L HN 0.284 8.514 8.230 0.000 0.000 0.432 91 N N -0.242 118.464 118.700 0.010 0.000 2.520 91 N HA -0.149 4.592 4.740 0.001 0.000 0.185 91 N C 1.752 177.262 175.510 -0.001 0.000 1.068 91 N CA 1.060 54.112 53.050 0.003 0.000 0.911 91 N CB 0.055 38.553 38.487 0.019 0.000 0.961 91 N HN 0.341 8.721 8.380 0.000 0.000 0.446 92 S N -1.717 114.001 115.700 0.031 0.000 2.593 92 S HA 0.018 4.489 4.470 0.001 0.000 0.217 92 S C 1.818 176.421 174.600 0.004 0.000 0.966 92 S CA 0.349 58.584 58.200 0.059 0.000 0.914 92 S CB -0.397 62.885 63.200 0.137 0.000 0.776 92 S HN 0.342 8.652 8.310 0.000 0.000 0.523 93 S N 2.241 117.841 115.700 -0.166 0.000 2.351 93 S HA -0.025 4.446 4.470 0.001 0.000 0.220 93 S C 0.880 175.314 174.600 -0.277 0.000 1.035 93 S CA 0.377 58.253 58.200 -0.540 0.000 1.031 93 S CB -0.447 62.323 63.200 -0.717 0.000 0.928 93 S HN 0.591 8.901 8.310 0.000 0.000 0.433 94 R N 1.056 121.457 120.500 -0.164 0.000 2.686 94 R HA 0.411 4.752 4.340 0.001 0.000 0.283 94 R C -2.160 174.101 176.300 -0.066 0.000 0.978 94 R CA -1.732 54.315 56.100 -0.088 0.000 0.897 94 R CB 1.918 32.180 30.300 -0.063 0.000 1.192 94 R HN 0.220 8.490 8.270 0.000 0.000 0.457 95 P HA -0.005 4.415 4.420 0.000 0.000 0.218 95 P C 0.728 177.951 177.300 -0.128 0.000 1.151 95 P CA 0.963 64.024 63.100 -0.066 0.000 0.850 95 P CB 0.403 32.081 31.700 -0.037 0.000 0.801 96 T N 1.144 115.560 114.554 -0.230 0.000 2.668 96 T HA 0.035 4.385 4.350 0.001 0.000 0.262 96 T C 1.301 175.782 174.700 -0.365 0.000 1.045 96 T CA 1.113 62.965 62.100 -0.413 0.000 1.152 96 T CB -1.027 67.258 68.868 -0.972 0.000 0.864 96 T HN 0.181 8.421 8.240 0.000 0.000 0.419 97 A N 1.598 124.218 122.820 -0.333 0.000 2.515 97 A HA 0.281 4.602 4.320 0.001 0.000 0.263 97 A C 1.371 178.890 177.584 -0.108 0.000 1.096 97 A CA -0.072 51.846 52.037 -0.198 0.000 0.769 97 A CB -0.556 18.380 19.000 -0.107 0.000 1.040 97 A HN 0.602 8.752 8.150 0.000 0.000 0.505 98 I N 2.349 122.862 120.570 -0.095 0.000 2.676 98 I HA -0.190 3.981 4.170 0.001 0.000 0.259 98 I C 1.477 177.634 176.117 0.066 0.000 1.194 98 I CA 1.196 62.480 61.300 -0.026 0.000 1.473 98 I CB -0.125 37.852 38.000 -0.039 0.000 1.096 98 I HN 0.817 9.027 8.210 0.000 0.000 0.443 99 N N 0.933 119.658 118.700 0.042 0.000 2.192 99 N HA -0.259 4.482 4.740 0.001 0.000 0.188 99 N C 1.596 177.261 175.510 0.259 0.000 1.013 99 N CA 1.436 54.583 53.050 0.160 0.000 0.863 99 N CB -0.316 38.210 38.487 0.065 0.000 0.990 99 N HN 0.310 8.690 8.380 0.000 0.000 0.430 100 L N 0.171 121.469 121.223 0.125 0.000 1.988 100 L HA -0.044 4.297 4.340 0.001 0.000 0.207 100 L C 2.257 179.180 176.870 0.087 0.000 1.071 100 L CA 1.690 56.582 54.840 0.085 0.000 0.744 100 L CB -1.327 40.745 42.059 0.023 0.000 0.893 100 L HN 0.130 8.360 8.230 0.000 0.000 0.433 101 S N -1.392 114.357 115.700 0.083 0.000 2.370 101 S HA -0.295 4.176 4.470 0.001 0.000 0.226 101 S C 1.888 176.548 174.600 0.100 0.000 1.033 101 S CA 1.571 59.812 58.200 0.069 0.000 1.011 101 S CB -0.871 62.364 63.200 0.057 0.000 0.852 101 S HN 0.646 8.956 8.310 0.000 0.000 0.457 102 W N 2.123 123.409 121.300 -0.024 0.000 2.333 102 W HA -0.127 4.534 4.660 0.001 0.000 0.316 102 W C 2.434 178.942 176.519 -0.017 0.000 1.215 102 W CA 2.029 59.363 57.345 -0.017 0.000 1.278 102 W CB -0.990 28.466 29.460 -0.006 0.000 1.154 102 W HN 0.342 8.522 8.180 0.000 0.000 0.486 103 A N 0.318 123.067 122.820 -0.118 0.000 1.877 103 A HA -0.170 4.151 4.320 0.001 0.000 0.216 103 A C 2.120 179.516 177.584 -0.314 0.000 1.186 103 A CA 1.966 53.755 52.037 -0.414 0.000 0.620 103 A CB -1.132 17.811 19.000 -0.095 0.000 0.822 103 A HN 0.417 8.567 8.150 0.000 0.000 0.443 104 L N -1.104 120.030 121.223 -0.148 0.000 2.046 104 L HA -0.165 4.176 4.340 0.001 0.000 0.208 104 L C 2.584 179.385 176.870 -0.114 0.000 1.077 104 L CA 1.654 56.434 54.840 -0.101 0.000 0.747 104 L CB -0.479 41.559 42.059 -0.036 0.000 0.896 104 L HN 0.353 8.583 8.230 0.000 0.000 0.432 105 E N 0.243 120.367 120.200 -0.126 0.000 2.204 105 E HA -0.208 4.143 4.350 0.001 0.000 0.194 105 E C 2.218 178.732 176.600 -0.144 0.000 0.989 105 E CA 0.892 57.233 56.400 -0.098 0.000 0.824 105 E CB 0.022 29.679 29.700 -0.073 0.000 0.756 105 E HN 0.223 8.583 8.360 0.000 0.000 0.477 106 R N -0.732 119.581 120.500 -0.313 0.000 2.075 106 R HA -0.035 4.306 4.340 0.001 0.000 0.226 106 R C 1.868 178.058 176.300 -0.182 0.000 1.114 106 R CA 0.777 56.668 56.100 -0.348 0.000 0.972 106 R CB -0.157 29.723 30.300 -0.700 0.000 0.869 106 R HN 0.167 8.437 8.270 0.000 0.000 0.437 107 L N 0.747 121.860 121.223 -0.183 0.000 2.027 107 L HA -0.107 4.233 4.340 0.001 0.000 0.206 107 L C 2.548 179.396 176.870 -0.036 0.000 1.074 107 L CA 2.039 56.816 54.840 -0.106 0.000 0.745 107 L CB -0.559 41.433 42.059 -0.111 0.000 0.898 107 L HN 0.318 8.548 8.230 0.000 0.000 0.433 108 S N -1.992 113.690 115.700 -0.031 0.000 2.419 108 S HA -0.292 4.179 4.470 0.001 0.000 0.233 108 S C 2.053 176.654 174.600 0.001 0.000 1.016 108 S CA 1.447 59.640 58.200 -0.012 0.000 0.974 108 S CB -0.680 62.508 63.200 -0.020 0.000 0.786 108 S HN 0.632 8.942 8.310 0.000 0.000 0.492 109 H N 1.321 120.355 119.070 -0.060 0.000 2.502 109 H HA 0.146 4.703 4.556 0.001 0.000 0.283 109 H C 2.156 177.462 175.328 -0.035 0.000 1.015 109 H CA 1.284 57.304 56.048 -0.046 0.000 1.298 109 H CB -0.041 29.683 29.762 -0.063 0.000 1.411 109 H HN 0.652 8.932 8.280 0.000 0.000 0.556 110 S N -0.316 115.419 115.700 0.059 0.000 2.522 110 S HA -0.065 4.406 4.470 0.001 0.000 0.227 110 S C 1.606 176.207 174.600 0.001 0.000 0.986 110 S CA 0.613 58.832 58.200 0.032 0.000 0.929 110 S CB -0.167 63.037 63.200 0.008 0.000 0.769 110 S HN 0.308 8.618 8.310 0.000 0.000 0.529 111 V N -1.916 117.997 119.914 -0.001 0.000 3.319 111 V HA 0.437 4.558 4.120 0.001 0.000 0.317 111 V C 1.570 177.655 176.094 -0.015 0.000 1.411 111 V CA 0.212 62.526 62.300 0.023 0.000 1.112 111 V CB -0.315 31.591 31.823 0.138 0.000 1.031 111 V HN 0.333 8.523 8.190 0.000 0.000 0.448 112 E N 2.025 122.164 120.200 -0.103 0.000 2.077 112 E HA -0.164 4.187 4.350 0.001 0.000 0.193 112 E C 1.254 177.797 176.600 -0.096 0.000 0.989 112 E CA 1.855 58.162 56.400 -0.155 0.000 0.800 112 E CB 0.104 29.576 29.700 -0.379 0.000 0.746 112 E HN 0.687 9.047 8.360 0.000 0.000 0.452 113 N N -0.196 118.455 118.700 -0.081 0.000 2.251 113 N HA 0.202 4.943 4.740 0.001 0.000 0.217 113 N C -1.063 174.426 175.510 -0.035 0.000 1.124 113 N CA 0.261 53.282 53.050 -0.049 0.000 0.843 113 N CB 1.129 39.592 38.487 -0.040 0.000 1.024 113 N HN 0.115 8.495 8.380 0.000 0.000 0.501 114 A N 0.715 123.515 122.820 -0.033 0.000 2.425 114 A HA 0.292 4.613 4.320 0.001 0.000 0.249 114 A C 1.272 178.832 177.584 -0.040 0.000 1.084 114 A CA -0.341 51.672 52.037 -0.041 0.000 0.781 114 A CB -0.075 18.894 19.000 -0.052 0.000 1.019 114 A HN 0.415 8.565 8.150 0.000 0.000 0.490 115 I N -0.162 120.379 120.570 -0.048 0.000 3.956 115 I HA 0.271 4.442 4.170 0.001 0.000 0.333 115 I C 0.516 176.598 176.117 -0.059 0.000 1.302 115 I CA 0.498 61.773 61.300 -0.042 0.000 1.122 115 I CB 0.022 38.001 38.000 -0.034 0.000 1.013 115 I HN 0.466 8.676 8.210 0.000 0.000 0.405 116 S N -0.199 115.446 115.700 -0.091 0.000 2.569 116 S HA 0.408 4.879 4.470 0.001 0.000 0.280 116 S C 0.229 174.699 174.600 -0.217 0.000 1.111 116 S CA -0.400 57.727 58.200 -0.121 0.000 0.887 116 S CB 2.535 65.673 63.200 -0.103 0.000 1.095 116 S HN 0.002 8.312 8.310 0.000 0.000 0.476 117 V N 3.425 123.189 119.914 -0.250 0.000 2.323 117 V HA -0.078 4.043 4.120 0.001 0.000 0.244 117 V C 2.221 178.043 176.094 -0.453 0.000 1.041 117 V CA 2.243 64.266 62.300 -0.461 0.000 1.025 117 V CB -1.025 30.620 31.823 -0.297 0.000 0.656 117 V HN 0.970 9.160 8.190 0.000 0.000 0.451 118 N N -0.461 118.088 118.700 -0.250 0.000 2.104 118 N HA -0.243 4.497 4.740 0.001 0.000 0.190 118 N C 1.897 177.292 175.510 -0.191 0.000 1.024 118 N CA 1.798 54.739 53.050 -0.182 0.000 0.853 118 N CB -0.078 38.343 38.487 -0.111 0.000 1.008 118 N HN 0.667 9.047 8.380 0.000 0.000 0.424 119 E N 1.061 121.148 120.200 -0.188 0.000 2.047 119 E HA -0.141 4.209 4.350 0.001 0.000 0.191 119 E C 1.927 178.413 176.600 -0.190 0.000 0.987 119 E CA 0.971 57.273 56.400 -0.163 0.000 0.799 119 E CB -0.063 29.562 29.700 -0.124 0.000 0.752 119 E HN 0.287 8.647 8.360 0.000 0.000 0.449 120 A N 1.430 124.094 122.820 -0.259 0.000 1.940 120 A HA -0.230 4.091 4.320 0.001 0.000 0.219 120 A C 2.082 179.572 177.584 -0.157 0.000 1.176 120 A CA 1.857 53.759 52.037 -0.226 0.000 0.631 120 A CB -0.403 18.360 19.000 -0.395 0.000 0.814 120 A HN 0.200 8.350 8.150 0.000 0.000 0.446 121 K N -1.101 119.141 120.400 -0.263 0.000 2.002 121 K HA -0.091 4.230 4.320 0.001 0.000 0.209 121 K C 2.112 178.672 176.600 -0.066 0.000 1.048 121 K CA 1.765 58.016 56.287 -0.060 0.000 0.930 121 K CB -0.485 31.972 32.500 -0.071 0.000 0.714 121 K HN 0.441 8.691 8.250 0.000 0.000 0.438 122 T N 1.484 115.945 114.554 -0.154 0.000 2.803 122 T HA -0.110 4.241 4.350 0.001 0.000 0.269 122 T C 1.508 175.999 174.700 -0.348 0.000 1.052 122 T CA 1.365 63.295 62.100 -0.285 0.000 1.136 122 T CB -0.274 68.392 68.868 -0.336 0.000 0.864 122 T HN 0.186 8.427 8.240 0.000 0.000 0.467 123 N N 1.138 119.722 118.700 -0.193 0.000 2.120 123 N HA 0.036 4.777 4.740 0.001 0.000 0.188 123 N C 1.815 177.290 175.510 -0.058 0.000 1.024 123 N CA 0.822 53.808 53.050 -0.106 0.000 0.852 123 N CB -0.590 37.867 38.487 -0.051 0.000 1.003 123 N HN 0.340 8.720 8.380 0.000 0.000 0.424 124 L N 0.027 121.231 121.223 -0.032 0.000 2.012 124 L HA -0.150 4.191 4.340 0.001 0.000 0.210 124 L C 2.155 178.979 176.870 -0.077 0.000 1.073 124 L CA 0.952 55.780 54.840 -0.019 0.000 0.748 124 L CB -0.620 41.473 42.059 0.058 0.000 0.891 124 L HN 0.010 8.240 8.230 0.000 0.000 0.431 125 V N -0.975 118.884 119.914 -0.093 0.000 2.343 125 V HA -0.295 3.826 4.120 0.001 0.000 0.247 125 V C 2.454 178.501 176.094 -0.080 0.000 1.051 125 V CA 1.737 63.919 62.300 -0.196 0.000 1.036 125 V CB -0.828 30.922 31.823 -0.122 0.000 0.654 125 V HN 0.419 8.609 8.190 0.000 0.000 0.451 126 H N -0.247 118.744 119.070 -0.132 0.000 2.421 126 H HA -0.109 4.448 4.556 0.001 0.000 0.298 126 H C 2.274 177.538 175.328 -0.105 0.000 1.087 126 H CA 1.711 57.702 56.048 -0.095 0.000 1.330 126 H CB -0.114 29.617 29.762 -0.051 0.000 1.388 126 H HN 0.438 8.718 8.280 0.000 0.000 0.526 127 E N 0.202 120.406 120.200 0.007 0.000 2.158 127 E HA 0.042 4.393 4.350 0.001 0.000 0.191 127 E C 2.195 178.695 176.600 -0.167 0.000 0.982 127 E CA 0.846 57.204 56.400 -0.069 0.000 0.823 127 E CB -0.074 29.581 29.700 -0.075 0.000 0.766 127 E HN 0.389 8.749 8.360 0.000 0.000 0.468 128 A N 0.236 122.910 122.820 -0.243 0.000 1.930 128 A HA -0.027 4.294 4.320 0.001 0.000 0.215 128 A C 2.187 179.472 177.584 -0.498 0.000 1.176 128 A CA 0.922 52.671 52.037 -0.479 0.000 0.632 128 A CB -0.467 18.152 19.000 -0.634 0.000 0.819 128 A HN 0.297 8.447 8.150 0.000 0.000 0.445 129 I N -0.662 119.798 120.570 -0.183 0.000 2.252 129 I HA -0.278 3.893 4.170 0.001 0.000 0.245 129 I C 2.746 178.860 176.117 -0.005 0.000 1.102 129 I CA 1.613 62.938 61.300 0.042 0.000 1.385 129 I CB -0.326 37.698 38.000 0.040 0.000 1.064 129 I HN 0.486 8.696 8.210 0.000 0.000 0.414 130 Q N 1.218 120.990 119.800 -0.046 0.000 2.135 130 Q HA -0.210 4.131 4.340 0.001 0.000 0.204 130 Q C 2.330 178.332 176.000 0.003 0.000 0.981 130 Q CA 1.592 57.385 55.803 -0.017 0.000 0.856 130 Q CB 0.021 28.746 28.738 -0.021 0.000 0.902 130 Q HN 0.525 8.795 8.270 0.000 0.000 0.425 131 I N 0.362 120.904 120.570 -0.047 0.000 2.142 131 I HA -0.347 3.824 4.170 0.001 0.000 0.240 131 I C 2.692 178.849 176.117 0.068 0.000 1.078 131 I CA 1.694 63.007 61.300 0.023 0.000 1.343 131 I CB -0.462 37.492 38.000 -0.078 0.000 1.046 131 I HN 0.415 8.625 8.210 0.000 0.000 0.405 132 Q N 0.950 120.763 119.800 0.021 0.000 2.030 132 Q HA -0.213 4.127 4.340 0.001 0.000 0.204 132 Q C 2.318 178.391 176.000 0.122 0.000 0.986 132 Q CA 2.511 58.383 55.803 0.115 0.000 0.843 132 Q CB -0.091 28.794 28.738 0.245 0.000 0.904 132 Q HN 0.328 8.598 8.270 0.000 0.000 0.420 133 V N 1.242 121.219 119.914 0.105 0.000 2.332 133 V HA -0.280 3.841 4.120 0.001 0.000 0.248 133 V C 2.067 178.213 176.094 0.087 0.000 1.055 133 V CA 2.338 64.693 62.300 0.091 0.000 1.038 133 V CB -0.640 31.222 31.823 0.065 0.000 0.651 133 V HN 0.437 8.627 8.190 0.000 0.000 0.450 134 E N -0.186 120.064 120.200 0.085 0.000 2.072 134 E HA -0.266 4.085 4.350 0.001 0.000 0.191 134 E C 1.990 178.643 176.600 0.090 0.000 0.985 134 E CA 1.435 57.885 56.400 0.084 0.000 0.801 134 E CB -0.224 29.538 29.700 0.103 0.000 0.750 134 E HN 0.677 9.037 8.360 0.000 0.000 0.452 135 D N 0.855 121.320 120.400 0.108 0.000 2.123 135 D HA -0.195 4.446 4.640 0.001 0.000 0.196 135 D C 1.623 177.997 176.300 0.124 0.000 0.992 135 D CA 1.326 55.388 54.000 0.104 0.000 0.833 135 D CB 0.130 41.000 40.800 0.116 0.000 0.954 135 D HN 0.188 8.558 8.370 0.000 0.000 0.455 136 E N -0.261 120.029 120.200 0.150 0.000 2.058 136 E HA -0.222 4.129 4.350 0.001 0.000 0.194 136 E C 1.985 178.690 176.600 0.176 0.000 0.997 136 E CA 1.144 57.684 56.400 0.233 0.000 0.801 136 E CB -0.115 29.723 29.700 0.229 0.000 0.746 136 E HN 0.222 8.582 8.360 0.000 0.000 0.450 137 E N 0.389 120.647 120.200 0.096 0.000 2.110 137 E HA -0.148 4.203 4.350 0.001 0.000 0.193 137 E C 2.112 178.716 176.600 0.008 0.000 0.988 137 E CA 1.870 58.288 56.400 0.030 0.000 0.804 137 E CB -0.297 29.417 29.700 0.023 0.000 0.745 137 E HN 0.377 8.737 8.360 0.000 0.000 0.458 138 T N -2.290 112.282 114.554 0.029 0.000 2.821 138 T HA -0.135 4.216 4.350 0.001 0.000 0.267 138 T C 2.324 177.033 174.700 0.015 0.000 1.046 138 T CA 1.191 63.297 62.100 0.009 0.000 1.139 138 T CB -1.007 67.867 68.868 0.010 0.000 0.871 138 T HN 0.184 8.424 8.240 0.000 0.000 0.454 139 C N 1.480 120.816 119.300 0.060 0.000 2.425 139 C HA 0.079 4.540 4.460 0.001 0.000 0.277 139 C C 3.123 178.119 174.990 0.009 0.000 1.280 139 C CA 0.388 59.457 59.018 0.084 0.000 1.744 139 C CB -1.116 26.751 27.740 0.212 0.000 1.989 139 C HN 0.575 8.805 8.230 0.000 0.000 0.491 140 R N 0.653 121.103 120.500 -0.082 0.000 2.070 140 R HA -0.090 4.251 4.340 0.001 0.000 0.233 140 R C 2.100 178.335 176.300 -0.109 0.000 1.137 140 R CA 1.284 57.264 56.100 -0.201 0.000 0.945 140 R CB -0.509 29.630 30.300 -0.269 0.000 0.845 140 R HN 0.513 8.783 8.270 0.000 0.000 0.430 141 L N 0.390 121.567 121.223 -0.077 0.000 2.083 141 L HA -0.162 4.179 4.340 0.001 0.000 0.209 141 L C 2.412 179.244 176.870 -0.064 0.000 1.083 141 L CA 1.104 55.904 54.840 -0.067 0.000 0.752 141 L CB -0.372 41.652 42.059 -0.058 0.000 0.899 141 L HN 0.189 8.419 8.230 0.000 0.000 0.433 142 I N -0.140 120.400 120.570 -0.050 0.000 2.252 142 I HA -0.186 3.985 4.170 0.001 0.000 0.245 142 I C 2.588 178.665 176.117 -0.066 0.000 1.102 142 I CA 1.420 62.689 61.300 -0.051 0.000 1.385 142 I CB -0.654 37.331 38.000 -0.026 0.000 1.064 142 I HN 0.256 8.466 8.210 0.000 0.000 0.414 143 G N -0.487 108.283 108.800 -0.049 0.000 2.408 143 G HA2 -0.274 3.687 3.960 0.001 0.000 0.217 143 G HA3 -0.274 3.687 3.960 0.001 0.000 0.217 143 G C 1.567 176.434 174.900 -0.054 0.000 1.150 143 G CA 0.391 45.464 45.100 -0.044 0.000 0.776 143 G HN 0.376 8.666 8.290 0.000 0.000 0.542 144 Q N -0.007 119.756 119.800 -0.062 0.000 2.172 144 Q HA -0.058 4.283 4.340 0.001 0.000 0.200 144 Q C 2.129 178.077 176.000 -0.087 0.000 0.964 144 Q CA 1.050 56.815 55.803 -0.064 0.000 0.855 144 Q CB 0.013 28.712 28.738 -0.065 0.000 0.918 144 Q HN 0.366 8.636 8.270 0.000 0.000 0.444 145 N N -0.045 118.593 118.700 -0.104 0.000 2.368 145 N HA -0.006 4.735 4.740 0.001 0.000 0.176 145 N C 1.364 176.751 175.510 -0.205 0.000 1.021 145 N CA 1.049 54.019 53.050 -0.133 0.000 0.888 145 N CB -0.122 38.295 38.487 -0.116 0.000 0.995 145 N HN 0.237 8.617 8.380 0.000 0.000 0.437 146 A N 0.867 123.554 122.820 -0.222 0.000 2.014 146 A HA -0.008 4.312 4.320 0.001 0.000 0.218 146 A C 2.102 179.398 177.584 -0.480 0.000 1.163 146 A CA 0.548 52.364 52.037 -0.368 0.000 0.652 146 A CB -0.443 18.393 19.000 -0.273 0.000 0.808 146 A HN 0.178 8.328 8.150 0.000 0.000 0.449 147 L N 0.749 121.824 121.223 -0.246 0.000 2.131 147 L HA -0.206 4.135 4.340 0.001 0.000 0.210 147 L C 2.598 179.345 176.870 -0.205 0.000 1.092 147 L CA 2.417 57.172 54.840 -0.142 0.000 0.759 147 L CB -0.597 41.452 42.059 -0.017 0.000 0.903 147 L HN 0.685 8.915 8.230 0.000 0.000 0.435 148 Q N -1.098 118.565 119.800 -0.228 0.000 2.500 148 Q HA -0.160 4.181 4.340 0.001 0.000 0.213 148 Q C 1.860 177.703 176.000 -0.261 0.000 0.974 148 Q CA 1.154 56.846 55.803 -0.185 0.000 0.918 148 Q CB -0.470 28.179 28.738 -0.147 0.000 0.980 148 Q HN 0.550 8.820 8.270 0.000 0.000 0.505 149 L N -0.219 120.687 121.223 -0.527 0.000 2.418 149 L HA 0.128 4.469 4.340 0.001 0.000 0.218 149 L C 0.217 176.853 176.870 -0.390 0.000 1.125 149 L CA 0.251 54.705 54.840 -0.644 0.000 0.835 149 L CB 0.068 41.388 42.059 -1.233 0.000 0.953 149 L HN 0.056 8.286 8.230 0.000 0.000 0.454 150 F N 0.050 119.985 119.950 -0.025 0.000 2.557 150 F HA 0.526 5.053 4.527 0.001 0.000 0.336 150 F C 0.287 176.085 175.800 -0.003 0.000 1.058 150 F CA -1.463 56.544 58.000 0.011 0.000 0.988 150 F CB 0.890 39.907 39.000 0.028 0.000 1.275 150 F HN -0.217 8.083 8.300 0.000 0.000 0.488 151 K N 0.012 120.542 120.400 0.218 0.000 2.480 151 K HA 0.454 4.775 4.320 0.001 0.000 0.258 151 K C -1.345 175.274 176.600 0.032 0.000 0.990 151 K CA -1.001 55.343 56.287 0.095 0.000 0.857 151 K CB 1.802 34.343 32.500 0.068 0.000 1.384 151 K HN 0.545 8.795 8.250 0.000 0.000 0.446 152 K N 0.206 120.608 120.400 0.004 0.000 2.530 152 K HA 0.042 4.363 4.320 0.001 0.000 0.280 152 K C 0.895 177.447 176.600 -0.081 0.000 1.004 152 K CA 1.810 58.073 56.287 -0.041 0.000 1.071 152 K CB -0.262 32.225 32.500 -0.021 0.000 0.876 152 K HN 0.948 9.197 8.250 0.000 0.000 0.487 153 G N 2.190 110.881 108.800 -0.181 0.000 2.212 153 G HA2 -0.298 3.663 3.960 0.001 0.000 0.266 153 G HA3 -0.298 3.663 3.960 0.001 0.000 0.266 153 G C -0.206 174.541 174.900 -0.255 0.000 0.978 153 G CA 0.541 45.495 45.100 -0.243 0.000 0.632 153 G HN 0.837 9.127 8.290 0.000 0.000 0.537 154 D N -0.031 120.253 120.400 -0.194 0.000 2.339 154 D HA 0.531 5.171 4.640 0.001 0.000 0.245 154 D C 0.435 176.605 176.300 -0.216 0.000 1.115 154 D CA -0.411 53.503 54.000 -0.144 0.000 0.917 154 D CB 0.498 41.258 40.800 -0.067 0.000 1.192 154 D HN 0.404 8.774 8.370 0.000 0.000 0.428 155 R N 1.152 121.589 120.500 -0.105 0.000 2.255 155 R HA 0.442 4.783 4.340 0.001 0.000 0.326 155 R C -0.572 175.667 176.300 -0.101 0.000 0.986 155 R CA -0.692 55.387 56.100 -0.035 0.000 0.847 155 R CB 1.093 31.470 30.300 0.128 0.000 1.111 155 R HN 0.420 8.690 8.270 0.000 0.000 0.452 156 I N 3.854 124.322 120.570 -0.171 0.000 2.378 156 I HA 0.311 4.482 4.170 0.001 0.000 0.291 156 I C 0.078 176.179 176.117 -0.027 0.000 0.992 156 I CA -0.690 60.504 61.300 -0.178 0.000 1.154 156 I CB 1.455 39.232 38.000 -0.372 0.000 1.315 156 I HN 0.656 8.866 8.210 0.000 0.000 0.448 157 M N 5.274 124.890 119.600 0.027 0.000 2.367 157 M HA 0.483 4.964 4.480 0.001 0.000 0.339 157 M C -0.299 176.060 176.300 0.099 0.000 1.177 157 M CA 0.267 55.612 55.300 0.076 0.000 1.068 157 M CB 1.669 34.293 32.600 0.039 0.000 1.602 157 M HN 0.751 9.041 8.290 0.000 0.000 0.457 158 T N 3.630 118.253 114.554 0.115 0.000 2.787 158 T HA 0.720 5.071 4.350 0.001 0.000 0.297 158 T C -1.776 172.986 174.700 0.104 0.000 1.221 158 T CA -0.713 61.458 62.100 0.118 0.000 1.006 158 T CB 1.448 70.419 68.868 0.172 0.000 1.328 158 T HN 0.758 8.998 8.240 0.000 0.000 0.509 159 I N 0.742 121.369 120.570 0.095 0.000 2.994 159 I HA 0.579 4.750 4.170 0.001 0.000 0.306 159 I C 0.543 176.705 176.117 0.075 0.000 1.195 159 I CA -0.316 61.036 61.300 0.087 0.000 1.001 159 I CB 1.691 39.751 38.000 0.100 0.000 1.244 159 I HN 1.160 9.370 8.210 0.000 0.000 0.437 160 C N 3.675 123.010 119.300 0.058 0.000 0.168 160 C HA -0.285 4.175 4.460 0.001 0.000 0.017 160 C C -0.047 174.983 174.990 0.067 0.000 0.171 160 C CA 0.897 59.944 59.018 0.049 0.000 0.499 160 C CB -1.346 26.422 27.740 0.048 0.000 3.212 160 C HN 1.063 9.293 8.230 0.000 0.000 1.118 161 N N 0.421 119.164 118.700 0.072 0.000 2.675 161 N HA 0.591 5.331 4.740 0.001 0.000 0.254 161 N C -0.646 174.919 175.510 0.093 0.000 1.224 161 N CA 0.525 53.630 53.050 0.092 0.000 0.777 161 N CB 1.049 39.599 38.487 0.105 0.000 1.256 161 N HN 1.148 9.528 8.380 0.000 0.000 0.531 162 A N 1.845 124.712 122.820 0.079 0.000 3.175 162 A HA 0.685 5.006 4.320 0.001 0.000 0.289 162 A C 0.616 178.248 177.584 0.080 0.000 1.429 162 A CA -0.063 52.015 52.037 0.068 0.000 1.155 162 A CB -0.505 18.517 19.000 0.037 0.000 1.169 162 A HN 0.602 8.752 8.150 0.000 0.000 0.574 163 G N -0.570 108.308 108.800 0.131 0.000 3.217 163 G HA2 0.428 4.388 3.960 0.001 0.000 0.213 163 G HA3 0.428 4.388 3.960 0.001 0.000 0.213 163 G C 1.177 176.209 174.900 0.220 0.000 1.294 163 G CA 0.414 45.632 45.100 0.197 0.000 0.987 163 G HN 0.750 9.040 8.290 0.000 0.000 0.584 164 S N -0.682 115.186 115.700 0.281 0.000 2.420 164 S HA -0.196 4.274 4.470 0.001 0.000 0.237 164 S C 2.135 176.830 174.600 0.159 0.000 1.023 164 S CA 1.841 60.162 58.200 0.202 0.000 0.991 164 S CB -0.586 62.721 63.200 0.179 0.000 0.792 164 S HN 0.854 9.164 8.310 0.000 0.000 0.488 165 I N -2.248 118.441 120.570 0.199 0.000 3.883 165 I HA 0.579 4.750 4.170 0.001 0.000 0.326 165 I C 1.658 177.862 176.117 0.145 0.000 1.283 165 I CA 0.256 61.666 61.300 0.183 0.000 1.161 165 I CB 0.034 38.179 38.000 0.242 0.000 1.012 165 I HN 0.258 8.468 8.210 0.000 0.000 0.421 166 A N 1.141 124.044 122.820 0.139 0.000 2.423 166 A HA 0.436 4.757 4.320 0.001 0.000 0.246 166 A C 0.884 178.532 177.584 0.107 0.000 1.278 166 A CA 0.594 52.699 52.037 0.114 0.000 0.903 166 A CB -0.503 18.562 19.000 0.108 0.000 0.997 166 A HN 0.584 8.734 8.150 0.000 0.000 0.510 167 T N -5.301 109.322 114.554 0.115 0.000 2.671 167 T HA 0.388 4.739 4.350 0.001 0.000 0.300 167 T C 1.189 175.957 174.700 0.112 0.000 1.238 167 T CA 0.388 62.555 62.100 0.112 0.000 1.020 167 T CB 0.603 69.541 68.868 0.117 0.000 1.503 167 T HN 0.409 8.649 8.240 0.000 0.000 0.497 168 S N 0.643 116.411 115.700 0.114 0.000 2.365 168 S HA -0.038 4.433 4.470 0.001 0.000 0.225 168 S C 0.839 175.454 174.600 0.025 0.000 1.039 168 S CA 1.058 59.319 58.200 0.101 0.000 1.033 168 S CB -0.928 62.341 63.200 0.114 0.000 0.887 168 S HN 1.175 9.485 8.310 0.000 0.000 0.447 169 R N -3.458 117.035 120.500 -0.012 0.000 2.829 169 R HA 0.396 4.737 4.340 0.001 0.000 0.284 169 R C -0.544 175.712 176.300 -0.075 0.000 1.006 169 R CA -0.523 55.461 56.100 -0.193 0.000 0.844 169 R CB -0.169 29.798 30.300 -0.556 0.000 1.309 169 R HN 0.024 8.294 8.270 0.000 0.000 0.494 170 Y N -0.876 119.503 120.300 0.132 0.000 2.760 170 Y HA -0.292 4.259 4.550 0.002 0.000 0.484 170 Y C 1.083 177.130 175.900 0.244 0.000 1.172 170 Y CA 2.385 60.634 58.100 0.250 0.000 2.808 170 Y CB -2.093 36.467 38.460 0.167 0.000 0.948 170 Y HN 1.712 9.992 8.280 0.000 0.000 0.551 171 G N -1.128 107.866 108.800 0.322 0.000 2.631 171 G HA2 0.226 4.186 3.960 0.001 0.000 0.504 171 G HA3 0.226 4.186 3.960 0.001 0.000 0.504 171 G C 0.434 175.422 174.900 0.148 0.000 1.306 171 G CA 0.628 45.860 45.100 0.220 0.000 0.897 171 G HN 1.093 9.383 8.290 0.000 0.000 0.520 172 T N -3.156 111.442 114.554 0.074 0.000 3.397 172 T HA 0.595 4.945 4.350 0.001 0.000 0.233 172 T C 2.618 177.285 174.700 -0.054 0.000 0.969 172 T CA 2.084 64.195 62.100 0.019 0.000 1.316 172 T CB -0.473 68.405 68.868 0.016 0.000 1.175 172 T HN 2.067 10.307 8.240 0.000 0.000 0.381 173 A N 1.294 124.070 122.820 -0.073 0.000 1.930 173 A HA 0.275 4.596 4.320 0.001 0.000 0.217 173 A C 2.353 179.685 177.584 -0.420 0.000 1.175 173 A CA 1.222 53.164 52.037 -0.158 0.000 0.627 173 A CB -1.029 17.921 19.000 -0.083 0.000 0.815 173 A HN 0.563 8.713 8.150 0.000 0.000 0.443 174 L N -1.198 119.808 121.223 -0.362 0.000 2.446 174 L HA 0.043 4.384 4.340 0.001 0.000 0.219 174 L C 2.879 179.462 176.870 -0.477 0.000 1.116 174 L CA 0.488 54.946 54.840 -0.636 0.000 0.844 174 L CB -0.576 41.362 42.059 -0.202 0.000 0.970 174 L HN 0.383 8.613 8.230 0.000 0.000 0.457 175 A N 1.540 124.280 122.820 -0.134 0.000 1.915 175 A HA -0.186 4.135 4.320 0.001 0.000 0.220 175 A C -0.031 177.541 177.584 -0.020 0.000 1.198 175 A CA 2.059 54.136 52.037 0.066 0.000 0.647 175 A CB -1.828 17.216 19.000 0.074 0.000 0.825 175 A HN 0.283 8.433 8.150 0.000 0.000 0.456 176 P HA -0.129 4.291 4.420 0.000 0.000 0.218 176 P C 0.958 178.335 177.300 0.129 0.000 1.148 176 P CA 1.004 64.097 63.100 -0.011 0.000 0.822 176 P CB -0.156 31.566 31.700 0.038 0.000 0.784 177 F N -2.374 117.529 119.950 -0.078 0.000 2.146 177 F HA -0.111 4.416 4.527 0.001 0.000 0.298 177 F C 2.221 177.885 175.800 -0.227 0.000 1.096 177 F CA 0.542 58.420 58.000 -0.204 0.000 1.275 177 F CB -2.025 36.757 39.000 -0.364 0.000 1.008 177 F HN -0.050 8.250 8.300 0.000 0.000 0.480 178 Y N -0.232 120.036 120.300 -0.055 0.000 2.181 178 Y HA -0.162 4.389 4.550 0.001 0.000 0.288 178 Y C 2.399 178.240 175.900 -0.099 0.000 1.146 178 Y CA 0.912 58.828 58.100 -0.306 0.000 1.164 178 Y CB -1.035 36.886 38.460 -0.898 0.000 0.982 178 Y HN 0.025 8.305 8.280 0.000 0.000 0.515 179 L N 0.206 121.512 121.223 0.138 0.000 2.005 179 L HA -0.062 4.278 4.340 0.001 0.000 0.207 179 L C 2.395 179.322 176.870 0.094 0.000 1.072 179 L CA 2.002 56.910 54.840 0.114 0.000 0.744 179 L CB -1.291 40.815 42.059 0.079 0.000 0.895 179 L HN 0.106 8.336 8.230 0.000 0.000 0.433 180 A N -0.573 122.308 122.820 0.102 0.000 1.948 180 A HA -0.276 4.045 4.320 0.001 0.000 0.220 180 A C 2.439 180.057 177.584 0.056 0.000 1.177 180 A CA 2.052 54.140 52.037 0.085 0.000 0.636 180 A CB -0.708 18.358 19.000 0.109 0.000 0.815 180 A HN 0.471 8.621 8.150 0.000 0.000 0.449 181 K N -0.860 119.575 120.400 0.059 0.000 2.057 181 K HA -0.142 4.179 4.320 0.001 0.000 0.207 181 K C 2.010 178.655 176.600 0.074 0.000 1.049 181 K CA 1.391 57.710 56.287 0.053 0.000 0.931 181 K CB -0.184 32.352 32.500 0.060 0.000 0.714 181 K HN 0.458 8.708 8.250 0.000 0.000 0.440 182 Q N 0.520 120.377 119.800 0.096 0.000 2.291 182 Q HA -0.125 4.215 4.340 0.001 0.000 0.205 182 Q C 1.245 177.283 176.000 0.064 0.000 0.970 182 Q CA 1.237 57.097 55.803 0.095 0.000 0.876 182 Q CB 0.079 28.881 28.738 0.107 0.000 0.935 182 Q HN 0.500 8.770 8.270 0.000 0.000 0.455 183 K N -0.237 120.195 120.400 0.053 0.000 2.399 183 K HA 0.130 4.451 4.320 0.001 0.000 0.204 183 K C -0.468 176.150 176.600 0.030 0.000 1.023 183 K CA -0.123 56.186 56.287 0.037 0.000 1.127 183 K CB 0.559 33.079 32.500 0.032 0.000 0.856 183 K HN -0.218 8.032 8.250 0.000 0.000 0.514 184 D N 1.478 121.896 120.400 0.031 0.000 2.723 184 D HA -0.179 4.462 4.640 0.001 0.000 0.236 184 D C -0.779 175.527 176.300 0.010 0.000 1.138 184 D CA 0.677 54.689 54.000 0.020 0.000 0.676 184 D CB -0.934 39.878 40.800 0.019 0.000 1.069 184 D HN 0.422 8.792 8.370 0.000 0.000 0.430 185 L N 0.547 121.776 121.223 0.010 0.000 2.353 185 L HA 0.403 4.744 4.340 0.001 0.000 0.269 185 L C 1.121 177.970 176.870 -0.036 0.000 1.085 185 L CA -0.322 54.519 54.840 0.001 0.000 0.938 185 L CB 0.462 42.538 42.059 0.028 0.000 1.312 185 L HN 0.092 8.322 8.230 0.000 0.000 0.429 186 G N 5.615 114.379 108.800 -0.059 0.000 2.115 186 G HA2 0.138 4.099 3.960 0.001 0.000 0.244 186 G HA3 0.138 4.099 3.960 0.001 0.000 0.244 186 G C -0.567 174.176 174.900 -0.263 0.000 1.105 186 G CA -0.005 45.021 45.100 -0.123 0.000 0.893 186 G HN 0.572 8.862 8.290 0.000 0.000 0.443 187 L N 3.110 124.144 121.223 -0.315 0.000 2.422 187 L HA 0.395 4.736 4.340 0.001 0.000 0.264 187 L C -1.021 175.605 176.870 -0.408 0.000 0.984 187 L CA -1.130 53.446 54.840 -0.441 0.000 0.819 187 L CB 2.623 44.474 42.059 -0.348 0.000 1.330 187 L HN 0.508 8.738 8.230 0.000 0.000 0.410 188 H N 3.334 122.235 119.070 -0.282 0.000 2.646 188 H HA 0.438 4.995 4.556 0.001 0.000 0.328 188 H C -0.903 174.203 175.328 -0.371 0.000 0.998 188 H CA -0.728 55.141 56.048 -0.298 0.000 1.225 188 H CB 2.360 32.020 29.762 -0.169 0.000 1.457 188 H HN 0.374 8.654 8.280 0.000 0.000 0.505 189 I N 2.865 123.196 120.570 -0.398 0.000 2.359 189 I HA 0.286 4.456 4.170 0.001 0.000 0.294 189 I C -1.349 174.541 176.117 -0.379 0.000 0.987 189 I CA -0.541 60.495 61.300 -0.440 0.000 1.225 189 I CB 0.484 38.052 38.000 -0.719 0.000 1.366 189 I HN 0.305 8.515 8.210 0.000 0.000 0.466 190 Y N 6.516 126.724 120.300 -0.153 0.000 2.342 190 Y HA 0.724 5.275 4.550 0.001 0.000 0.338 190 Y C 0.292 176.163 175.900 -0.049 0.000 0.965 190 Y CA -0.604 57.443 58.100 -0.089 0.000 1.159 190 Y CB 1.684 40.096 38.460 -0.081 0.000 1.157 190 Y HN 0.737 9.017 8.280 0.000 0.000 0.486 191 A N 3.010 125.863 122.820 0.056 0.000 2.271 191 A HA 0.548 4.869 4.320 0.001 0.000 0.317 191 A C -0.748 176.879 177.584 0.072 0.000 1.245 191 A CA -0.635 51.440 52.037 0.064 0.000 0.857 191 A CB 0.057 19.080 19.000 0.038 0.000 1.175 191 A HN 0.879 9.029 8.150 0.000 0.000 0.512 192 C N 2.869 122.214 119.300 0.076 0.000 2.576 192 C HA 0.187 4.647 4.460 0.001 0.000 0.401 192 C C 2.026 177.046 174.990 0.050 0.000 1.314 192 C CA 0.016 59.072 59.018 0.064 0.000 1.855 192 C CB -0.489 27.289 27.740 0.064 0.000 2.537 192 C HN 1.036 9.266 8.230 0.000 0.000 0.578 193 E N 1.328 121.552 120.200 0.041 0.000 2.273 193 E HA -0.193 4.158 4.350 0.001 0.000 0.198 193 E C 0.276 176.889 176.600 0.023 0.000 1.002 193 E CA 1.437 57.856 56.400 0.031 0.000 0.828 193 E CB -0.415 29.299 29.700 0.023 0.000 0.747 193 E HN 0.802 9.162 8.360 0.000 0.000 0.491 194 T N 1.399 115.965 114.554 0.020 0.000 3.645 194 T HA -0.133 4.218 4.350 0.001 0.000 0.400 194 T C -0.074 174.616 174.700 -0.017 0.000 0.764 194 T CA 0.465 62.569 62.100 0.005 0.000 2.104 194 T CB -0.991 67.882 68.868 0.008 0.000 1.737 194 T HN 0.269 8.509 8.240 0.000 0.000 0.763 195 R N 1.784 122.273 120.500 -0.018 0.000 2.827 195 R HA 0.169 4.510 4.340 0.001 0.000 0.269 195 R C -0.944 175.320 176.300 -0.059 0.000 1.048 195 R CA -1.387 54.695 56.100 -0.031 0.000 1.173 195 R CB 0.098 30.384 30.300 -0.022 0.000 1.070 195 R HN 0.288 8.558 8.270 0.000 0.000 0.498 196 P HA 0.040 4.460 4.420 0.000 0.000 0.238 196 P C 0.979 178.248 177.300 -0.051 0.000 1.183 196 P CA 0.417 63.484 63.100 -0.055 0.000 0.813 196 P CB 0.399 32.062 31.700 -0.061 0.000 0.944 197 V N 0.709 120.585 119.914 -0.064 0.000 2.809 197 V HA -0.060 4.061 4.120 0.001 0.000 0.256 197 V C 1.507 177.577 176.094 -0.040 0.000 1.080 197 V CA 0.731 62.997 62.300 -0.056 0.000 1.102 197 V CB -1.224 30.558 31.823 -0.069 0.000 0.705 197 V HN 0.046 8.236 8.190 0.000 0.000 0.475 198 L N -0.758 120.446 121.223 -0.032 0.000 3.598 198 L HA -0.316 4.025 4.340 0.001 0.000 0.422 198 L C 1.470 178.338 176.870 -0.003 0.000 1.262 198 L CA -0.090 54.741 54.840 -0.014 0.000 0.889 198 L CB -1.729 40.322 42.059 -0.012 0.000 1.857 198 L HN 0.317 8.547 8.230 0.000 0.000 0.858 199 Q N 0.307 120.106 119.800 -0.003 0.000 2.084 199 Q HA -0.109 4.232 4.340 0.001 0.000 0.202 199 Q C 2.172 178.201 176.000 0.049 0.000 0.978 199 Q CA 2.172 57.986 55.803 0.019 0.000 0.844 199 Q CB -0.169 28.579 28.738 0.017 0.000 0.898 199 Q HN 0.710 8.980 8.270 0.000 0.000 0.426 200 G N -0.487 108.341 108.800 0.046 0.000 2.408 200 G HA2 -0.261 3.700 3.960 0.001 0.000 0.217 200 G HA3 -0.261 3.700 3.960 0.001 0.000 0.217 200 G C 1.526 176.466 174.900 0.067 0.000 1.150 200 G CA 0.957 46.095 45.100 0.063 0.000 0.776 200 G HN 0.414 8.704 8.290 0.000 0.000 0.542 201 S N 0.055 115.785 115.700 0.050 0.000 2.357 201 S HA 0.002 4.473 4.470 0.001 0.000 0.221 201 S C 2.431 177.070 174.600 0.064 0.000 1.031 201 S CA 1.074 59.304 58.200 0.048 0.000 0.982 201 S CB -0.144 63.073 63.200 0.029 0.000 0.853 201 S HN 0.399 8.709 8.310 0.000 0.000 0.458 202 R N -0.128 120.400 120.500 0.046 0.000 2.140 202 R HA 0.276 4.617 4.340 0.001 0.000 0.213 202 R C 2.035 178.377 176.300 0.070 0.000 1.059 202 R CA 1.057 57.174 56.100 0.028 0.000 1.000 202 R CB -0.111 30.170 30.300 -0.031 0.000 0.910 202 R HN 0.417 8.687 8.270 0.000 0.000 0.455 203 L N -1.668 119.626 121.223 0.117 0.000 2.433 203 L HA 0.176 4.517 4.340 0.001 0.000 0.200 203 L C 2.030 179.090 176.870 0.316 0.000 1.059 203 L CA 0.472 55.446 54.840 0.223 0.000 0.835 203 L CB -0.549 41.595 42.059 0.142 0.000 1.076 203 L HN -0.054 8.176 8.230 0.000 0.000 0.481 204 T N 0.747 115.419 114.554 0.196 0.000 2.737 204 T HA -0.111 4.240 4.350 0.001 0.000 0.265 204 T C 2.006 176.789 174.700 0.138 0.000 1.038 204 T CA 1.623 63.819 62.100 0.161 0.000 1.144 204 T CB -0.170 68.766 68.868 0.114 0.000 0.866 204 T HN 0.372 8.612 8.240 0.000 0.000 0.434 205 A N 0.076 122.975 122.820 0.131 0.000 1.969 205 A HA -0.071 4.249 4.320 0.001 0.000 0.218 205 A C 2.011 179.677 177.584 0.136 0.000 1.169 205 A CA 1.340 53.433 52.037 0.093 0.000 0.635 205 A CB -0.927 18.122 19.000 0.080 0.000 0.810 205 A HN 0.718 8.868 8.150 0.000 0.000 0.445 206 W N 1.557 122.874 121.300 0.029 0.000 2.378 206 W HA -0.186 4.476 4.660 0.004 0.000 0.313 206 W C 2.258 178.820 176.519 0.071 0.000 1.197 206 W CA 1.969 59.338 57.345 0.040 0.000 1.304 206 W CB -0.261 29.221 29.460 0.037 0.000 1.148 206 W HN 0.558 8.738 8.180 0.000 0.000 0.494 207 E N -0.251 119.888 120.200 -0.102 0.000 2.152 207 E HA -0.210 4.141 4.350 0.001 0.000 0.192 207 E C 1.988 178.523 176.600 -0.107 0.000 0.983 207 E CA 1.347 57.550 56.400 -0.329 0.000 0.818 207 E CB -0.857 28.874 29.700 0.051 0.000 0.758 207 E HN 0.272 8.632 8.360 0.000 0.000 0.467 208 L N 0.849 122.046 121.223 -0.043 0.000 2.027 208 L HA -0.086 4.255 4.340 0.001 0.000 0.206 208 L C 2.673 179.489 176.870 -0.090 0.000 1.074 208 L CA 1.775 56.565 54.840 -0.083 0.000 0.745 208 L CB -0.496 41.506 42.059 -0.094 0.000 0.898 208 L HN 0.218 8.448 8.230 0.000 0.000 0.433 209 M N -1.675 117.865 119.600 -0.100 0.000 2.213 209 M HA -0.238 4.242 4.480 0.001 0.000 0.263 209 M C 2.299 178.534 176.300 -0.109 0.000 1.062 209 M CA 1.455 56.700 55.300 -0.092 0.000 1.105 209 M CB -0.362 32.199 32.600 -0.066 0.000 1.385 209 M HN 0.318 8.608 8.290 0.000 0.000 0.417 210 Q N -0.217 119.465 119.800 -0.197 0.000 2.050 210 Q HA -0.122 4.219 4.340 0.001 0.000 0.202 210 Q C 2.133 178.100 176.000 -0.054 0.000 0.980 210 Q CA 1.499 57.187 55.803 -0.192 0.000 0.840 210 Q CB -0.422 28.086 28.738 -0.383 0.000 0.898 210 Q HN 0.666 8.936 8.270 0.000 0.000 0.424 211 G N -0.457 108.358 108.800 0.026 0.000 2.625 211 G HA2 0.050 4.011 3.960 0.001 0.000 0.214 211 G HA3 0.050 4.011 3.960 0.001 0.000 0.214 211 G C 0.856 175.808 174.900 0.086 0.000 1.132 211 G CA 0.449 45.648 45.100 0.166 0.000 0.782 211 G HN 0.523 8.813 8.290 0.000 0.000 0.538 212 G N -0.398 108.406 108.800 0.007 0.000 2.160 212 G HA2 -0.265 3.695 3.960 0.001 0.000 0.244 212 G HA3 -0.265 3.695 3.960 0.001 0.000 0.244 212 G C 0.228 175.106 174.900 -0.036 0.000 1.022 212 G CA 0.201 45.294 45.100 -0.012 0.000 0.741 212 G HN 0.509 8.799 8.290 0.000 0.000 0.508 213 I N 0.133 120.657 120.570 -0.076 0.000 2.499 213 I HA 0.271 4.442 4.170 0.001 0.000 0.296 213 I C 0.441 176.471 176.117 -0.144 0.000 0.992 213 I CA -0.711 60.510 61.300 -0.131 0.000 1.297 213 I CB 1.201 39.071 38.000 -0.218 0.000 1.410 213 I HN 0.091 8.301 8.210 0.000 0.000 0.507 214 D N 5.742 126.051 120.400 -0.151 0.000 2.416 214 D HA 0.178 4.819 4.640 0.001 0.000 0.240 214 D C -0.852 175.302 176.300 -0.243 0.000 1.250 214 D CA 0.182 54.088 54.000 -0.157 0.000 0.967 214 D CB 0.503 41.262 40.800 -0.067 0.000 1.059 214 D HN 0.205 8.575 8.370 0.000 0.000 0.512 215 V N 3.511 123.283 119.914 -0.236 0.000 2.628 215 V HA 0.633 4.754 4.120 0.001 0.000 0.306 215 V C -0.460 175.464 176.094 -0.285 0.000 1.045 215 V CA -0.292 61.844 62.300 -0.272 0.000 0.905 215 V CB 2.112 33.826 31.823 -0.182 0.000 0.997 215 V HN 0.550 8.740 8.190 0.000 0.000 0.436 216 T N 7.234 121.553 114.554 -0.392 0.000 2.841 216 T HA 0.541 4.892 4.350 0.001 0.000 0.283 216 T C -0.901 173.697 174.700 -0.171 0.000 1.000 216 T CA -0.287 61.608 62.100 -0.340 0.000 0.977 216 T CB 1.395 69.897 68.868 -0.609 0.000 0.979 216 T HN 0.620 8.860 8.240 0.000 0.000 0.446 217 L N 5.140 126.320 121.223 -0.071 0.000 2.307 217 L HA 0.781 5.122 4.340 0.001 0.000 0.282 217 L C -0.657 176.237 176.870 0.039 0.000 1.051 217 L CA -0.419 54.418 54.840 -0.005 0.000 0.804 217 L CB 0.340 42.399 42.059 0.000 0.000 1.197 217 L HN 0.715 8.945 8.230 0.000 0.000 0.431 218 I N 0.250 120.858 120.570 0.064 0.000 3.095 218 I HA 0.686 4.857 4.170 0.001 0.000 0.310 218 I C -0.190 175.960 176.117 0.055 0.000 1.196 218 I CA -0.630 60.714 61.300 0.074 0.000 0.985 218 I CB 2.234 40.299 38.000 0.109 0.000 1.250 218 I HN 0.637 8.847 8.210 0.000 0.000 0.446 219 T N -1.303 113.279 114.554 0.047 0.000 2.874 219 T HA 0.277 4.628 4.350 0.001 0.000 0.281 219 T C 0.501 175.225 174.700 0.040 0.000 0.994 219 T CA -0.322 61.800 62.100 0.036 0.000 1.015 219 T CB 1.138 70.022 68.868 0.028 0.000 1.028 219 T HN 0.660 8.900 8.240 0.000 0.000 0.523 220 D N 0.935 121.356 120.400 0.034 0.000 2.144 220 D HA -0.117 4.524 4.640 0.001 0.000 0.199 220 D C 2.318 178.640 176.300 0.037 0.000 0.984 220 D CA 1.752 55.774 54.000 0.037 0.000 0.834 220 D CB -0.461 40.357 40.800 0.029 0.000 0.955 220 D HN 0.748 9.118 8.370 0.000 0.000 0.465 221 S N 0.066 115.785 115.700 0.031 0.000 2.547 221 S HA -0.066 4.404 4.470 0.001 0.000 0.235 221 S C 1.842 176.467 174.600 0.041 0.000 0.980 221 S CA 0.429 58.648 58.200 0.031 0.000 0.941 221 S CB -0.333 62.880 63.200 0.021 0.000 0.763 221 S HN 0.207 8.517 8.310 0.000 0.000 0.532 222 M N 0.774 120.402 119.600 0.047 0.000 2.556 222 M HA 0.295 4.775 4.480 0.001 0.000 0.245 222 M C 2.435 178.766 176.300 0.051 0.000 1.128 222 M CA 0.513 55.851 55.300 0.063 0.000 1.069 222 M CB -0.379 32.261 32.600 0.066 0.000 1.469 222 M HN 0.476 8.766 8.290 0.000 0.000 0.494 223 A N 1.409 124.252 122.820 0.039 0.000 1.869 223 A HA -0.247 4.074 4.320 0.001 0.000 0.218 223 A C 2.399 179.979 177.584 -0.008 0.000 1.203 223 A CA 2.540 54.586 52.037 0.014 0.000 0.638 223 A CB -1.108 17.918 19.000 0.043 0.000 0.831 223 A HN 0.495 8.645 8.150 0.000 0.000 0.450 224 A N -1.600 121.269 122.820 0.082 0.000 1.851 224 A HA -0.275 4.045 4.320 0.001 0.000 0.216 224 A C 2.186 179.818 177.584 0.080 0.000 1.195 224 A CA 1.947 54.093 52.037 0.182 0.000 0.622 224 A CB -1.170 17.983 19.000 0.255 0.000 0.831 224 A HN 0.804 8.954 8.150 0.000 0.000 0.444 225 H N -0.811 118.260 119.070 0.001 0.000 2.421 225 H HA -0.100 4.457 4.556 0.001 0.000 0.298 225 H C 1.937 177.185 175.328 -0.134 0.000 1.087 225 H CA 1.790 57.817 56.048 -0.036 0.000 1.330 225 H CB 0.136 29.889 29.762 -0.016 0.000 1.388 225 H HN 0.461 8.741 8.280 0.000 0.000 0.526 226 T N 0.723 115.145 114.554 -0.220 0.000 2.770 226 T HA -0.087 4.264 4.350 0.001 0.000 0.263 226 T C 2.252 176.664 174.700 -0.479 0.000 1.039 226 T CA 1.133 63.016 62.100 -0.362 0.000 1.142 226 T CB -0.148 68.553 68.868 -0.279 0.000 0.868 226 T HN 0.309 8.549 8.240 0.000 0.000 0.435 227 M N 0.778 120.080 119.600 -0.496 0.000 2.195 227 M HA -0.117 4.363 4.480 0.001 0.000 0.260 227 M C 2.389 178.227 176.300 -0.770 0.000 1.066 227 M CA 1.401 56.312 55.300 -0.649 0.000 1.089 227 M CB -0.220 31.887 32.600 -0.822 0.000 1.377 227 M HN 0.050 8.340 8.290 0.000 0.000 0.411 228 K N 0.339 120.283 120.400 -0.760 0.000 2.020 228 K HA -0.090 4.231 4.320 0.001 0.000 0.206 228 K C 1.797 178.196 176.600 -0.335 0.000 1.038 228 K CA 1.170 57.160 56.287 -0.494 0.000 0.947 228 K CB -0.016 32.352 32.500 -0.221 0.000 0.744 228 K HN 0.170 8.420 8.250 0.000 0.000 0.442 229 E N 0.943 120.900 120.200 -0.406 0.000 2.106 229 E HA -0.123 4.228 4.350 0.001 0.000 0.192 229 E C 1.775 178.210 176.600 -0.275 0.000 0.984 229 E CA 0.952 57.150 56.400 -0.337 0.000 0.806 229 E CB 0.078 29.497 29.700 -0.469 0.000 0.750 229 E HN 0.150 8.510 8.360 0.000 0.000 0.458 230 K N 0.484 120.673 120.400 -0.351 0.000 2.418 230 K HA 0.040 4.361 4.320 0.001 0.000 0.195 230 K C 0.159 176.604 176.600 -0.258 0.000 1.035 230 K CA 0.067 56.157 56.287 -0.329 0.000 1.003 230 K CB 0.110 32.247 32.500 -0.605 0.000 0.793 230 K HN 0.196 8.446 8.250 0.000 0.000 0.494 231 Q N 1.146 120.789 119.800 -0.262 0.000 2.460 231 Q HA -0.162 4.179 4.340 0.001 0.000 0.311 231 Q C -0.588 175.306 176.000 -0.176 0.000 1.396 231 Q CA 0.133 55.822 55.803 -0.189 0.000 0.838 231 Q CB -1.383 27.290 28.738 -0.108 0.000 1.140 231 Q HN 0.178 8.448 8.270 0.000 0.000 0.415 232 I N 0.357 120.778 120.570 -0.248 0.000 2.741 232 I HA -0.101 4.070 4.170 0.001 0.000 0.288 232 I C 1.654 177.712 176.117 -0.097 0.000 1.192 232 I CA 0.885 62.069 61.300 -0.193 0.000 1.426 232 I CB 0.875 38.740 38.000 -0.224 0.000 1.367 232 I HN 0.279 8.489 8.210 0.000 0.000 0.563 233 S N 4.210 119.876 115.700 -0.057 0.000 2.414 233 S HA 0.252 4.723 4.470 0.001 0.000 0.227 233 S C 0.775 175.413 174.600 0.063 0.000 1.022 233 S CA 0.777 58.979 58.200 0.005 0.000 0.958 233 S CB 0.200 63.401 63.200 0.002 0.000 0.797 233 S HN 0.888 9.198 8.310 0.000 0.000 0.493 234 A N -0.001 122.846 122.820 0.044 0.000 2.544 234 A HA 0.633 4.954 4.320 0.001 0.000 0.291 234 A C -1.803 175.824 177.584 0.071 0.000 1.055 234 A CA -0.638 51.467 52.037 0.113 0.000 0.651 234 A CB 0.785 20.021 19.000 0.393 0.000 1.296 234 A HN 0.047 8.197 8.150 0.000 0.000 0.431 235 V N 1.140 121.085 119.914 0.051 0.000 2.487 235 V HA 0.664 4.785 4.120 0.001 0.000 0.298 235 V C -0.575 175.466 176.094 -0.088 0.000 1.028 235 V CA -0.305 61.992 62.300 -0.006 0.000 0.860 235 V CB 1.508 33.348 31.823 0.028 0.000 0.991 235 V HN 0.800 8.990 8.190 0.000 0.000 0.427 236 I N 6.207 126.785 120.570 0.014 0.000 2.533 236 I HA 0.807 4.978 4.170 0.001 0.000 0.290 236 I C -0.999 175.091 176.117 -0.045 0.000 1.056 236 I CA -0.620 60.704 61.300 0.039 0.000 1.057 236 I CB 1.902 40.076 38.000 0.290 0.000 1.240 236 I HN 0.580 8.790 8.210 0.000 0.000 0.423 237 V N 3.818 123.659 119.914 -0.122 0.000 3.130 237 V HA 0.911 5.032 4.120 0.001 0.000 0.310 237 V C 0.113 176.193 176.094 -0.024 0.000 1.158 237 V CA -0.217 62.054 62.300 -0.049 0.000 1.029 237 V CB 1.122 32.932 31.823 -0.021 0.000 1.057 237 V HN 0.757 8.947 8.190 0.000 0.000 0.436 238 G N 0.278 109.084 108.800 0.009 0.000 2.531 238 G HA2 0.872 4.833 3.960 0.001 0.000 0.253 238 G HA3 0.872 4.833 3.960 0.001 0.000 0.253 238 G C -0.186 174.719 174.900 0.009 0.000 1.439 238 G CA -0.288 44.815 45.100 0.005 0.000 1.056 238 G HN 2.075 10.365 8.290 0.000 0.000 0.555 239 A N -1.860 120.954 122.820 -0.009 0.000 2.577 239 A HA 0.571 4.891 4.320 0.001 0.000 0.297 239 A C -0.084 177.468 177.584 -0.052 0.000 1.060 239 A CA -0.351 51.666 52.037 -0.033 0.000 0.697 239 A CB 1.112 20.044 19.000 -0.113 0.000 1.281 239 A HN 0.429 8.579 8.150 0.000 0.000 0.402 240 D N 0.055 120.423 120.400 -0.054 0.000 2.277 240 D HA 0.094 4.734 4.640 0.001 0.000 0.209 240 D C 0.462 176.652 176.300 -0.183 0.000 0.970 240 D CA 0.905 54.835 54.000 -0.117 0.000 0.874 240 D CB 0.510 41.179 40.800 -0.218 0.000 0.982 240 D HN 0.525 8.895 8.370 0.000 0.000 0.504 241 R N 0.501 120.884 120.500 -0.194 0.000 2.647 241 R HA 0.308 4.649 4.340 0.001 0.000 0.260 241 R C -1.962 174.197 176.300 -0.234 0.000 1.154 241 R CA -0.363 55.609 56.100 -0.213 0.000 1.029 241 R CB 0.989 31.176 30.300 -0.189 0.000 1.262 241 R HN -0.156 8.114 8.270 0.000 0.000 0.437 242 I N 4.047 124.413 120.570 -0.339 0.000 2.355 242 I HA 0.407 4.578 4.170 0.001 0.000 0.288 242 I C 0.613 176.619 176.117 -0.185 0.000 0.999 242 I CA -0.771 60.308 61.300 -0.367 0.000 1.163 242 I CB 1.813 39.309 38.000 -0.839 0.000 1.316 242 I HN 0.722 8.932 8.210 0.000 0.000 0.454 243 A N 5.608 128.374 122.820 -0.090 0.000 2.425 243 A HA 0.119 4.440 4.320 0.001 0.000 0.242 243 A C 1.395 179.006 177.584 0.045 0.000 1.077 243 A CA -0.313 51.710 52.037 -0.023 0.000 0.781 243 A CB 0.295 19.288 19.000 -0.012 0.000 1.020 243 A HN 0.923 9.073 8.150 0.000 0.000 0.494 244 K N 0.720 121.150 120.400 0.049 0.000 2.442 244 K HA -0.207 4.114 4.320 0.001 0.000 0.200 244 K C 1.169 177.820 176.600 0.084 0.000 1.045 244 K CA 2.036 58.372 56.287 0.081 0.000 0.937 244 K CB -0.095 32.419 32.500 0.023 0.000 0.757 244 K HN 0.686 8.936 8.250 0.000 0.000 0.474 245 N N -0.416 118.318 118.700 0.057 0.000 2.333 245 N HA -0.035 4.706 4.740 0.001 0.000 0.178 245 N C 1.123 176.646 175.510 0.021 0.000 1.018 245 N CA 1.522 54.593 53.050 0.035 0.000 0.882 245 N CB 0.439 38.967 38.487 0.068 0.000 0.984 245 N HN 0.440 8.820 8.380 0.000 0.000 0.434 246 G N -0.524 108.304 108.800 0.047 0.000 2.231 246 G HA2 -0.196 3.765 3.960 0.001 0.000 0.206 246 G HA3 -0.196 3.765 3.960 0.001 0.000 0.206 246 G C -0.600 174.294 174.900 -0.010 0.000 0.996 246 G CA 0.044 45.132 45.100 -0.020 0.000 0.645 246 G HN 0.362 8.652 8.290 0.000 0.000 0.498 247 D N 2.152 122.589 120.400 0.062 0.000 2.493 247 D HA 0.435 5.075 4.640 0.001 0.000 0.240 247 D C 1.010 177.295 176.300 -0.025 0.000 1.142 247 D CA 1.409 55.439 54.000 0.050 0.000 0.872 247 D CB 1.138 41.964 40.800 0.043 0.000 1.173 247 D HN 0.511 8.881 8.370 0.000 0.000 0.467 248 T N -1.209 113.336 114.554 -0.015 0.000 2.771 248 T HA 0.671 5.022 4.350 0.001 0.000 0.281 248 T C -0.215 174.474 174.700 -0.017 0.000 0.982 248 T CA -1.104 60.976 62.100 -0.033 0.000 0.978 248 T CB 1.515 70.394 68.868 0.017 0.000 0.930 248 T HN 0.290 8.530 8.240 0.000 0.000 0.447 249 A N 3.620 126.410 122.820 -0.052 0.000 2.260 249 A HA 0.738 5.059 4.320 0.001 0.000 0.308 249 A C 0.013 177.611 177.584 0.022 0.000 1.254 249 A CA -0.712 51.304 52.037 -0.035 0.000 0.874 249 A CB 0.116 19.042 19.000 -0.123 0.000 1.153 249 A HN 0.946 9.096 8.150 0.000 0.000 0.527 250 N N 0.785 119.582 118.700 0.161 0.000 2.853 250 N HA 0.396 5.137 4.740 0.001 0.000 0.258 250 N C -0.825 174.922 175.510 0.396 0.000 1.444 250 N CA -0.732 52.471 53.050 0.255 0.000 0.837 250 N CB 1.085 39.676 38.487 0.175 0.000 1.489 250 N HN 0.463 8.843 8.380 0.000 0.000 0.529 251 K N 1.034 121.600 120.400 0.277 0.000 2.550 251 K HA 0.035 4.356 4.320 0.001 0.000 0.280 251 K C -0.260 176.335 176.600 -0.008 0.000 0.987 251 K CA -0.011 56.275 56.287 -0.002 0.000 1.048 251 K CB -0.282 32.202 32.500 -0.026 0.000 0.879 251 K HN 0.521 8.771 8.250 0.000 0.000 0.491 252 I N 4.264 124.747 120.570 -0.144 0.000 2.826 252 I HA 0.121 4.292 4.170 0.001 0.000 0.295 252 I C 1.271 177.386 176.117 -0.003 0.000 1.213 252 I CA 2.317 63.580 61.300 -0.061 0.000 1.436 252 I CB -0.034 37.877 38.000 -0.147 0.000 1.348 252 I HN 0.874 9.084 8.210 0.000 0.000 0.570 253 G N 3.664 112.502 108.800 0.062 0.000 2.307 253 G HA2 -0.294 3.667 3.960 0.001 0.000 0.210 253 G HA3 -0.294 3.667 3.960 0.001 0.000 0.210 253 G C 0.969 175.940 174.900 0.118 0.000 1.005 253 G CA 0.257 45.401 45.100 0.073 0.000 0.634 253 G HN 0.619 8.909 8.290 0.000 0.000 0.496 254 T N 0.471 115.118 114.554 0.155 0.000 2.788 254 T HA -0.120 4.231 4.350 0.001 0.000 0.268 254 T C 1.781 176.609 174.700 0.214 0.000 1.044 254 T CA 1.883 64.119 62.100 0.227 0.000 1.139 254 T CB -0.237 68.784 68.868 0.255 0.000 0.867 254 T HN 0.520 8.760 8.240 0.000 0.000 0.454 255 Y N 2.157 122.474 120.300 0.029 0.000 2.145 255 Y HA -0.001 4.549 4.550 0.001 0.000 0.286 255 Y C 2.520 178.376 175.900 -0.074 0.000 1.145 255 Y CA 1.053 59.127 58.100 -0.043 0.000 1.148 255 Y CB -1.019 37.435 38.460 -0.010 0.000 0.981 255 Y HN 0.157 8.437 8.280 0.000 0.000 0.507 256 G N 0.131 108.849 108.800 -0.136 0.000 2.402 256 G HA2 -0.253 3.708 3.960 0.001 0.000 0.216 256 G HA3 -0.253 3.708 3.960 0.001 0.000 0.216 256 G C 1.650 176.471 174.900 -0.133 0.000 1.162 256 G CA 0.907 45.868 45.100 -0.232 0.000 0.777 256 G HN 0.420 8.710 8.290 0.000 0.000 0.539 257 L N 1.337 122.552 121.223 -0.013 0.000 2.043 257 L HA 0.006 4.347 4.340 0.001 0.000 0.212 257 L C 3.126 179.993 176.870 -0.005 0.000 1.075 257 L CA 1.995 56.882 54.840 0.079 0.000 0.752 257 L CB -0.586 41.608 42.059 0.225 0.000 0.891 257 L HN 0.266 8.496 8.230 0.000 0.000 0.432 258 A N -0.991 121.643 122.820 -0.309 0.000 1.969 258 A HA -0.124 4.197 4.320 0.001 0.000 0.218 258 A C 2.264 179.607 177.584 -0.401 0.000 1.169 258 A CA 1.654 53.192 52.037 -0.831 0.000 0.635 258 A CB -0.662 17.606 19.000 -1.220 0.000 0.810 258 A HN 0.454 8.604 8.150 0.000 0.000 0.445 259 I N -0.960 119.411 120.570 -0.330 0.000 2.353 259 I HA -0.183 3.988 4.170 0.001 0.000 0.248 259 I C 2.183 178.207 176.117 -0.153 0.000 1.119 259 I CA 0.631 61.767 61.300 -0.273 0.000 1.417 259 I CB -0.170 37.604 38.000 -0.375 0.000 1.078 259 I HN 0.226 8.436 8.210 0.000 0.000 0.421 260 L N 0.749 121.924 121.223 -0.080 0.000 2.044 260 L HA -0.079 4.262 4.340 0.001 0.000 0.205 260 L C 2.721 179.696 176.870 0.175 0.000 1.075 260 L CA 2.053 56.926 54.840 0.055 0.000 0.747 260 L CB -1.215 40.927 42.059 0.139 0.000 0.903 260 L HN 0.162 8.392 8.230 0.000 0.000 0.435 261 A N -0.599 122.309 122.820 0.147 0.000 1.948 261 A HA -0.285 4.036 4.320 0.001 0.000 0.220 261 A C 2.255 179.915 177.584 0.126 0.000 1.177 261 A CA 2.101 54.252 52.037 0.189 0.000 0.636 261 A CB -0.847 18.286 19.000 0.222 0.000 0.815 261 A HN 0.577 8.727 8.150 0.000 0.000 0.449 262 N N 0.264 118.976 118.700 0.020 0.000 2.188 262 N HA -0.114 4.627 4.740 0.001 0.000 0.184 262 N C 1.890 177.378 175.510 -0.037 0.000 1.018 262 N CA 1.379 54.419 53.050 -0.016 0.000 0.858 262 N CB -0.228 38.217 38.487 -0.069 0.000 0.989 262 N HN 0.390 8.770 8.380 0.000 0.000 0.426 263 A N 0.049 122.813 122.820 -0.095 0.000 1.933 263 A HA -0.064 4.256 4.320 0.001 0.000 0.218 263 A C 1.485 178.909 177.584 -0.267 0.000 1.175 263 A CA 0.924 52.819 52.037 -0.236 0.000 0.628 263 A CB -0.713 18.048 19.000 -0.398 0.000 0.814 263 A HN 0.318 8.468 8.150 0.000 0.000 0.444 264 F N -0.707 119.227 119.950 -0.027 0.000 2.732 264 F HA 0.189 4.717 4.527 0.001 0.000 0.303 264 F C 0.631 176.423 175.800 -0.014 0.000 1.110 264 F CA 0.229 58.216 58.000 -0.022 0.000 1.355 264 F CB -0.407 38.578 39.000 -0.025 0.000 1.081 264 F HN 0.325 8.625 8.300 0.000 0.000 0.565 265 D N 1.288 121.761 120.400 0.121 0.000 2.689 265 D HA -0.225 4.415 4.640 0.001 0.000 0.237 265 D C -0.429 175.926 176.300 0.092 0.000 1.148 265 D CA 0.391 54.439 54.000 0.079 0.000 0.656 265 D CB -0.976 39.859 40.800 0.058 0.000 1.050 265 D HN 0.245 8.615 8.370 0.000 0.000 0.426 266 I N 1.070 121.704 120.570 0.106 0.000 2.362 266 I HA 0.332 4.503 4.170 0.001 0.000 0.289 266 I C -1.712 174.426 176.117 0.035 0.000 0.994 266 I CA -2.116 59.230 61.300 0.076 0.000 1.158 266 I CB 1.523 39.570 38.000 0.078 0.000 1.315 266 I HN -0.057 8.153 8.210 0.000 0.000 0.451 267 P HA -0.084 4.336 4.420 0.000 0.000 0.264 267 P C -0.989 176.073 177.300 -0.396 0.000 1.183 267 P CA 0.324 63.280 63.100 -0.240 0.000 0.763 267 P CB 0.500 32.041 31.700 -0.264 0.000 0.807 268 F N 4.137 123.740 119.950 -0.578 0.000 2.449 268 F HA 0.520 5.048 4.527 0.001 0.000 0.342 268 F C -1.101 174.417 175.800 -0.470 0.000 1.127 268 F CA -0.805 56.964 58.000 -0.385 0.000 0.975 268 F CB 0.683 39.603 39.000 -0.134 0.000 1.146 268 F HN 0.083 8.383 8.300 0.000 0.000 0.444 269 F N 4.725 124.467 119.950 -0.346 0.000 2.522 269 F HA 0.704 5.232 4.527 0.001 0.000 0.324 269 F C -0.696 174.922 175.800 -0.304 0.000 1.077 269 F CA -1.381 56.506 58.000 -0.188 0.000 0.944 269 F CB 1.813 40.775 39.000 -0.063 0.000 1.175 269 F HN 0.059 8.359 8.300 0.000 0.000 0.468 270 V N 1.922 121.892 119.914 0.093 0.000 2.487 270 V HA 0.804 4.925 4.120 0.001 0.000 0.298 270 V C -0.534 175.572 176.094 0.019 0.000 1.028 270 V CA -0.949 61.358 62.300 0.012 0.000 0.860 270 V CB 1.465 33.304 31.823 0.025 0.000 0.991 270 V HN 0.904 9.094 8.190 0.000 0.000 0.427 271 A N 3.943 126.756 122.820 -0.010 0.000 2.291 271 A HA 0.982 5.303 4.320 0.001 0.000 0.311 271 A C -0.176 177.398 177.584 -0.017 0.000 1.224 271 A CA -0.088 51.940 52.037 -0.015 0.000 0.821 271 A CB 1.174 20.151 19.000 -0.038 0.000 1.172 271 A HN 1.573 9.723 8.150 0.000 0.000 0.494 272 A N 3.859 126.684 122.820 0.008 0.000 2.589 272 A HA 0.892 5.213 4.320 0.001 0.000 0.296 272 A C -3.310 174.328 177.584 0.090 0.000 1.062 272 A CA -1.335 50.703 52.037 0.002 0.000 0.686 272 A CB 1.509 20.441 19.000 -0.113 0.000 1.282 272 A HN 0.547 8.697 8.150 0.000 0.000 0.404 273 P HA 0.245 4.665 4.420 0.000 0.000 0.278 273 P C 0.542 177.924 177.300 0.136 0.000 1.238 273 P CA -0.304 62.822 63.100 0.043 0.000 0.794 273 P CB 0.889 32.569 31.700 -0.032 0.000 0.955 274 L N 2.811 124.076 121.223 0.070 0.000 2.137 274 L HA -0.232 4.109 4.340 0.001 0.000 0.213 274 L C 2.498 179.460 176.870 0.154 0.000 1.085 274 L CA 2.519 57.405 54.840 0.076 0.000 0.760 274 L CB -1.757 40.160 42.059 -0.236 0.000 0.893 274 L HN 0.495 8.725 8.230 0.000 0.000 0.434 275 S N -3.358 112.201 115.700 -0.236 0.000 2.595 275 S HA -0.090 4.381 4.470 0.001 0.000 0.235 275 S C 1.472 175.745 174.600 -0.544 0.000 0.974 275 S CA 1.172 58.869 58.200 -0.839 0.000 0.942 275 S CB -0.547 61.703 63.200 -1.583 0.000 0.766 275 S HN 0.445 8.755 8.310 0.000 0.000 0.536 276 T N 1.273 115.734 114.554 -0.154 0.000 3.105 276 T HA 0.375 4.726 4.350 0.001 0.000 0.253 276 T C -0.320 174.261 174.700 -0.198 0.000 1.047 276 T CA -0.263 61.729 62.100 -0.180 0.000 0.944 276 T CB -0.263 68.487 68.868 -0.196 0.000 1.016 276 T HN 0.373 8.613 8.240 0.000 0.000 0.544 277 F N 2.108 122.007 119.950 -0.084 0.000 2.404 277 F HA 0.457 4.985 4.527 0.001 0.000 0.339 277 F C 0.375 176.089 175.800 -0.144 0.000 1.105 277 F CA -1.226 56.752 58.000 -0.037 0.000 1.087 277 F CB 0.972 40.079 39.000 0.178 0.000 1.143 277 F HN -0.122 8.178 8.300 0.000 0.000 0.491 278 D N 1.691 122.088 120.400 -0.005 0.000 2.446 278 D HA 0.074 4.715 4.640 0.001 0.000 0.251 278 D C 0.850 177.103 176.300 -0.079 0.000 1.137 278 D CA -0.168 53.794 54.000 -0.064 0.000 0.890 278 D CB 1.286 42.049 40.800 -0.061 0.000 1.071 278 D HN 0.598 8.968 8.370 0.000 0.000 0.528 279 T N 1.531 115.986 114.554 -0.166 0.000 3.055 279 T HA -0.068 4.283 4.350 0.001 0.000 0.265 279 T C 1.443 176.091 174.700 -0.086 0.000 1.111 279 T CA 0.822 62.833 62.100 -0.149 0.000 1.118 279 T CB -0.050 68.657 68.868 -0.269 0.000 0.909 279 T HN 0.228 8.468 8.240 0.000 0.000 0.501 280 K N 0.566 120.921 120.400 -0.074 0.000 2.439 280 K HA 0.087 4.408 4.320 0.001 0.000 0.197 280 K C 0.015 176.596 176.600 -0.032 0.000 1.041 280 K CA 0.220 56.480 56.287 -0.044 0.000 0.970 280 K CB -0.033 32.448 32.500 -0.033 0.000 0.773 280 K HN 0.294 8.544 8.250 0.000 0.000 0.479 281 V N 1.310 121.203 119.914 -0.035 0.000 2.481 281 V HA 0.081 4.202 4.120 0.001 0.000 0.286 281 V C 1.026 177.112 176.094 -0.014 0.000 1.042 281 V CA -0.182 62.103 62.300 -0.025 0.000 0.928 281 V CB 1.641 33.444 31.823 -0.033 0.000 0.986 281 V HN 0.100 8.290 8.190 0.000 0.000 0.462 282 K N 2.261 122.658 120.400 -0.005 0.000 2.166 282 K HA 0.150 4.471 4.320 0.001 0.000 0.201 282 K C 0.410 177.022 176.600 0.019 0.000 1.052 282 K CA 0.905 57.196 56.287 0.008 0.000 0.969 282 K CB 0.335 32.841 32.500 0.009 0.000 0.761 282 K HN 0.954 9.204 8.250 0.000 0.000 0.459 283 C N -4.578 114.731 119.300 0.015 0.000 3.321 283 C HA 0.596 5.057 4.460 0.001 0.000 0.329 283 C C 1.672 176.665 174.990 0.004 0.000 1.394 283 C CA -0.788 58.246 59.018 0.028 0.000 1.291 283 C CB 0.875 28.640 27.740 0.041 0.000 1.606 283 C HN 0.318 8.548 8.230 0.000 0.000 0.463 284 G N 0.375 109.177 108.800 0.003 0.000 2.485 284 G HA2 0.066 4.026 3.960 0.001 0.000 0.221 284 G HA3 0.066 4.026 3.960 0.001 0.000 0.221 284 G C 1.547 176.425 174.900 -0.036 0.000 1.115 284 G CA 1.439 46.522 45.100 -0.029 0.000 0.751 284 G HN 1.695 9.985 8.290 0.000 0.000 0.567 285 A N 0.743 123.549 122.820 -0.023 0.000 2.076 285 A HA -0.040 4.281 4.320 0.001 0.000 0.220 285 A C 1.907 179.480 177.584 -0.018 0.000 1.160 285 A CA 1.893 53.917 52.037 -0.022 0.000 0.653 285 A CB -0.166 18.827 19.000 -0.012 0.000 0.801 285 A HN 0.320 8.470 8.150 0.000 0.000 0.455 286 D N -0.513 119.877 120.400 -0.018 0.000 2.354 286 D HA 0.122 4.763 4.640 0.001 0.000 0.209 286 D C 0.383 176.667 176.300 -0.027 0.000 1.015 286 D CA 0.149 54.138 54.000 -0.018 0.000 0.867 286 D CB 0.004 40.794 40.800 -0.015 0.000 0.933 286 D HN 0.453 8.823 8.370 0.000 0.000 0.520 287 I N 4.444 124.991 120.570 -0.039 0.000 2.494 287 I HA 0.056 4.227 4.170 0.001 0.000 0.289 287 I C -1.889 174.199 176.117 -0.049 0.000 1.106 287 I CA -1.384 59.882 61.300 -0.057 0.000 1.369 287 I CB 0.364 38.317 38.000 -0.078 0.000 1.410 287 I HN -0.268 7.942 8.210 0.000 0.000 0.523 288 P HA 0.229 4.649 4.420 0.000 0.000 0.271 288 P C -0.582 176.697 177.300 -0.035 0.000 1.216 288 P CA 0.031 63.114 63.100 -0.028 0.000 0.771 288 P CB 1.127 32.813 31.700 -0.024 0.000 0.864 289 I N 2.086 122.667 120.570 0.018 0.000 2.339 289 I HA 0.197 4.368 4.170 0.001 0.000 0.290 289 I C 1.022 177.205 176.117 0.111 0.000 0.994 289 I CA -0.750 60.595 61.300 0.075 0.000 1.191 289 I CB 1.248 39.312 38.000 0.106 0.000 1.343 289 I HN 0.372 8.582 8.210 0.000 0.000 0.458 290 E N 7.098 127.407 120.200 0.181 0.000 2.324 290 E HA 0.117 4.467 4.350 0.001 0.000 0.271 290 E C -0.721 175.948 176.600 0.115 0.000 1.028 290 E CA -0.142 56.356 56.400 0.163 0.000 0.890 290 E CB 0.725 30.564 29.700 0.233 0.000 1.004 290 E HN 0.522 8.882 8.360 0.000 0.000 0.431 291 E N 4.452 124.683 120.200 0.051 0.000 2.133 291 E HA 0.279 4.630 4.350 0.001 0.000 0.274 291 E C -0.518 176.075 176.600 -0.010 0.000 0.930 291 E CA -0.513 55.879 56.400 -0.015 0.000 0.770 291 E CB 1.621 31.331 29.700 0.017 0.000 1.104 291 E HN 0.383 8.743 8.360 0.000 0.000 0.403 292 R N 1.415 121.886 120.500 -0.048 0.000 2.607 292 R HA 0.177 4.518 4.340 0.001 0.000 0.261 292 R C -0.407 175.875 176.300 -0.029 0.000 1.051 292 R CA -0.988 55.092 56.100 -0.034 0.000 1.110 292 R CB 0.578 30.847 30.300 -0.053 0.000 1.158 292 R HN 0.482 8.752 8.270 0.000 0.000 0.543 293 D N 1.136 121.527 120.400 -0.016 0.000 2.662 293 D HA -0.050 4.590 4.640 0.001 0.000 0.233 293 D C -1.570 174.721 176.300 -0.015 0.000 1.129 293 D CA -0.778 53.218 54.000 -0.007 0.000 0.851 293 D CB 0.822 41.621 40.800 -0.002 0.000 1.152 293 D HN 0.137 8.507 8.370 0.000 0.000 0.507 294 P HA -0.183 4.237 4.420 0.000 0.000 0.218 294 P C 0.868 178.164 177.300 -0.006 0.000 1.146 294 P CA 0.852 63.951 63.100 -0.001 0.000 0.813 294 P CB 0.167 31.877 31.700 0.017 0.000 0.778 295 E N 0.066 120.263 120.200 -0.005 0.000 2.160 295 E HA -0.210 4.141 4.350 0.001 0.000 0.195 295 E C 1.789 178.381 176.600 -0.014 0.000 0.991 295 E CA 1.045 57.441 56.400 -0.006 0.000 0.810 295 E CB -0.558 29.140 29.700 -0.004 0.000 0.742 295 E HN 0.494 8.854 8.360 0.000 0.000 0.466 296 E N 0.231 120.417 120.200 -0.023 0.000 2.233 296 E HA -0.161 4.190 4.350 0.001 0.000 0.199 296 E C 1.970 178.551 176.600 -0.032 0.000 1.004 296 E CA 1.176 57.556 56.400 -0.033 0.000 0.819 296 E CB 0.086 29.756 29.700 -0.050 0.000 0.738 296 E HN 0.094 8.454 8.360 0.000 0.000 0.478 297 V N 0.357 120.255 119.914 -0.027 0.000 2.949 297 V HA -0.058 4.063 4.120 0.001 0.000 0.245 297 V C 2.063 178.151 176.094 -0.010 0.000 1.086 297 V CA 0.849 63.136 62.300 -0.021 0.000 1.097 297 V CB -0.190 31.622 31.823 -0.019 0.000 0.762 297 V HN 0.144 8.334 8.190 0.000 0.000 0.470 298 R N 1.203 121.699 120.500 -0.006 0.000 2.055 298 R HA 0.008 4.349 4.340 0.001 0.000 0.226 298 R C 0.943 177.241 176.300 -0.004 0.000 1.135 298 R CA 0.829 56.928 56.100 -0.002 0.000 0.959 298 R CB -0.111 30.191 30.300 0.002 0.000 0.854 298 R HN 0.654 8.924 8.270 0.000 0.000 0.431 299 Q N 0.948 120.744 119.800 -0.006 0.000 2.333 299 Q HA 0.462 4.803 4.340 0.001 0.000 0.268 299 Q C -1.241 174.752 176.000 -0.011 0.000 1.007 299 Q CA -0.656 55.143 55.803 -0.007 0.000 0.810 299 Q CB 1.806 30.541 28.738 -0.005 0.000 1.264 299 Q HN -0.075 8.195 8.270 0.000 0.000 0.452 300 I N 2.533 123.097 120.570 -0.011 0.000 2.339 300 I HA 0.216 4.386 4.170 0.001 0.000 0.290 300 I C 0.211 176.319 176.117 -0.015 0.000 0.994 300 I CA 0.074 61.365 61.300 -0.014 0.000 1.191 300 I CB 1.467 39.459 38.000 -0.013 0.000 1.343 300 I HN 0.954 9.164 8.210 0.000 0.000 0.458 301 S N 4.249 119.938 115.700 -0.019 0.000 3.127 301 S HA -0.195 4.275 4.470 0.001 0.000 0.281 301 S C 1.176 175.766 174.600 -0.018 0.000 1.293 301 S CA 1.287 59.474 58.200 -0.021 0.000 1.156 301 S CB -1.453 61.736 63.200 -0.019 0.000 1.389 301 S HN 1.546 9.856 8.310 0.000 0.000 0.672 302 G N -1.504 107.287 108.800 -0.015 0.000 2.163 302 G HA2 -0.151 3.810 3.960 0.001 0.000 0.213 302 G HA3 -0.151 3.810 3.960 0.001 0.000 0.213 302 G C -0.132 174.763 174.900 -0.009 0.000 0.991 302 G CA -0.118 44.975 45.100 -0.011 0.000 0.653 302 G HN 1.189 9.479 8.290 0.000 0.000 0.518 303 V N 2.046 121.955 119.914 -0.009 0.000 2.448 303 V HA 0.514 4.635 4.120 0.001 0.000 0.295 303 V C 0.847 176.938 176.094 -0.005 0.000 1.025 303 V CA -1.105 61.191 62.300 -0.006 0.000 0.859 303 V CB 1.618 33.438 31.823 -0.006 0.000 0.988 303 V HN 0.333 8.523 8.190 0.000 0.000 0.431 304 R N 2.548 123.046 120.500 -0.003 0.000 2.489 304 R HA 0.249 4.590 4.340 0.001 0.000 0.287 304 R C 0.605 176.904 176.300 -0.002 0.000 1.053 304 R CA 0.542 56.641 56.100 -0.002 0.000 1.036 304 R CB 0.625 30.925 30.300 -0.001 0.000 0.966 304 R HN 0.912 9.182 8.270 0.000 0.000 0.432 305 T N -1.941 112.612 114.554 -0.002 0.000 3.209 305 T HA 0.461 4.812 4.350 0.001 0.000 0.295 305 T C -0.021 174.679 174.700 0.001 0.000 0.977 305 T CA -0.279 61.820 62.100 -0.001 0.000 0.922 305 T CB 0.756 69.623 68.868 -0.002 0.000 1.152 305 T HN 0.625 8.865 8.240 0.000 0.000 0.527 306 A N 1.337 124.158 122.820 0.002 0.000 2.601 306 A HA 0.785 5.106 4.320 0.001 0.000 0.291 306 A C -3.244 174.343 177.584 0.005 0.000 1.075 306 A CA -1.515 50.525 52.037 0.004 0.000 0.671 306 A CB 0.347 19.350 19.000 0.006 0.000 1.277 306 A HN 0.106 8.256 8.150 0.000 0.000 0.417 307 P HA 0.344 4.764 4.420 0.000 0.000 0.271 307 P C -0.155 177.149 177.300 0.007 0.000 1.216 307 P CA 0.166 63.270 63.100 0.006 0.000 0.776 307 P CB 0.790 32.494 31.700 0.007 0.000 0.881 308 S N 2.474 118.177 115.700 0.006 0.000 2.573 308 S HA 0.052 4.523 4.470 0.001 0.000 0.277 308 S C 0.824 175.429 174.600 0.009 0.000 1.346 308 S CA 0.198 58.402 58.200 0.007 0.000 1.034 308 S CB -0.239 62.965 63.200 0.006 0.000 0.879 308 S HN 0.579 8.889 8.310 0.000 0.000 0.528 309 N N -1.475 117.232 118.700 0.011 0.000 2.962 309 N HA -0.164 4.577 4.740 0.001 0.000 0.206 309 N C -0.233 175.286 175.510 0.015 0.000 0.907 309 N CA 0.959 54.017 53.050 0.013 0.000 1.029 309 N CB -1.253 37.240 38.487 0.011 0.000 1.009 309 N HN 0.443 8.823 8.380 0.000 0.000 0.587 310 V N 2.107 122.031 119.914 0.015 0.000 2.585 310 V HA 0.250 4.371 4.120 0.001 0.000 0.296 310 V C -1.753 174.356 176.094 0.025 0.000 1.035 310 V CA -0.969 61.342 62.300 0.018 0.000 1.084 310 V CB 0.588 32.421 31.823 0.017 0.000 0.953 310 V HN 0.025 8.215 8.190 0.000 0.000 0.483 311 P HA 0.232 4.652 4.420 0.000 0.000 0.267 311 P C -1.215 176.118 177.300 0.054 0.000 1.200 311 P CA 0.165 63.288 63.100 0.039 0.000 0.772 311 P CB 0.632 32.353 31.700 0.035 0.000 0.855 312 V N 3.095 123.053 119.914 0.073 0.000 2.841 312 V HA 0.421 4.542 4.120 0.001 0.000 0.310 312 V C -1.021 175.177 176.094 0.173 0.000 1.090 312 V CA -0.500 61.856 62.300 0.093 0.000 0.930 312 V CB 2.037 33.890 31.823 0.050 0.000 1.014 312 V HN 0.339 8.529 8.190 0.000 0.000 0.425 313 F N 4.176 124.129 119.950 0.005 0.000 2.375 313 F HA 0.613 5.141 4.527 0.002 0.000 0.361 313 F C -0.017 175.785 175.800 0.004 0.000 1.117 313 F CA -1.159 56.846 58.000 0.007 0.000 1.037 313 F CB 1.168 40.174 39.000 0.010 0.000 1.192 313 F HN 0.520 8.820 8.300 0.000 0.000 0.452 314 N N 7.918 126.424 118.700 -0.322 0.000 2.990 314 N HA 0.329 5.069 4.740 0.001 0.000 0.288 314 N C -3.010 172.236 175.510 -0.440 0.000 1.624 314 N CA -2.302 50.541 53.050 -0.346 0.000 0.961 314 N CB 0.594 38.991 38.487 -0.150 0.000 1.259 314 N HN 0.218 8.598 8.380 0.000 0.000 0.489 315 P HA 0.139 4.559 4.420 0.000 0.000 0.276 315 P C -0.083 177.032 177.300 -0.308 0.000 1.235 315 P CA -0.139 62.683 63.100 -0.464 0.000 0.772 315 P CB 1.650 33.013 31.700 -0.562 0.000 0.871 316 A N 3.068 125.737 122.820 -0.252 0.000 2.275 316 A HA 0.358 4.679 4.320 0.001 0.000 0.212 316 A C 0.072 177.072 177.584 -0.973 0.000 1.201 316 A CA 0.394 52.105 52.037 -0.543 0.000 0.843 316 A CB -0.498 18.161 19.000 -0.568 0.000 0.873 316 A HN 0.510 8.660 8.150 0.000 0.000 0.492 317 F N -1.255 118.659 119.950 -0.060 0.000 2.711 317 F HA 0.514 5.042 4.527 0.001 0.000 0.313 317 F C -0.891 174.895 175.800 -0.024 0.000 1.141 317 F CA -1.100 56.882 58.000 -0.031 0.000 0.941 317 F CB 1.523 40.505 39.000 -0.030 0.000 1.349 317 F HN 0.178 8.478 8.300 0.000 0.000 0.464 318 D N -0.366 120.150 120.400 0.194 0.000 2.664 318 D HA 0.653 5.294 4.640 0.001 0.000 0.292 318 D C -1.725 174.584 176.300 0.015 0.000 1.214 318 D CA -0.378 53.671 54.000 0.081 0.000 0.932 318 D CB 1.640 42.503 40.800 0.106 0.000 1.420 318 D HN 0.214 8.584 8.370 0.000 0.000 0.471 319 I N 0.024 120.497 120.570 -0.161 0.000 2.436 319 I HA 0.384 4.555 4.170 0.001 0.000 0.289 319 I C -0.402 175.526 176.117 -0.315 0.000 1.010 319 I CA -0.287 60.902 61.300 -0.185 0.000 1.098 319 I CB 2.035 39.930 38.000 -0.175 0.000 1.266 319 I HN 0.378 8.588 8.210 0.000 0.000 0.434 320 T N 8.169 122.675 114.554 -0.079 0.000 2.733 320 T HA 0.406 4.756 4.350 0.001 0.000 0.294 320 T C -2.506 172.194 174.700 -0.000 0.000 0.956 320 T CA -1.220 60.895 62.100 0.024 0.000 0.987 320 T CB 0.965 69.876 68.868 0.073 0.000 0.920 320 T HN 0.207 8.447 8.240 0.000 0.000 0.470 321 P HA 0.098 4.518 4.420 0.000 0.000 0.268 321 P C 0.567 177.873 177.300 0.010 0.000 1.205 321 P CA -0.246 62.845 63.100 -0.016 0.000 0.771 321 P CB 0.384 32.064 31.700 -0.032 0.000 0.858 322 H N 1.597 120.711 119.070 0.074 0.000 2.489 322 H HA -0.155 4.401 4.556 0.001 0.000 0.293 322 H C 1.016 176.467 175.328 0.204 0.000 1.066 322 H CA 1.720 57.852 56.048 0.139 0.000 1.305 322 H CB -0.755 29.136 29.762 0.215 0.000 1.386 322 H HN 0.318 8.598 8.280 0.000 0.000 0.551 323 D N 0.778 121.011 120.400 -0.277 0.000 2.378 323 D HA -0.092 4.549 4.640 0.001 0.000 0.227 323 D C 1.205 177.511 176.300 0.009 0.000 1.012 323 D CA 0.342 54.291 54.000 -0.085 0.000 0.905 323 D CB -0.340 40.350 40.800 -0.184 0.000 0.895 323 D HN 0.565 8.935 8.370 0.000 0.000 0.532 324 L N -0.152 121.076 121.223 0.009 0.000 2.857 324 L HA 0.351 4.692 4.340 0.001 0.000 0.249 324 L C 0.169 177.054 176.870 0.025 0.000 1.172 324 L CA -0.181 54.641 54.840 -0.030 0.000 0.980 324 L CB 0.454 42.442 42.059 -0.118 0.000 1.299 324 L HN -0.068 8.162 8.230 0.000 0.000 0.535 325 I N -0.811 119.868 120.570 0.180 0.000 2.405 325 I HA 0.147 4.318 4.170 0.001 0.000 0.280 325 I C 1.082 177.408 176.117 0.348 0.000 1.027 325 I CA -0.071 61.414 61.300 0.308 0.000 1.161 325 I CB 1.868 40.023 38.000 0.259 0.000 1.300 325 I HN -0.033 8.177 8.210 0.000 0.000 0.463 326 S N 3.902 119.746 115.700 0.240 0.000 2.383 326 S HA -0.011 4.459 4.470 0.001 0.000 0.229 326 S C 0.900 175.760 174.600 0.433 0.000 1.030 326 S CA 0.978 59.309 58.200 0.218 0.000 1.002 326 S CB 0.018 63.190 63.200 -0.047 0.000 0.829 326 S HN 0.854 9.164 8.310 0.000 0.000 0.467 327 G N 0.026 109.150 108.800 0.540 0.000 2.733 327 G HA2 0.571 4.531 3.960 0.001 0.000 0.297 327 G HA3 0.571 4.531 3.960 0.001 0.000 0.297 327 G C -1.471 173.669 174.900 0.400 0.000 1.452 327 G CA -0.874 44.575 45.100 0.582 0.000 0.940 327 G HN 0.177 8.467 8.290 0.000 0.000 0.547 328 I N 1.538 122.256 120.570 0.247 0.000 2.378 328 I HA 0.425 4.596 4.170 0.001 0.000 0.291 328 I C -0.675 175.507 176.117 0.108 0.000 0.992 328 I CA -0.838 60.531 61.300 0.116 0.000 1.154 328 I CB 1.908 39.912 38.000 0.007 0.000 1.315 328 I HN 0.207 8.417 8.210 0.000 0.000 0.448 329 I N 5.511 126.114 120.570 0.054 0.000 2.377 329 I HA 0.465 4.636 4.170 0.001 0.000 0.293 329 I C 0.521 176.661 176.117 0.038 0.000 0.987 329 I CA -0.022 61.278 61.300 -0.001 0.000 1.185 329 I CB 1.761 39.709 38.000 -0.085 0.000 1.341 329 I HN 0.634 8.844 8.210 0.000 0.000 0.455 330 T N 0.421 114.985 114.554 0.017 0.000 2.831 330 T HA 0.367 4.718 4.350 0.001 0.000 0.287 330 T C 0.781 175.456 174.700 -0.042 0.000 1.070 330 T CA -0.676 61.433 62.100 0.015 0.000 1.010 330 T CB 1.471 70.327 68.868 -0.020 0.000 1.264 330 T HN 0.630 8.870 8.240 0.000 0.000 0.532 331 E N 0.367 120.534 120.200 -0.055 0.000 2.268 331 E HA -0.100 4.251 4.350 0.001 0.000 0.195 331 E C 1.069 177.619 176.600 -0.083 0.000 0.995 331 E CA 0.707 57.068 56.400 -0.065 0.000 0.836 331 E CB -0.156 29.508 29.700 -0.061 0.000 0.763 331 E HN 0.467 8.827 8.360 0.000 0.000 0.491 332 K N 0.961 121.296 120.400 -0.108 0.000 2.459 332 K HA 0.181 4.502 4.320 0.001 0.000 0.193 332 K C 1.037 177.582 176.600 -0.092 0.000 1.030 332 K CA 0.774 56.991 56.287 -0.116 0.000 1.026 332 K CB 0.764 33.164 32.500 -0.167 0.000 0.809 332 K HN 0.318 8.568 8.250 0.000 0.000 0.504 333 G N 0.824 109.576 108.800 -0.080 0.000 2.316 333 G HA2 -0.068 3.893 3.960 0.001 0.000 0.349 333 G HA3 -0.068 3.893 3.960 0.001 0.000 0.349 333 G C -1.310 173.558 174.900 -0.054 0.000 1.274 333 G CA -1.002 44.056 45.100 -0.070 0.000 1.018 333 G HN 0.025 8.315 8.290 0.000 0.000 0.486 334 I N 0.903 121.444 120.570 -0.049 0.000 2.377 334 I HA 0.509 4.679 4.170 0.001 0.000 0.293 334 I C 0.503 176.647 176.117 0.044 0.000 0.987 334 I CA -0.479 60.809 61.300 -0.019 0.000 1.185 334 I CB 1.687 39.641 38.000 -0.076 0.000 1.341 334 I HN 0.363 8.573 8.210 0.000 0.000 0.455 335 M N 4.985 124.668 119.600 0.139 0.000 2.268 335 M HA 0.295 4.776 4.480 0.001 0.000 0.344 335 M C 0.447 176.974 176.300 0.378 0.000 1.106 335 M CA -0.403 55.042 55.300 0.240 0.000 1.010 335 M CB 1.767 34.591 32.600 0.373 0.000 1.649 335 M HN 0.668 8.958 8.290 0.000 0.000 0.443 336 T N -1.726 112.940 114.554 0.186 0.000 3.040 336 T HA 0.557 4.908 4.350 0.001 0.000 0.266 336 T C 0.424 175.046 174.700 -0.130 0.000 1.005 336 T CA -0.112 62.084 62.100 0.161 0.000 0.906 336 T CB 0.317 69.252 68.868 0.112 0.000 1.082 336 T HN 0.928 9.168 8.240 0.000 0.000 0.531 337 G N 1.031 109.464 108.800 -0.612 0.000 2.358 337 G HA2 0.377 4.338 3.960 0.001 0.000 0.301 337 G HA3 0.377 4.338 3.960 0.001 0.000 0.301 337 G C -0.505 174.008 174.900 -0.645 0.000 1.539 337 G CA -0.236 44.375 45.100 -0.815 0.000 0.893 337 G HN 0.417 8.707 8.290 0.000 0.000 0.636 338 N N -1.120 117.285 118.700 -0.492 0.000 2.776 338 N HA -0.239 4.502 4.740 0.001 0.000 0.249 338 N C 0.834 176.232 175.510 -0.186 0.000 1.111 338 N CA 1.765 54.671 53.050 -0.239 0.000 0.711 338 N CB -1.494 36.907 38.487 -0.144 0.000 1.065 338 N HN 0.715 9.095 8.380 0.000 0.000 0.556 339 Y N 0.065 120.343 120.300 -0.036 0.000 2.069 339 Y HA -0.268 4.283 4.550 0.002 0.000 0.278 339 Y C 2.468 178.358 175.900 -0.017 0.000 1.175 339 Y CA 2.030 60.121 58.100 -0.015 0.000 1.134 339 Y CB -0.801 37.649 38.460 -0.018 0.000 0.965 339 Y HN 0.493 8.773 8.280 0.000 0.000 0.498 340 E N 0.258 120.509 120.200 0.086 0.000 2.086 340 E HA -0.349 4.002 4.350 0.001 0.000 0.205 340 E C 2.259 178.891 176.600 0.053 0.000 1.027 340 E CA 1.951 58.380 56.400 0.049 0.000 0.830 340 E CB -0.215 29.481 29.700 -0.007 0.000 0.751 340 E HN 0.672 9.033 8.360 0.000 0.000 0.456 341 E N -0.364 119.852 120.200 0.026 0.000 2.107 341 E HA -0.180 4.171 4.350 0.001 0.000 0.191 341 E C 1.984 178.599 176.600 0.026 0.000 0.982 341 E CA 0.750 57.162 56.400 0.019 0.000 0.809 341 E CB 0.118 29.816 29.700 -0.003 0.000 0.756 341 E HN 0.246 8.606 8.360 0.000 0.000 0.459 342 E N 0.617 120.838 120.200 0.034 0.000 2.077 342 E HA -0.186 4.165 4.350 0.001 0.000 0.193 342 E C 2.216 178.833 176.600 0.030 0.000 0.989 342 E CA 0.941 57.361 56.400 0.034 0.000 0.800 342 E CB -0.205 29.541 29.700 0.076 0.000 0.746 342 E HN 0.452 8.812 8.360 0.000 0.000 0.452 343 I N 1.334 121.954 120.570 0.082 0.000 2.493 343 I HA -0.213 3.958 4.170 0.001 0.000 0.254 343 I C 2.636 178.833 176.117 0.135 0.000 1.160 343 I CA 0.846 62.200 61.300 0.089 0.000 1.445 343 I CB -0.207 37.913 38.000 0.199 0.000 1.086 343 I HN 0.133 8.343 8.210 0.000 0.000 0.433 344 E N 0.897 121.153 120.200 0.093 0.000 2.051 344 E HA -0.306 4.045 4.350 0.001 0.000 0.192 344 E C 2.148 178.780 176.600 0.053 0.000 0.991 344 E CA 1.346 57.795 56.400 0.083 0.000 0.799 344 E CB 0.051 29.779 29.700 0.047 0.000 0.748 344 E HN 0.336 8.696 8.360 0.000 0.000 0.449 345 Q N 0.799 120.603 119.800 0.007 0.000 1.993 345 Q HA -0.095 4.246 4.340 0.001 0.000 0.202 345 Q C 2.351 178.300 176.000 -0.084 0.000 0.984 345 Q CA 1.653 57.437 55.803 -0.032 0.000 0.837 345 Q CB -0.388 28.324 28.738 -0.043 0.000 0.902 345 Q HN 0.389 8.659 8.270 0.000 0.000 0.423 346 L N -1.097 120.025 121.223 -0.167 0.000 2.129 346 L HA -0.156 4.184 4.340 0.001 0.000 0.212 346 L C 0.991 177.563 176.870 -0.497 0.000 1.087 346 L CA 0.794 55.410 54.840 -0.375 0.000 0.757 346 L CB -0.316 41.394 42.059 -0.581 0.000 0.896 346 L HN 0.171 8.401 8.230 0.000 0.000 0.434 347 F N -0.015 119.869 119.950 -0.109 0.000 2.713 347 F HA 0.151 4.679 4.527 0.001 0.000 0.294 347 F C 1.184 176.957 175.800 -0.045 0.000 1.152 347 F CA -0.228 57.725 58.000 -0.077 0.000 1.385 347 F CB -0.137 38.821 39.000 -0.070 0.000 0.981 347 F HN -0.126 8.174 8.300 0.000 0.000 0.514 348 K N 1.361 121.787 120.400 0.043 0.000 2.222 348 K HA 0.519 4.840 4.320 0.001 0.000 0.243 348 K C 0.263 176.873 176.600 0.016 0.000 1.160 348 K CA 0.195 56.502 56.287 0.034 0.000 1.090 348 K CB -0.398 32.105 32.500 0.005 0.000 1.694 348 K HN 0.421 8.671 8.250 0.000 0.000 0.361 349 G N 0.000 108.826 108.800 0.043 0.000 5.446 349 G HA2 0.000 3.961 3.960 0.001 0.000 0.244 349 G HA3 0.000 3.961 3.960 0.001 0.000 0.244 349 G CA 0.000 45.117 45.100 0.029 0.000 0.502 349 G HN 0.000 8.290 8.290 0.000 0.000 0.925