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 1qba_1_A DATA FIRST_RESID 28 DATA SEQUENCE DQQLVDQLSQ LKLNVKMLDN RAGENGVDcA ALGADWAScN RVLFTLSNDG DATA SEQUENCE QAIDGKDWVI YFHSPRQTLR VDNDQFKIAH LTGDLYKLEP TAKFSGFPAG DATA SEQUENCE KAVEIPVVAE YWQLFRNDFL PRWYATSGDA KPKMLANTDT ENLDQFVAPF DATA SEQUENCE TGDQWKRTKD DKNILMTPAS RFVSNADLQT LPAGALRGKI VPTPMQVKVH DATA SEQUENCE AQDADLRKGV ALDLSTLVKP AADVVSQRFA LLGVPVQTNG YPIKTDIQPG DATA SEQUENCE KFKGAMAVSG AYELKIGKKE AQVIGFDQAG VFYGLQSILS LVPSDGSGKI DATA SEQUENCE ATLDASDAPR FPYRGIFLDV ARNFHKKDAV LRLLDQMAAY KLNKFHFHLS DATA SEQUENCE DDEGWRIEIP GLPELTEVGG QRcHDLSETT cLLPQYGQGP DVYGGFFSRQ DATA SEQUENCE DYIDIIKYAQ ARQIEVIPEI DMPAHARAAV VSMEARYKKL HAAGKEQEAN DATA SEQUENCE EFRLVDPTDT SNTTSVQFFN RQSYLNPcLD SSQRFVDKVI GEIAQMHKEA DATA SEQUENCE GQPIKTWHFG GDEAKNIRLG AGYTDKAKPE PGKGIIDQGN EDKPWAKSQV DATA SEQUENCE cQTMIKEGKV ADMEHLPSYF GQEVSKLVKA HGIDRMQAWQ DGLKDAESSK DATA SEQUENCE AFATSRVGVN FWDTLYWGGF DSVNDWANKG YEVVVSNPDY VYMDFPYEVN DATA SEQUENCE PDERGYYWGT RFSDERKVFS FAPDNMPQNA ETSVDRDGNH FNAKSDKPWP DATA SEQUENCE GAYGLSAQLW SETQRTDPQM EYMIFPRALS VAERSWHRAG WEQDYRAGRE DATA SEQUENCE YKGGETHFVD TQALEKDWLR FANILGQREL AKLDKGGVAY RLPVPGARVA DATA SEQUENCE GGKLEANIAL PGLGIEYSTD GGKQWQRYDA KAKPAVSGEV QVRSVSPDGK DATA SEQUENCE RYSRAEKV 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 28 D HA 0.000 4.688 4.640 0.079 0.000 0.175 28 D C 0.000 176.347 176.300 0.078 0.000 2.045 28 D CA 0.000 54.050 54.000 0.084 0.000 0.868 28 D CB 0.000 40.842 40.800 0.070 0.000 0.688 29 Q N -0.787 119.049 119.800 0.061 0.000 2.119 29 Q HA -0.369 4.005 4.340 0.056 0.000 0.201 29 Q C 1.860 177.886 176.000 0.044 0.000 0.972 29 Q CA 3.529 59.362 55.803 0.051 0.000 0.847 29 Q CB -0.056 28.706 28.738 0.040 0.000 0.903 29 Q HN 0.491 8.795 8.270 0.056 0.000 0.433 30 Q N -1.726 118.101 119.800 0.045 0.000 2.084 30 Q HA -0.327 4.030 4.340 0.029 0.000 0.202 30 Q C 2.443 178.465 176.000 0.037 0.000 0.978 30 Q CA 3.499 59.325 55.803 0.038 0.000 0.844 30 Q CB -0.561 28.202 28.738 0.041 0.000 0.898 30 Q HN 0.361 8.660 8.270 0.049 0.000 0.426 31 L N 0.615 121.872 121.223 0.058 0.000 2.027 31 L HA -0.187 4.185 4.340 0.053 0.000 0.206 31 L C 2.044 178.925 176.870 0.018 0.000 1.074 31 L CA 2.505 57.381 54.840 0.060 0.000 0.745 31 L CB -0.364 41.771 42.059 0.126 0.000 0.898 31 L HN -0.506 7.990 8.230 0.070 -0.223 0.433 32 V N -0.090 119.850 119.914 0.043 0.000 2.332 32 V HA -0.542 3.589 4.120 0.018 0.000 0.248 32 V C 2.131 178.221 176.094 -0.006 0.000 1.055 32 V CA 4.497 66.814 62.300 0.028 0.000 1.038 32 V CB -1.088 30.771 31.823 0.060 0.000 0.651 32 V HN -0.279 7.951 8.190 0.067 0.000 0.450 33 D N -0.826 119.574 120.400 -0.000 0.000 2.144 33 D HA -0.254 4.382 4.640 -0.008 0.000 0.199 33 D C 2.819 179.096 176.300 -0.039 0.000 0.984 33 D CA 3.255 57.248 54.000 -0.012 0.000 0.834 33 D CB -0.531 40.269 40.800 0.000 0.000 0.955 33 D HN 0.150 8.459 8.370 0.015 0.070 0.465 34 Q N -0.571 119.202 119.800 -0.046 0.000 2.050 34 Q HA -0.336 3.965 4.340 -0.065 0.000 0.202 34 Q C 2.894 178.801 176.000 -0.155 0.000 0.980 34 Q CA 3.033 58.790 55.803 -0.077 0.000 0.840 34 Q CB 0.229 28.935 28.738 -0.053 0.000 0.898 34 Q HN -0.227 8.028 8.270 -0.025 0.000 0.424 35 L N -1.336 119.767 121.223 -0.200 0.000 2.131 35 L HA -0.312 3.759 4.340 -0.449 0.000 0.210 35 L C 2.267 179.004 176.870 -0.222 0.000 1.092 35 L CA 2.574 57.226 54.840 -0.313 0.000 0.759 35 L CB -0.342 41.509 42.059 -0.347 0.000 0.903 35 L HN -0.077 8.061 8.230 -0.153 0.000 0.435 36 S N -1.486 114.141 115.700 -0.123 0.000 2.442 36 S HA -0.320 4.112 4.470 -0.063 0.000 0.236 36 S C 1.197 175.740 174.600 -0.095 0.000 1.007 36 S CA 2.660 60.815 58.200 -0.076 0.000 0.965 36 S CB -0.347 62.835 63.200 -0.031 0.000 0.773 36 S HN 0.088 8.315 8.310 -0.100 0.024 0.504 37 Q N -0.534 119.197 119.800 -0.115 0.000 2.319 37 Q HA 0.099 4.387 4.340 -0.085 0.000 0.202 37 Q C -0.520 175.394 176.000 -0.144 0.000 0.896 37 Q CA -0.898 54.841 55.803 -0.106 0.000 0.942 37 Q CB 0.650 29.341 28.738 -0.079 0.000 1.083 37 Q HN -0.719 7.314 8.270 -0.128 0.160 0.510 38 L N -0.324 120.773 121.223 -0.211 0.000 2.456 38 L HA -0.067 4.294 4.340 -0.232 -0.160 0.272 38 L C 0.140 176.880 176.870 -0.216 0.000 1.189 38 L CA 0.121 54.806 54.840 -0.259 0.000 0.846 38 L CB 0.331 42.146 42.059 -0.406 0.000 1.111 38 L HN -0.655 7.259 8.230 -0.231 0.178 0.475 39 K N 1.595 121.884 120.400 -0.186 0.000 2.240 39 K HA 0.158 4.565 4.320 -0.173 -0.190 0.271 39 K C -1.083 175.390 176.600 -0.212 0.000 1.018 39 K CA -1.195 54.992 56.287 -0.167 0.000 0.874 39 K CB 1.360 33.798 32.500 -0.103 0.000 1.098 39 K HN 0.226 8.375 8.250 -0.169 0.000 0.458 40 L N 5.908 126.959 121.223 -0.287 0.000 2.334 40 L HA 0.532 4.805 4.340 -0.387 -0.165 0.277 40 L C -1.680 175.071 176.870 -0.197 0.000 1.075 40 L CA -1.034 53.575 54.840 -0.385 0.000 0.804 40 L CB 2.229 43.823 42.059 -0.776 0.000 1.174 40 L HN 0.241 8.638 8.230 -0.285 -0.338 0.438 41 N N 4.215 122.822 118.700 -0.155 0.000 2.295 41 N HA 0.367 5.268 4.740 -0.019 -0.172 0.293 41 N C -2.126 173.360 175.510 -0.039 0.000 1.040 41 N CA -0.653 52.361 53.050 -0.060 0.000 0.840 41 N CB 3.771 42.233 38.487 -0.043 0.000 1.468 41 N HN 0.361 8.627 8.380 -0.191 0.000 0.478 42 V N 5.136 125.030 119.914 -0.034 0.000 2.448 42 V HA 0.636 4.960 4.120 0.065 -0.165 0.295 42 V C -1.849 174.144 176.094 -0.169 0.000 1.025 42 V CA -1.702 60.561 62.300 -0.062 0.000 0.859 42 V CB 1.745 33.468 31.823 -0.166 0.000 0.988 42 V HN 0.968 9.135 8.190 -0.039 0.000 0.431 43 K N 6.817 127.122 120.400 -0.157 0.000 2.507 43 K HA 0.422 4.675 4.320 -0.112 0.000 0.252 43 K C -1.898 174.610 176.600 -0.152 0.000 0.943 43 K CA -1.770 54.437 56.287 -0.133 0.000 0.808 43 K CB 4.189 36.639 32.500 -0.083 0.000 1.142 43 K HN 0.593 8.765 8.250 -0.130 0.000 0.426 44 M N 6.539 126.057 119.600 -0.138 0.000 2.238 44 M HA -0.144 4.291 4.480 -0.074 0.000 0.350 44 M C -1.076 175.124 176.300 -0.167 0.000 1.321 44 M CA 1.084 56.293 55.300 -0.151 0.000 1.097 44 M CB -0.255 32.119 32.600 -0.378 0.000 1.713 44 M HN 0.741 8.973 8.290 -0.097 0.000 0.455 45 L N 6.259 127.407 121.223 -0.125 0.000 2.349 45 L HA 0.272 4.547 4.340 -0.109 0.000 0.200 45 L C 0.330 177.138 176.870 -0.103 0.000 1.064 45 L CA 0.707 55.483 54.840 -0.107 0.000 0.821 45 L CB 1.323 43.330 42.059 -0.087 0.000 1.027 45 L HN 0.327 8.498 8.230 -0.097 0.000 0.476 46 D N -3.682 116.667 120.400 -0.085 0.000 2.591 46 D HA 0.091 4.676 4.640 -0.091 0.000 0.222 46 D C -1.452 174.828 176.300 -0.034 0.000 1.360 46 D CA -0.298 53.659 54.000 -0.070 0.000 0.967 46 D CB 1.797 42.568 40.800 -0.049 0.000 1.456 46 D HN -0.410 7.918 8.370 -0.069 0.000 0.588 47 N N 4.085 122.760 118.700 -0.042 0.000 2.467 47 N HA -0.113 4.683 4.740 0.093 0.000 0.184 47 N C -0.113 175.450 175.510 0.088 0.000 1.106 47 N CA 1.038 54.115 53.050 0.046 0.000 0.892 47 N CB 0.361 38.867 38.487 0.033 0.000 0.969 47 N HN 0.545 8.869 8.380 -0.094 0.000 0.454 48 R N -1.833 118.682 120.500 0.026 0.000 2.795 48 R HA 0.366 4.759 4.340 0.088 0.000 0.320 48 R C -0.511 175.802 176.300 0.021 0.000 1.223 48 R CA -1.464 54.658 56.100 0.036 0.000 1.305 48 R CB -0.582 29.707 30.300 -0.019 0.000 1.318 48 R HN -0.275 8.231 8.270 -0.014 -0.244 0.636 49 A N 1.512 124.349 122.820 0.029 0.000 2.019 49 A HA -0.042 4.461 4.320 -0.004 -0.185 0.219 49 A C 1.018 178.610 177.584 0.013 0.000 1.164 49 A CA 2.878 54.921 52.037 0.009 0.000 0.644 49 A CB -0.126 18.877 19.000 0.004 0.000 0.805 49 A HN -0.099 8.080 8.150 0.049 0.000 0.449 50 G N -3.349 105.470 108.800 0.030 0.000 2.443 50 G HA2 -0.286 3.901 3.960 0.023 0.000 0.219 50 G HA3 -0.286 3.703 3.960 0.049 0.000 0.219 50 G C 1.672 176.587 174.900 0.024 0.000 1.131 50 G CA 1.476 46.595 45.100 0.033 0.000 0.775 50 G HN -0.176 8.117 8.290 0.049 0.026 0.547 51 E N -1.030 119.181 120.200 0.017 0.000 2.358 51 E HA -0.103 4.250 4.350 0.006 0.000 0.195 51 E C 0.366 176.963 176.600 -0.006 0.000 1.010 51 E CA 1.296 57.697 56.400 0.003 0.000 0.856 51 E CB 0.167 29.860 29.700 -0.011 0.000 0.795 51 E HN -0.550 7.693 8.360 0.022 0.130 0.504 52 N N -1.481 117.215 118.700 -0.007 0.000 2.401 52 N HA 0.111 4.843 4.740 -0.013 0.000 0.264 52 N C -0.224 175.280 175.510 -0.010 0.000 1.238 52 N CA -0.416 52.626 53.050 -0.012 0.000 0.889 52 N CB 0.337 38.811 38.487 -0.020 0.000 1.196 52 N HN -0.530 7.665 8.380 -0.002 0.183 0.511 53 G N -1.056 107.741 108.800 -0.005 0.000 2.194 53 G HA2 -0.426 3.533 3.960 -0.002 0.000 0.236 53 G HA3 -0.426 3.531 3.960 -0.006 0.000 0.236 53 G C -0.731 174.167 174.900 -0.003 0.000 0.987 53 G CA 0.150 45.247 45.100 -0.004 0.000 0.635 53 G HN -0.040 8.249 8.290 -0.002 0.000 0.520 54 V N 3.497 123.409 119.914 -0.003 0.000 2.546 54 V HA -0.052 4.065 4.120 -0.006 0.000 0.284 54 V C -0.966 175.128 176.094 -0.000 0.000 1.050 54 V CA -0.356 61.942 62.300 -0.004 0.000 0.981 54 V CB 0.110 31.928 31.823 -0.007 0.000 0.990 54 V HN -0.331 7.858 8.190 -0.002 0.000 0.474 55 D N 6.694 127.092 120.400 -0.003 0.000 2.517 55 D HA 0.061 4.704 4.640 0.004 0.000 0.220 55 D C 0.317 176.614 176.300 -0.006 0.000 1.158 55 D CA -1.078 52.922 54.000 -0.001 0.000 0.992 55 D CB -1.019 39.779 40.800 -0.002 0.000 1.058 55 D HN 0.450 8.817 8.370 -0.005 0.000 0.516 56 c N 3.579 122.177 118.600 -0.004 0.000 2.440 56 c HA -0.316 4.238 4.570 -0.027 0.000 0.278 56 c C 1.263 175.339 174.090 -0.023 0.000 1.295 56 c CA 2.734 59.053 56.329 -0.017 0.000 1.738 56 c CB 0.233 42.738 42.510 -0.009 0.000 1.987 56 c HN -0.060 8.173 8.230 0.005 0.000 0.492 57 A N -0.425 122.390 122.820 -0.008 0.000 1.883 57 A HA -0.299 4.087 4.320 -0.019 -0.077 0.217 57 A C 1.493 179.070 177.584 -0.012 0.000 1.186 57 A CA 3.000 55.030 52.037 -0.011 0.000 0.624 57 A CB -0.982 18.020 19.000 0.002 0.000 0.822 57 A HN 0.266 8.405 8.150 0.003 0.013 0.444 58 A N -2.100 120.713 122.820 -0.010 0.000 2.019 58 A HA -0.141 4.172 4.320 -0.011 0.000 0.219 58 A C 1.224 178.797 177.584 -0.018 0.000 1.164 58 A CA 2.320 54.350 52.037 -0.012 0.000 0.644 58 A CB -0.559 18.435 19.000 -0.010 0.000 0.805 58 A HN -0.537 7.893 8.150 -0.007 -0.284 0.449 59 L N -5.622 115.586 121.223 -0.024 0.000 2.599 59 L HA -0.158 4.163 4.340 -0.031 0.000 0.230 59 L C -0.166 176.680 176.870 -0.039 0.000 1.141 59 L CA -0.359 54.461 54.840 -0.034 0.000 0.877 59 L CB -0.098 41.937 42.059 -0.040 0.000 1.009 59 L HN -0.871 7.205 8.230 -0.023 0.140 0.447 60 G N -3.681 105.105 108.800 -0.024 0.000 2.149 60 G HA2 -0.327 3.855 3.960 0.029 0.000 0.235 60 G HA3 -0.327 3.629 3.960 -0.006 0.000 0.235 60 G C -0.483 174.438 174.900 0.035 0.000 1.018 60 G CA -0.228 44.877 45.100 0.008 0.000 0.728 60 G HN -0.526 7.554 8.290 -0.020 0.198 0.508 61 A N 0.030 122.818 122.820 -0.053 0.000 2.409 61 A HA -0.052 4.286 4.320 -0.185 -0.129 0.262 61 A C -1.205 176.223 177.584 -0.261 0.000 1.113 61 A CA -1.123 50.816 52.037 -0.163 0.000 0.790 61 A CB 1.076 19.969 19.000 -0.178 0.000 1.046 61 A HN -0.282 7.836 8.150 -0.054 0.000 0.496 62 D N 4.935 125.036 120.400 -0.498 0.000 2.531 62 D HA -0.368 3.671 4.640 -1.241 -0.143 0.239 62 D C 0.727 176.861 176.300 -0.276 0.000 1.144 62 D CA 1.284 54.814 54.000 -0.782 0.000 0.869 62 D CB 0.292 40.665 40.800 -0.711 0.000 1.160 62 D HN -0.093 8.330 8.370 -0.492 -0.349 0.484 63 W N 3.629 124.778 121.300 -0.250 0.000 5.271 63 W HA -0.500 4.258 4.660 -0.068 -0.138 0.364 63 W C -0.922 175.574 176.519 -0.039 0.000 1.342 63 W CA 0.779 58.077 57.345 -0.078 0.000 0.899 63 W CB -2.845 26.636 29.460 0.035 0.000 2.450 63 W HN 0.377 7.912 8.180 -0.867 0.125 1.508 64 A N -5.968 116.891 122.820 0.066 0.000 2.704 64 A HA -0.434 3.963 4.320 -0.007 -0.081 0.299 64 A C -1.268 176.366 177.584 0.083 0.000 1.507 64 A CA 1.179 53.248 52.037 0.052 0.000 0.776 64 A CB -1.513 17.534 19.000 0.079 0.000 1.027 64 A HN -0.199 7.886 8.150 -0.065 0.026 0.475 65 S N -2.145 113.596 115.700 0.068 0.000 2.449 65 S HA 0.215 4.786 4.470 0.169 0.000 0.310 65 S C -1.419 173.177 174.600 -0.007 0.000 1.096 65 S CA -0.111 58.166 58.200 0.128 0.000 1.095 65 S CB 1.260 64.663 63.200 0.338 0.000 1.007 65 S HN -0.554 7.739 8.310 -0.006 0.013 0.474 66 c N 2.032 120.659 118.600 0.044 0.000 3.288 66 c HA 0.698 5.413 4.570 -0.050 -0.174 0.318 66 c C -2.677 171.442 174.090 0.048 0.000 1.356 66 c CA -3.044 53.281 56.329 -0.006 0.000 1.359 66 c CB 3.772 46.253 42.510 -0.049 0.000 1.688 66 c HN 0.292 8.582 8.230 0.098 0.000 0.467 67 N N -1.094 117.626 118.700 0.033 0.000 2.262 67 N HA 0.598 5.442 4.740 0.043 -0.078 0.295 67 N C -1.421 174.094 175.510 0.009 0.000 1.161 67 N CA -0.888 52.192 53.050 0.050 0.000 0.767 67 N CB 3.700 42.253 38.487 0.110 0.000 1.499 67 N HN 0.700 9.080 8.380 -0.000 0.000 0.476 68 R N -0.427 120.069 120.500 -0.008 0.000 2.387 68 R HA 0.791 5.277 4.340 -0.055 -0.179 0.314 68 R C -1.666 174.595 176.300 -0.065 0.000 0.958 68 R CA -0.930 55.142 56.100 -0.046 0.000 0.846 68 R CB 2.401 32.671 30.300 -0.050 0.000 1.147 68 R HN 0.811 8.969 8.270 -0.003 0.110 0.447 69 V N 2.965 122.804 119.914 -0.125 0.000 2.769 69 V HA 0.507 4.652 4.120 -0.134 -0.105 0.312 69 V C -2.304 173.589 176.094 -0.335 0.000 1.061 69 V CA -2.077 60.107 62.300 -0.194 0.000 0.931 69 V CB 3.784 35.506 31.823 -0.169 0.000 1.010 69 V HN 0.649 8.749 8.190 -0.152 0.000 0.433 70 L N 4.614 125.664 121.223 -0.290 0.000 2.287 70 L HA 0.362 4.547 4.340 -0.259 0.000 0.287 70 L C -2.342 174.407 176.870 -0.201 0.000 1.022 70 L CA -1.376 53.317 54.840 -0.244 0.000 0.814 70 L CB 2.516 44.505 42.059 -0.117 0.000 1.217 70 L HN 0.955 8.939 8.230 -0.222 0.113 0.420 71 F N 7.868 127.778 119.950 -0.067 0.000 2.405 71 F HA 0.695 5.276 4.527 -0.148 -0.143 0.355 71 F C -0.195 175.534 175.800 -0.118 0.000 1.121 71 F CA -2.872 55.060 58.000 -0.113 0.000 1.112 71 F CB 1.125 40.071 39.000 -0.091 0.000 1.126 71 F HN 0.861 8.906 8.300 -0.256 0.101 0.481 72 T N 6.090 120.677 114.554 0.055 0.000 2.779 72 T HA 0.615 5.164 4.350 0.025 -0.184 0.280 72 T C -1.306 173.352 174.700 -0.070 0.000 0.987 72 T CA -0.228 61.871 62.100 -0.001 0.000 0.966 72 T CB 1.424 70.287 68.868 -0.009 0.000 0.933 72 T HN 1.046 9.203 8.240 0.038 0.106 0.442 73 L N 8.338 129.537 121.223 -0.039 0.000 2.294 73 L HA 0.464 4.881 4.340 -0.176 -0.182 0.283 73 L C -1.263 175.591 176.870 -0.027 0.000 1.015 73 L CA -1.071 53.713 54.840 -0.092 0.000 0.831 73 L CB 1.369 43.373 42.059 -0.091 0.000 1.217 73 L HN 0.962 9.208 8.230 0.027 0.000 0.420 74 S N 5.192 120.848 115.700 -0.073 0.000 2.489 74 S HA 0.321 4.936 4.470 0.009 -0.139 0.291 74 S C -1.517 173.044 174.600 -0.065 0.000 1.151 74 S CA -0.390 57.788 58.200 -0.036 0.000 1.082 74 S CB 1.540 64.718 63.200 -0.036 0.000 1.019 74 S HN 0.782 8.916 8.310 -0.117 0.106 0.492 75 N N 4.318 123.005 118.700 -0.021 0.000 2.476 75 N HA 0.242 4.935 4.740 -0.078 0.000 0.257 75 N C -1.293 174.209 175.510 -0.014 0.000 0.970 75 N CA -1.296 51.734 53.050 -0.032 0.000 0.938 75 N CB 2.113 40.611 38.487 0.018 0.000 1.144 75 N HN 0.030 8.421 8.380 0.019 0.000 0.500 76 D N 4.154 124.537 120.400 -0.029 0.000 2.340 76 D HA 0.082 4.717 4.640 -0.008 0.000 0.217 76 D C 0.109 176.402 176.300 -0.012 0.000 1.081 76 D CA -0.782 53.208 54.000 -0.017 0.000 0.842 76 D CB -0.160 40.627 40.800 -0.021 0.000 0.934 76 D HN 0.219 8.560 8.370 -0.049 0.000 0.511 77 G N -0.191 108.601 108.800 -0.014 0.000 2.971 77 G HA2 0.217 4.174 3.960 -0.005 0.000 0.235 77 G HA3 0.217 4.169 3.960 -0.013 0.000 0.235 77 G C -2.127 172.778 174.900 0.008 0.000 1.351 77 G CA -1.064 44.032 45.100 -0.007 0.000 1.039 77 G HN -0.544 7.932 8.290 -0.021 -0.199 0.563 78 Q N -1.753 118.054 119.800 0.012 0.000 2.443 78 Q HA -0.082 4.272 4.340 0.024 0.000 0.232 78 Q C -0.393 175.632 176.000 0.040 0.000 1.026 78 Q CA -0.341 55.477 55.803 0.024 0.000 0.924 78 Q CB 0.512 29.263 28.738 0.022 0.000 1.256 78 Q HN -0.058 8.216 8.270 0.007 0.000 0.519 79 A N 1.039 123.889 122.820 0.050 0.000 2.561 79 A HA 0.012 4.586 4.320 0.094 -0.197 0.234 79 A C -0.451 177.195 177.584 0.103 0.000 1.055 79 A CA 0.416 52.499 52.037 0.076 0.000 0.756 79 A CB 0.717 19.749 19.000 0.052 0.000 0.986 79 A HN 0.197 8.371 8.150 0.039 0.000 0.505 80 I N 3.007 123.682 120.570 0.176 0.000 2.359 80 I HA 0.085 4.359 4.170 0.172 0.000 0.284 80 I C -1.180 175.128 176.117 0.318 0.000 1.018 80 I CA -0.027 61.412 61.300 0.232 0.000 1.173 80 I CB 0.221 38.370 38.000 0.248 0.000 1.326 80 I HN 0.622 8.847 8.210 0.219 0.117 0.462 81 D N 6.926 127.471 120.400 0.242 0.000 2.441 81 D HA 0.110 4.856 4.640 0.176 0.000 0.210 81 D C 0.359 176.864 176.300 0.343 0.000 1.102 81 D CA -0.152 53.977 54.000 0.215 0.000 0.840 81 D CB 0.828 41.685 40.800 0.096 0.000 0.990 81 D HN 0.374 8.860 8.370 0.194 0.000 0.505 82 G N -0.125 108.900 108.800 0.375 0.000 2.554 82 G HA2 -0.062 4.079 3.960 0.302 0.000 0.238 82 G HA3 -0.062 4.118 3.960 0.367 0.000 0.238 82 G C -0.689 174.596 174.900 0.642 0.000 1.259 82 G CA -0.207 45.136 45.100 0.405 0.000 0.843 82 G HN -0.179 8.299 8.290 0.313 0.000 0.582 83 K N -0.319 120.318 120.400 0.395 0.000 2.373 83 K HA 0.074 4.473 4.320 0.132 0.000 0.200 83 K C -0.368 176.153 176.600 -0.132 0.000 1.054 83 K CA 0.346 56.715 56.287 0.136 0.000 1.065 83 K CB 1.174 33.727 32.500 0.088 0.000 0.886 83 K HN 0.163 8.579 8.250 0.277 0.000 0.546 84 D N 0.948 121.407 120.400 0.100 0.000 2.713 84 D HA 0.017 4.623 4.640 -0.057 0.000 0.229 84 D C -1.988 174.415 176.300 0.171 0.000 1.136 84 D CA -0.493 53.540 54.000 0.054 0.000 1.010 84 D CB -1.398 39.459 40.800 0.095 0.000 1.084 84 D HN 0.013 8.524 8.370 0.235 0.000 0.495 85 W N -1.530 119.780 121.300 0.016 0.000 3.167 85 W HA 0.519 5.346 4.660 0.041 -0.143 0.324 85 W C -2.935 173.573 176.519 -0.018 0.000 1.230 85 W CA -2.038 55.320 57.345 0.021 0.000 1.184 85 W CB 2.376 31.862 29.460 0.042 0.000 1.414 85 W HN -0.525 7.317 8.180 -0.472 0.055 0.551 86 V N -0.065 120.045 119.914 0.327 0.000 2.638 86 V HA 0.383 4.505 4.120 0.003 0.000 0.306 86 V C -1.866 174.344 176.094 0.195 0.000 1.052 86 V CA -1.675 60.689 62.300 0.106 0.000 0.885 86 V CB 3.248 34.984 31.823 -0.146 0.000 0.999 86 V HN 0.341 8.756 8.190 0.376 0.000 0.424 87 I N 6.022 126.698 120.570 0.177 0.000 2.321 87 I HA 0.307 4.667 4.170 0.067 -0.151 0.291 87 I C -1.298 174.656 176.117 -0.271 0.000 0.998 87 I CA -0.927 60.409 61.300 0.060 0.000 1.227 87 I CB 1.681 39.801 38.000 0.200 0.000 1.368 87 I HN 0.681 9.049 8.210 0.263 0.000 0.466 88 Y N 6.666 126.706 120.300 -0.434 0.000 2.342 88 Y HA 0.837 5.279 4.550 -0.525 -0.207 0.334 88 Y C -0.312 175.145 175.900 -0.739 0.000 1.067 88 Y CA -1.607 56.067 58.100 -0.710 0.000 1.128 88 Y CB 1.895 39.620 38.460 -1.226 0.000 1.200 88 Y HN 0.727 8.848 8.280 -0.265 0.000 0.464 89 F N -3.984 115.513 119.950 -0.755 0.000 2.662 89 F HA 0.587 4.584 4.527 -0.883 0.000 0.312 89 F C -2.653 172.797 175.800 -0.583 0.000 1.113 89 F CA -2.272 55.148 58.000 -0.967 0.000 0.951 89 F CB 2.912 40.733 39.000 -1.965 0.000 1.344 89 F HN 0.580 8.417 8.300 -0.770 0.000 0.462 90 H N -0.022 119.024 119.070 -0.041 0.000 2.529 90 H HA 1.051 5.901 4.556 0.031 -0.276 0.348 90 H C -0.719 174.771 175.328 0.269 0.000 1.152 90 H CA -1.301 54.798 56.048 0.085 0.000 1.202 90 H CB 3.211 33.062 29.762 0.148 0.000 1.562 90 H HN 0.257 8.594 8.280 0.095 0.000 0.515 91 S N -0.955 114.968 115.700 0.372 0.000 2.535 91 S HA 0.473 5.165 4.470 0.368 0.000 0.272 91 S C -1.914 172.850 174.600 0.273 0.000 1.149 91 S CA -3.784 54.607 58.200 0.318 0.000 0.888 91 S CB 1.789 65.119 63.200 0.217 0.000 1.110 91 S HN 0.336 8.879 8.310 0.388 0.000 0.463 92 P HA 0.055 4.641 4.420 0.276 0.000 0.241 92 P C -1.148 176.251 177.300 0.165 0.000 1.191 92 P CA 0.513 63.742 63.100 0.216 0.000 0.771 92 P CB 0.338 32.126 31.700 0.147 0.000 0.929 93 R N -1.514 119.031 120.500 0.075 0.000 2.589 93 R HA 0.275 4.655 4.340 0.066 0.000 0.293 93 R C -0.870 175.301 176.300 -0.216 0.000 0.963 93 R CA -3.004 53.092 56.100 -0.006 0.000 0.905 93 R CB 1.027 31.317 30.300 -0.018 0.000 1.144 93 R HN -0.482 7.764 8.270 0.073 0.068 0.459 94 Q N 3.028 122.633 119.800 -0.325 0.000 2.304 94 Q HA 0.008 4.044 4.340 -0.507 0.000 0.260 94 Q C -0.303 175.495 176.000 -0.338 0.000 0.965 94 Q CA 0.264 55.795 55.803 -0.453 0.000 0.898 94 Q CB 1.056 29.451 28.738 -0.571 0.000 1.196 94 Q HN 0.385 8.493 8.270 -0.270 0.000 0.402 95 T N 5.229 119.566 114.554 -0.361 0.000 2.814 95 T HA -0.004 4.439 4.350 -0.110 -0.159 0.297 95 T C 0.073 174.711 174.700 -0.103 0.000 0.956 95 T CA 1.741 63.741 62.100 -0.167 0.000 1.123 95 T CB 0.081 68.904 68.868 -0.074 0.000 0.902 95 T HN 0.393 8.294 8.240 -0.565 0.000 0.528 96 L N 5.197 126.370 121.223 -0.084 0.000 2.575 96 L HA 0.164 4.463 4.340 -0.070 0.000 0.228 96 L C -0.400 176.449 176.870 -0.035 0.000 1.075 96 L CA -0.143 54.655 54.840 -0.070 0.000 0.867 96 L CB 1.370 43.377 42.059 -0.086 0.000 1.097 96 L HN 0.842 8.913 8.230 -0.079 0.112 0.485 97 R N -3.117 117.371 120.500 -0.019 0.000 2.604 97 R HA 0.161 4.503 4.340 0.004 0.000 0.261 97 R C -2.862 173.448 176.300 0.016 0.000 1.080 97 R CA -0.599 55.500 56.100 -0.002 0.000 0.917 97 R CB 4.071 34.364 30.300 -0.011 0.000 1.252 97 R HN -0.718 7.539 8.270 -0.022 0.000 0.456 98 V N 4.958 124.896 119.914 0.041 0.000 2.487 98 V HA 0.355 4.644 4.120 0.062 -0.132 0.298 98 V C -1.185 174.949 176.094 0.067 0.000 1.028 98 V CA -0.697 61.646 62.300 0.072 0.000 0.860 98 V CB 1.970 33.868 31.823 0.125 0.000 0.991 98 V HN 0.446 8.659 8.190 0.038 0.000 0.427 99 D N 5.950 126.385 120.400 0.059 0.000 2.427 99 D HA 0.120 4.784 4.640 0.041 0.000 0.224 99 D C -0.916 175.432 176.300 0.080 0.000 1.157 99 D CA 0.263 54.293 54.000 0.050 0.000 0.828 99 D CB 0.402 41.213 40.800 0.018 0.000 0.974 99 D HN 0.553 8.952 8.370 0.049 0.000 0.498 100 N N -0.041 118.742 118.700 0.139 0.000 2.531 100 N HA 0.142 4.966 4.740 0.139 0.000 0.268 100 N C -0.371 175.252 175.510 0.189 0.000 1.023 100 N CA -1.340 51.828 53.050 0.196 0.000 0.896 100 N CB 2.004 40.687 38.487 0.326 0.000 1.233 100 N HN -0.370 8.031 8.380 0.158 0.074 0.512 101 D N 4.887 125.339 120.400 0.086 0.000 2.378 101 D HA -0.157 4.507 4.640 0.039 0.000 0.227 101 D C 0.981 177.255 176.300 -0.044 0.000 1.012 101 D CA 1.448 55.466 54.000 0.029 0.000 0.905 101 D CB -0.398 40.406 40.800 0.006 0.000 0.895 101 D HN 0.538 8.950 8.370 0.069 0.000 0.532 102 Q N -1.350 118.378 119.800 -0.118 0.000 2.472 102 Q HA 0.045 4.232 4.340 -0.255 0.000 0.208 102 Q C -0.393 175.153 176.000 -0.756 0.000 0.958 102 Q CA 1.465 57.030 55.803 -0.396 0.000 0.932 102 Q CB 0.909 29.342 28.738 -0.507 0.000 1.007 102 Q HN -0.342 8.155 8.270 -0.019 -0.238 0.508 103 F N -2.543 117.454 119.950 0.078 0.000 2.620 103 F HA 0.838 5.545 4.527 -0.005 -0.183 0.320 103 F C -1.541 174.276 175.800 0.028 0.000 1.069 103 F CA -1.834 56.196 58.000 0.050 0.000 0.953 103 F CB 4.552 43.628 39.000 0.127 0.000 1.322 103 F HN -0.500 7.767 8.300 0.052 0.064 0.479 104 K N -2.509 118.014 120.400 0.205 0.000 2.508 104 K HA 0.418 4.814 4.320 0.127 0.000 0.260 104 K C -2.298 174.379 176.600 0.128 0.000 0.949 104 K CA -0.989 55.370 56.287 0.120 0.000 0.834 104 K CB 3.526 36.042 32.500 0.028 0.000 1.365 104 K HN 0.948 9.327 8.250 0.216 0.000 0.437 105 I N 1.233 121.878 120.570 0.126 0.000 2.465 105 I HA 0.851 5.345 4.170 0.139 -0.241 0.291 105 I C -0.629 175.551 176.117 0.104 0.000 1.014 105 I CA -1.500 59.891 61.300 0.151 0.000 1.093 105 I CB 2.517 40.666 38.000 0.248 0.000 1.267 105 I HN 0.245 8.521 8.210 0.110 0.000 0.431 106 A N 6.377 129.238 122.820 0.069 0.000 2.413 106 A HA 0.507 4.875 4.320 0.080 0.000 0.307 106 A C -2.326 175.290 177.584 0.053 0.000 1.087 106 A CA -1.949 50.116 52.037 0.045 0.000 0.750 106 A CB 3.800 22.783 19.000 -0.028 0.000 1.296 106 A HN 0.682 8.853 8.150 0.034 0.000 0.423 107 H N 2.785 121.791 119.070 -0.108 0.000 2.548 107 H HA -0.023 4.173 4.556 -0.600 0.000 0.331 107 H C -1.067 174.060 175.328 -0.336 0.000 1.093 107 H CA 0.341 56.149 56.048 -0.400 0.000 1.367 107 H CB 1.392 30.933 29.762 -0.369 0.000 1.455 107 H HN 0.366 8.711 8.280 0.107 0.000 0.519 108 L N 6.315 127.130 121.223 -0.680 0.000 2.255 108 L HA 0.264 4.380 4.340 -0.374 0.000 0.196 108 L C -0.311 176.056 176.870 -0.840 0.000 1.202 108 L CA 0.579 55.103 54.840 -0.527 0.000 0.819 108 L CB 1.290 43.191 42.059 -0.264 0.000 1.006 108 L HN 0.821 8.500 8.230 -0.744 0.104 0.480 109 T N -4.531 109.516 114.554 -0.845 0.000 2.886 109 T HA 0.082 3.830 4.350 -1.003 0.000 0.330 109 T C -0.654 173.744 174.700 -0.504 0.000 1.488 109 T CA -0.640 61.058 62.100 -0.670 0.000 1.054 109 T CB 1.098 69.858 68.868 -0.180 0.000 1.348 109 T HN -0.594 7.265 8.240 -0.635 0.000 0.489 110 G N 7.051 115.451 108.800 -0.667 0.000 2.556 110 G HA2 -0.489 2.664 3.960 -1.663 0.000 0.283 110 G HA3 -0.489 2.845 3.960 -1.318 -0.165 0.283 110 G C -0.512 174.226 174.900 -0.271 0.000 1.177 110 G CA 1.086 45.513 45.100 -1.122 0.000 0.978 110 G HN 0.283 8.177 8.290 -0.510 0.090 0.554 111 D N 2.272 122.552 120.400 -0.200 0.000 2.328 111 D HA 0.063 4.821 4.640 0.198 0.000 0.221 111 D C -0.917 175.422 176.300 0.066 0.000 1.072 111 D CA -0.623 53.412 54.000 0.059 0.000 0.850 111 D CB 0.273 41.107 40.800 0.057 0.000 0.922 111 D HN 0.010 8.567 8.370 -0.289 -0.360 0.516 112 L N 1.201 122.300 121.223 -0.208 0.000 2.264 112 L HA 0.535 4.834 4.340 -0.352 -0.170 0.289 112 L C -2.371 174.098 176.870 -0.669 0.000 1.044 112 L CA -0.390 54.253 54.840 -0.329 0.000 0.807 112 L CB 1.275 43.225 42.059 -0.180 0.000 1.192 112 L HN -0.782 7.205 8.230 -0.260 0.086 0.425 113 Y N 5.889 125.853 120.300 -0.560 0.000 2.602 113 Y HA 0.563 4.996 4.550 -0.357 -0.097 0.342 113 Y C -1.318 174.167 175.900 -0.691 0.000 1.029 113 Y CA -1.878 55.835 58.100 -0.644 0.000 1.080 113 Y CB 4.642 42.489 38.460 -1.023 0.000 1.284 113 Y HN 0.963 8.884 8.280 -0.599 0.000 0.485 114 K N -1.254 118.944 120.400 -0.335 0.000 2.427 114 K HA 0.827 5.012 4.320 -0.546 -0.192 0.252 114 K C -1.838 174.696 176.600 -0.110 0.000 0.931 114 K CA -1.963 54.073 56.287 -0.418 0.000 0.793 114 K CB 3.609 35.717 32.500 -0.653 0.000 1.211 114 K HN 1.124 9.158 8.250 -0.175 0.111 0.426 115 L N 5.410 126.622 121.223 -0.018 0.000 2.272 115 L HA 0.799 5.439 4.340 0.162 -0.203 0.289 115 L C -2.000 174.917 176.870 0.077 0.000 1.032 115 L CA -0.943 53.985 54.840 0.147 0.000 0.810 115 L CB 2.483 44.687 42.059 0.241 0.000 1.205 115 L HN 1.088 9.135 8.230 -0.115 0.114 0.422 116 E N 6.024 126.215 120.200 -0.015 0.000 2.369 116 E HA 0.603 4.592 4.350 -0.602 0.000 0.270 116 E C -2.674 173.716 176.600 -0.349 0.000 0.909 116 E CA -3.583 52.605 56.400 -0.353 0.000 0.775 116 E CB 3.687 33.188 29.700 -0.331 0.000 1.270 116 E HN 0.951 9.348 8.360 0.062 0.000 0.445 117 P HA 0.538 4.790 4.420 -0.645 -0.218 0.278 117 P C 0.213 177.273 177.300 -0.400 0.000 1.238 117 P CA -0.964 61.701 63.100 -0.726 0.000 0.794 117 P CB 0.733 31.736 31.700 -1.162 0.000 0.955 118 T N -1.088 113.305 114.554 -0.268 0.000 2.880 118 T HA 0.083 4.346 4.350 -0.146 0.000 0.279 118 T C 1.241 175.879 174.700 -0.103 0.000 0.990 118 T CA -2.330 59.676 62.100 -0.157 0.000 0.938 118 T CB 1.832 70.632 68.868 -0.113 0.000 1.206 118 T HN 0.200 8.126 8.240 -0.322 0.121 0.573 119 A N -0.824 121.952 122.820 -0.074 0.000 2.070 119 A HA -0.125 4.172 4.320 -0.038 0.000 0.220 119 A C 0.773 178.336 177.584 -0.035 0.000 1.159 119 A CA 2.423 54.433 52.037 -0.044 0.000 0.656 119 A CB -0.545 18.430 19.000 -0.042 0.000 0.800 119 A HN 0.431 8.537 8.150 -0.075 0.000 0.453 120 K N -3.587 116.782 120.400 -0.051 0.000 2.459 120 K HA -0.075 4.207 4.320 -0.064 0.000 0.193 120 K C 0.284 176.835 176.600 -0.082 0.000 1.030 120 K CA 0.110 56.358 56.287 -0.065 0.000 1.026 120 K CB -0.204 32.253 32.500 -0.071 0.000 0.809 120 K HN -0.682 7.496 8.250 -0.064 0.033 0.504 121 F N 2.236 122.040 119.950 -0.244 0.000 2.578 121 F HA -0.233 4.223 4.527 -0.403 -0.172 0.376 121 F C 0.250 175.947 175.800 -0.170 0.000 1.085 121 F CA 0.952 58.770 58.000 -0.303 0.000 1.260 121 F CB 0.969 39.777 39.000 -0.319 0.000 1.095 121 F HN -0.601 7.540 8.300 0.031 0.178 0.573 122 S N 7.104 122.304 115.700 -0.833 0.000 2.749 122 S HA 0.150 4.330 4.470 -0.483 0.000 0.246 122 S C -0.480 173.650 174.600 -0.783 0.000 1.023 122 S CA -0.752 57.074 58.200 -0.623 0.000 1.012 122 S CB 2.084 65.091 63.200 -0.323 0.000 0.942 122 S HN 0.378 8.457 8.310 -0.897 -0.308 0.531 123 G N 0.653 108.485 108.800 -1.613 0.000 2.619 123 G HA2 -0.181 3.277 3.960 -0.984 0.000 0.686 123 G HA3 -0.181 3.674 3.960 -0.455 -0.169 0.686 123 G C -1.161 173.450 174.900 -0.482 0.000 1.256 123 G CA -0.505 44.025 45.100 -0.950 0.000 0.826 123 G HN -0.659 5.714 8.290 -3.195 0.000 0.619 124 F N 1.137 121.145 119.950 0.098 0.000 2.350 124 F HA 0.348 4.963 4.527 0.146 0.000 0.365 124 F C -1.682 174.142 175.800 0.040 0.000 1.122 124 F CA -1.773 56.303 58.000 0.127 0.000 1.139 124 F CB 0.541 39.625 39.000 0.140 0.000 1.220 124 F HN 0.383 8.832 8.300 0.426 0.107 0.499 125 P HA 0.009 4.467 4.420 0.064 0.000 0.269 125 P C -1.292 176.063 177.300 0.092 0.000 1.215 125 P CA -0.690 62.459 63.100 0.082 0.000 0.780 125 P CB 0.828 32.553 31.700 0.042 0.000 0.898 126 A N 0.673 123.527 122.820 0.057 0.000 2.524 126 A HA -0.180 4.287 4.320 0.048 -0.118 0.250 126 A C 1.006 178.611 177.584 0.035 0.000 1.078 126 A CA 0.856 52.918 52.037 0.043 0.000 0.761 126 A CB 0.058 19.075 19.000 0.029 0.000 1.012 126 A HN 0.116 8.292 8.150 0.044 0.000 0.500 127 G N 1.990 110.808 108.800 0.029 0.000 2.166 127 G HA2 -0.433 3.649 3.960 0.014 0.000 0.260 127 G HA3 -0.433 3.537 3.960 0.017 0.000 0.260 127 G C -0.868 174.049 174.900 0.027 0.000 0.986 127 G CA 0.664 45.777 45.100 0.021 0.000 0.683 127 G HN 0.118 8.424 8.290 0.026 0.000 0.527 128 K N -0.416 120.011 120.400 0.045 0.000 2.352 128 K HA 0.417 4.759 4.320 0.037 0.000 0.240 128 K C -1.740 174.902 176.600 0.069 0.000 1.017 128 K CA -2.209 54.108 56.287 0.051 0.000 0.851 128 K CB 2.530 35.064 32.500 0.057 0.000 1.261 128 K HN -0.606 7.636 8.250 0.058 0.042 0.451 129 A N -0.081 122.777 122.820 0.065 0.000 2.324 129 A HA 0.488 5.027 4.320 0.091 -0.165 0.330 129 A C -0.766 176.884 177.584 0.110 0.000 1.165 129 A CA -1.269 50.813 52.037 0.074 0.000 0.813 129 A CB 1.639 20.662 19.000 0.039 0.000 1.197 129 A HN 0.149 8.330 8.150 0.051 0.000 0.484 130 V N 3.238 123.247 119.914 0.159 0.000 2.459 130 V HA 0.131 4.344 4.120 0.155 0.000 0.295 130 V C -1.247 174.921 176.094 0.124 0.000 1.029 130 V CA -0.896 61.515 62.300 0.185 0.000 0.874 130 V CB 2.746 34.755 31.823 0.311 0.000 0.985 130 V HN 0.907 9.088 8.190 0.166 0.109 0.438 131 E N 6.551 126.815 120.200 0.107 0.000 2.151 131 E HA 0.443 4.964 4.350 0.058 -0.136 0.275 131 E C -0.952 175.698 176.600 0.083 0.000 0.936 131 E CA -1.007 55.436 56.400 0.072 0.000 0.777 131 E CB 1.722 31.452 29.700 0.049 0.000 1.108 131 E HN 0.259 8.692 8.360 0.122 0.000 0.401 132 I N 5.587 126.191 120.570 0.056 0.000 2.537 132 I HA 0.450 4.678 4.170 0.097 0.000 0.276 132 I C -2.850 173.264 176.117 -0.006 0.000 1.063 132 I CA -3.114 58.223 61.300 0.061 0.000 1.144 132 I CB 1.464 39.478 38.000 0.024 0.000 1.252 132 I HN 0.929 9.066 8.210 0.057 0.108 0.480 133 P HA 0.480 4.950 4.420 -0.174 -0.154 0.280 133 P C -1.267 175.970 177.300 -0.106 0.000 1.244 133 P CA -0.795 62.244 63.100 -0.101 0.000 0.784 133 P CB 0.239 31.907 31.700 -0.053 0.000 0.913 134 V N -1.739 118.056 119.914 -0.198 0.000 3.040 134 V HA 0.832 5.038 4.120 -0.062 -0.123 0.312 134 V C -2.251 173.777 176.094 -0.110 0.000 1.115 134 V CA -3.126 59.093 62.300 -0.135 0.000 0.998 134 V CB 4.259 35.993 31.823 -0.149 0.000 1.042 134 V HN 0.956 8.973 8.190 -0.288 0.000 0.433 135 V N 1.438 121.314 119.914 -0.064 0.000 2.417 135 V HA 0.490 4.702 4.120 -0.055 -0.124 0.291 135 V C -1.563 174.497 176.094 -0.058 0.000 1.024 135 V CA -1.724 60.543 62.300 -0.054 0.000 0.861 135 V CB 1.113 32.911 31.823 -0.042 0.000 0.985 135 V HN 0.436 8.493 8.190 -0.044 0.107 0.436 136 A N 6.714 129.502 122.820 -0.053 0.000 2.354 136 A HA 0.943 5.408 4.320 -0.100 -0.205 0.321 136 A C -1.759 175.761 177.584 -0.107 0.000 1.125 136 A CA -3.032 48.963 52.037 -0.071 0.000 0.799 136 A CB 3.705 22.694 19.000 -0.018 0.000 1.293 136 A HN 1.064 9.192 8.150 -0.036 0.000 0.452 137 E N 1.620 121.712 120.200 -0.181 0.000 2.398 137 E HA -0.248 3.912 4.350 -0.316 0.000 0.263 137 E C -0.411 176.010 176.600 -0.298 0.000 1.046 137 E CA 0.847 57.051 56.400 -0.326 0.000 0.908 137 E CB 1.011 30.438 29.700 -0.456 0.000 0.963 137 E HN -0.337 7.911 8.360 -0.187 0.000 0.431 138 Y N -0.881 119.226 120.300 -0.321 0.000 2.896 138 Y HA -0.427 3.689 4.550 -0.723 0.000 0.466 138 Y C -1.393 174.304 175.900 -0.337 0.000 1.198 138 Y CA 2.579 60.249 58.100 -0.716 0.000 2.512 138 Y CB -1.275 36.420 38.460 -1.276 0.000 1.232 138 Y HN 0.281 8.201 8.280 -0.601 0.000 0.632 139 W N -5.808 115.672 121.300 0.299 0.000 3.137 139 W HA 0.437 5.338 4.660 0.166 -0.141 0.324 139 W C -1.580 175.092 176.519 0.255 0.000 1.253 139 W CA -1.534 55.943 57.345 0.220 0.000 1.183 139 W CB 2.525 32.109 29.460 0.206 0.000 1.424 139 W HN -0.457 7.199 8.180 -0.873 0.000 0.566 140 Q N -0.764 119.321 119.800 0.474 0.000 2.932 140 Q HA 0.299 5.056 4.340 0.443 -0.152 0.248 140 Q C -0.749 175.581 176.000 0.550 0.000 0.982 140 Q CA -1.099 54.961 55.803 0.428 0.000 0.730 140 Q CB 1.020 29.860 28.738 0.170 0.000 1.249 140 Q HN 0.494 9.452 8.270 0.441 -0.423 0.476 141 L N -0.103 121.429 121.223 0.515 0.000 2.418 141 L HA 0.048 4.607 4.340 0.365 0.000 0.218 141 L C -0.698 176.161 176.870 -0.017 0.000 1.125 141 L CA 0.747 55.740 54.840 0.256 0.000 0.835 141 L CB 0.969 42.968 42.059 -0.100 0.000 0.953 141 L HN -0.233 8.473 8.230 0.701 -0.056 0.454 142 F N -3.952 116.004 119.950 0.009 0.000 2.520 142 F HA 0.316 4.675 4.527 -0.280 0.000 0.322 142 F C 0.569 176.308 175.800 -0.102 0.000 1.103 142 F CA -1.485 56.436 58.000 -0.131 0.000 0.926 142 F CB 2.330 41.308 39.000 -0.035 0.000 1.154 142 F HN -1.029 7.660 8.300 0.443 -0.122 0.453 143 R N 2.656 123.070 120.500 -0.143 0.000 2.200 143 R HA -0.413 4.108 4.340 0.301 0.000 0.234 143 R C 1.746 178.203 176.300 0.262 0.000 1.127 143 R CA 4.002 60.142 56.100 0.066 0.000 0.989 143 R CB -0.326 29.912 30.300 -0.104 0.000 0.869 143 R HN 0.440 8.504 8.270 -0.343 0.000 0.459 144 N N -1.845 116.997 118.700 0.236 0.000 2.443 144 N HA -0.266 4.615 4.740 0.235 0.000 0.184 144 N C 0.508 176.183 175.510 0.276 0.000 1.037 144 N CA 2.070 55.271 53.050 0.252 0.000 0.896 144 N CB -0.462 38.173 38.487 0.248 0.000 0.959 144 N HN 0.080 8.568 8.380 0.240 0.035 0.442 145 D N -1.750 118.769 120.400 0.199 0.000 2.219 145 D HA -0.207 4.515 4.640 0.137 0.000 0.205 145 D C 0.456 176.704 176.300 -0.086 0.000 0.970 145 D CA 2.413 56.430 54.000 0.028 0.000 0.851 145 D CB 0.268 40.989 40.800 -0.133 0.000 0.943 145 D HN -0.337 7.986 8.370 0.217 0.176 0.488 146 F N -1.164 119.009 119.950 0.371 0.000 2.411 146 F HA 0.022 4.837 4.527 0.479 0.000 0.355 146 F C -0.513 175.581 175.800 0.490 0.000 1.117 146 F CA 0.118 58.380 58.000 0.437 0.000 1.139 146 F CB 0.230 39.471 39.000 0.401 0.000 1.120 146 F HN -0.628 7.667 8.300 0.229 0.143 0.493 147 L N 3.480 125.131 121.223 0.713 0.000 2.325 147 L HA 0.378 5.045 4.340 0.545 0.000 0.279 147 L C -1.727 175.553 176.870 0.683 0.000 1.054 147 L CA -2.761 52.449 54.840 0.618 0.000 0.804 147 L CB 0.836 43.197 42.059 0.504 0.000 1.200 147 L HN 0.285 8.961 8.230 0.743 0.000 0.436 148 P HA 0.094 4.450 4.420 -0.106 0.000 0.279 148 P C -1.265 176.199 177.300 0.274 0.000 1.282 148 P CA -0.762 62.492 63.100 0.255 0.000 0.788 148 P CB 0.758 32.622 31.700 0.273 0.000 1.139 149 R N -7.049 113.539 120.500 0.147 0.000 3.201 149 R HA -0.472 3.964 4.340 0.159 0.000 0.254 149 R C -0.696 175.867 176.300 0.438 0.000 0.978 149 R CA 0.546 56.793 56.100 0.246 0.000 0.661 149 R CB -2.799 27.631 30.300 0.216 0.000 1.170 149 R HN -0.016 8.094 8.270 -0.082 0.111 0.430 150 W N -2.426 118.912 121.300 0.063 0.000 2.158 150 W HA -0.065 4.797 4.660 0.096 -0.145 0.339 150 W C 0.501 177.108 176.519 0.148 0.000 1.294 150 W CA -0.203 57.178 57.345 0.059 0.000 1.231 150 W CB 0.320 29.724 29.460 -0.094 0.000 1.143 150 W HN -0.662 7.807 8.180 0.481 0.000 0.571 151 Y N -4.246 116.185 120.300 0.219 0.000 2.597 151 Y HA 0.606 5.323 4.550 0.105 -0.104 0.340 151 Y C -2.736 173.247 175.900 0.138 0.000 1.097 151 Y CA -2.137 56.038 58.100 0.126 0.000 1.037 151 Y CB 2.912 41.408 38.460 0.060 0.000 1.305 151 Y HN 0.738 8.990 8.280 -0.047 0.000 0.463 152 A N -0.568 122.412 122.820 0.266 0.000 2.355 152 A HA 1.004 5.588 4.320 0.177 -0.157 0.324 152 A C -1.357 176.363 177.584 0.227 0.000 1.117 152 A CA -2.093 50.056 52.037 0.187 0.000 0.785 152 A CB 3.048 22.090 19.000 0.070 0.000 1.254 152 A HN 0.918 9.129 8.150 0.275 0.105 0.453 153 T N -1.973 112.727 114.554 0.243 0.000 2.883 153 T HA 0.426 4.879 4.350 0.172 0.000 0.296 153 T C -1.811 173.030 174.700 0.234 0.000 1.117 153 T CA -2.128 60.105 62.100 0.221 0.000 1.006 153 T CB 3.092 72.115 68.868 0.257 0.000 1.191 153 T HN 0.713 9.114 8.240 0.267 0.000 0.508 154 S N 2.377 118.192 115.700 0.191 0.000 2.584 154 S HA 0.144 4.827 4.470 0.204 -0.092 0.280 154 S C 0.353 175.036 174.600 0.140 0.000 1.162 154 S CA -1.291 57.021 58.200 0.187 0.000 0.951 154 S CB 1.096 64.412 63.200 0.193 0.000 1.108 154 S HN 0.126 8.534 8.310 0.163 0.000 0.464 155 G N 7.515 116.389 108.800 0.122 0.000 2.787 155 G HA2 -0.538 3.475 3.960 0.088 0.000 0.374 155 G HA3 -0.538 3.474 3.960 0.086 0.000 0.374 155 G C 0.423 175.377 174.900 0.090 0.000 1.003 155 G CA 2.155 47.312 45.100 0.095 0.000 0.833 155 G HN 0.721 9.086 8.290 0.124 0.000 0.824 156 D N 4.392 124.839 120.400 0.077 0.000 2.156 156 D HA -0.248 4.427 4.640 0.059 0.000 0.190 156 D C 0.596 176.938 176.300 0.069 0.000 0.998 156 D CA 1.019 55.058 54.000 0.066 0.000 0.842 156 D CB -0.241 40.595 40.800 0.060 0.000 0.974 156 D HN 0.267 8.682 8.370 0.076 0.000 0.447 157 A N -1.258 121.606 122.820 0.072 0.000 2.639 157 A HA -0.322 4.165 4.320 0.057 -0.133 0.229 157 A C 0.605 178.230 177.584 0.068 0.000 1.062 157 A CA 1.016 53.094 52.037 0.068 0.000 0.761 157 A CB 0.368 19.415 19.000 0.078 0.000 0.988 157 A HN -0.340 7.856 8.150 0.077 0.000 0.510 158 K N 3.742 124.173 120.400 0.052 0.000 2.249 158 K HA 0.254 4.600 4.320 0.044 0.000 0.280 158 K C -1.694 174.928 176.600 0.038 0.000 1.033 158 K CA -2.732 53.580 56.287 0.041 0.000 0.946 158 K CB -1.208 31.308 32.500 0.027 0.000 1.005 158 K HN -0.192 8.355 8.250 0.046 -0.270 0.469 159 P HA 0.187 4.870 4.420 0.069 -0.222 0.268 159 P C -0.731 176.572 177.300 0.006 0.000 1.205 159 P CA -0.344 62.761 63.100 0.009 0.000 0.771 159 P CB 0.567 32.187 31.700 -0.135 0.000 0.858 160 K N 3.260 123.696 120.400 0.061 0.000 2.427 160 K HA 0.336 4.667 4.320 0.018 0.000 0.252 160 K C -0.704 175.959 176.600 0.104 0.000 0.931 160 K CA -1.565 54.752 56.287 0.050 0.000 0.793 160 K CB 3.992 36.513 32.500 0.033 0.000 1.211 160 K HN 0.041 8.357 8.250 0.111 0.000 0.426 161 M N 1.979 121.631 119.600 0.087 0.000 2.226 161 M HA -0.069 4.695 4.480 0.231 -0.145 0.324 161 M C 0.321 176.662 176.300 0.069 0.000 1.112 161 M CA 0.783 56.161 55.300 0.130 0.000 1.176 161 M CB 0.975 33.632 32.600 0.096 0.000 1.430 161 M HN 0.328 8.645 8.290 0.045 0.000 0.462 162 L N 0.546 121.808 121.223 0.065 0.000 2.485 162 L HA -0.112 4.413 4.340 -0.055 -0.218 0.279 162 L C 1.151 177.983 176.870 -0.064 0.000 1.124 162 L CA -0.049 54.769 54.840 -0.037 0.000 0.888 162 L CB -1.051 40.952 42.059 -0.093 0.000 1.217 162 L HN 0.189 8.392 8.230 0.145 0.114 0.464 163 A N 9.038 131.825 122.820 -0.055 0.000 1.948 163 A HA -0.414 3.894 4.320 -0.020 0.000 0.220 163 A C 1.412 178.965 177.584 -0.050 0.000 1.177 163 A CA 3.687 55.701 52.037 -0.039 0.000 0.636 163 A CB -0.234 18.749 19.000 -0.029 0.000 0.815 163 A HN 0.303 8.419 8.150 -0.058 0.000 0.449 164 N N -4.744 113.908 118.700 -0.080 0.000 2.520 164 N HA -0.209 4.520 4.740 -0.018 0.000 0.185 164 N C 0.389 175.841 175.510 -0.096 0.000 1.068 164 N CA 1.737 54.752 53.050 -0.058 0.000 0.911 164 N CB -0.415 38.039 38.487 -0.054 0.000 0.961 164 N HN 0.406 8.726 8.380 -0.100 0.000 0.446 165 T N -6.449 107.963 114.554 -0.236 0.000 3.107 165 T HA -0.019 3.817 4.350 -0.856 0.000 0.249 165 T C -0.171 174.404 174.700 -0.210 0.000 1.096 165 T CA 0.533 62.335 62.100 -0.498 0.000 1.012 165 T CB 0.869 69.337 68.868 -0.667 0.000 0.977 165 T HN -0.456 7.498 8.240 -0.195 0.169 0.527 166 D N 2.853 123.219 120.400 -0.058 0.000 2.551 166 D HA 0.026 4.688 4.640 0.036 0.000 0.223 166 D C -0.795 175.540 176.300 0.058 0.000 1.144 166 D CA 0.249 54.260 54.000 0.018 0.000 1.025 166 D CB -1.384 39.431 40.800 0.025 0.000 1.085 166 D HN -0.485 7.675 8.370 -0.059 0.174 0.506 167 T N 2.577 117.191 114.554 0.101 0.000 2.827 167 T HA 0.122 4.539 4.350 0.112 0.000 0.328 167 T C -0.891 173.926 174.700 0.195 0.000 1.598 167 T CA -0.832 61.355 62.100 0.144 0.000 1.043 167 T CB 1.028 70.001 68.868 0.174 0.000 1.447 167 T HN -0.298 7.977 8.240 0.099 0.025 0.491 168 E N 1.029 121.320 120.200 0.153 0.000 2.472 168 E HA 0.100 4.559 4.350 0.181 0.000 0.196 168 E C -0.793 175.891 176.600 0.139 0.000 1.033 168 E CA 0.297 56.786 56.400 0.149 0.000 0.886 168 E CB 0.049 29.807 29.700 0.096 0.000 0.944 168 E HN 0.172 8.604 8.360 0.119 0.000 0.492 169 N N 1.658 120.443 118.700 0.140 0.000 2.521 169 N HA 0.066 4.842 4.740 0.061 0.000 0.236 169 N C 0.798 176.357 175.510 0.082 0.000 1.067 169 N CA -1.098 52.007 53.050 0.092 0.000 0.939 169 N CB -0.344 38.188 38.487 0.074 0.000 1.201 169 N HN -0.369 8.055 8.380 0.154 0.049 0.511 170 L N 5.774 126.988 121.223 -0.014 0.000 2.265 170 L HA -0.311 3.720 4.340 -0.517 0.000 0.215 170 L C 0.891 177.571 176.870 -0.316 0.000 1.117 170 L CA 2.301 56.972 54.840 -0.282 0.000 0.782 170 L CB -0.425 41.507 42.059 -0.211 0.000 0.914 170 L HN 0.047 8.283 8.230 0.010 0.000 0.441 171 D N -1.976 118.353 120.400 -0.117 0.000 2.265 171 D HA -0.210 4.368 4.640 -0.103 0.000 0.208 171 D C 1.640 177.912 176.300 -0.046 0.000 0.977 171 D CA 2.352 56.306 54.000 -0.077 0.000 0.871 171 D CB -0.696 40.091 40.800 -0.021 0.000 0.925 171 D HN -0.382 8.122 8.370 -0.060 -0.170 0.485 172 Q N -2.700 117.109 119.800 0.015 0.000 2.224 172 Q HA -0.227 4.160 4.340 0.078 0.000 0.203 172 Q C 1.096 177.201 176.000 0.175 0.000 0.970 172 Q CA 1.996 57.868 55.803 0.116 0.000 0.865 172 Q CB 0.911 29.772 28.738 0.205 0.000 0.922 172 Q HN -0.264 7.870 8.270 0.024 0.151 0.445 173 F N -9.653 110.284 119.950 -0.021 0.000 2.974 173 F HA 0.369 4.844 4.527 -0.086 0.000 0.357 173 F C -2.174 173.587 175.800 -0.064 0.000 1.114 173 F CA -1.358 56.600 58.000 -0.070 0.000 1.099 173 F CB 2.138 41.069 39.000 -0.116 0.000 1.205 173 F HN -0.274 7.686 8.300 -0.332 0.141 0.535 174 V N 3.099 122.738 119.914 -0.458 0.000 2.409 174 V HA 0.385 4.491 4.120 -0.262 -0.143 0.291 174 V C -0.910 175.100 176.094 -0.140 0.000 1.020 174 V CA -1.687 60.417 62.300 -0.326 0.000 0.848 174 V CB 1.691 33.286 31.823 -0.380 0.000 0.990 174 V HN 0.202 8.087 8.190 -0.509 0.000 0.430 175 A N 8.235 131.014 122.820 -0.069 0.000 2.425 175 A HA 0.267 4.582 4.320 -0.008 0.000 0.242 175 A C -1.910 175.727 177.584 0.088 0.000 1.077 175 A CA -1.544 50.495 52.037 0.003 0.000 0.781 175 A CB -0.956 18.046 19.000 0.003 0.000 1.020 175 A HN 1.021 9.114 8.150 -0.095 0.000 0.494 176 P HA -0.035 4.452 4.420 0.111 0.000 0.269 176 P C -1.331 176.153 177.300 0.308 0.000 1.209 176 P CA -0.391 62.795 63.100 0.142 0.000 0.776 176 P CB 0.309 32.060 31.700 0.085 0.000 0.876 177 F N 2.106 122.075 119.950 0.032 0.000 2.418 177 F HA 0.171 4.861 4.527 0.045 -0.137 0.341 177 F C 0.981 176.809 175.800 0.047 0.000 1.120 177 F CA -0.974 57.055 58.000 0.049 0.000 1.232 177 F CB 0.927 39.968 39.000 0.068 0.000 1.175 177 F HN 0.263 8.752 8.300 0.315 0.000 0.569 178 T N 0.764 115.416 114.554 0.163 0.000 2.907 178 T HA 0.208 4.631 4.350 0.122 0.000 0.290 178 T C 0.454 175.209 174.700 0.091 0.000 1.066 178 T CA -1.365 60.797 62.100 0.104 0.000 1.012 178 T CB 3.034 71.927 68.868 0.042 0.000 1.184 178 T HN 0.394 8.986 8.240 0.049 -0.324 0.522 179 G N 2.558 111.412 108.800 0.089 0.000 2.652 179 G HA2 -0.399 3.613 3.960 0.087 0.000 0.318 179 G HA3 -0.399 3.578 3.960 0.028 0.000 0.318 179 G C -0.751 174.232 174.900 0.140 0.000 1.295 179 G CA 1.508 46.656 45.100 0.080 0.000 0.999 179 G HN 0.346 8.686 8.290 0.082 0.000 0.548 180 D N 2.777 123.169 120.400 -0.014 0.000 2.491 180 D HA 0.048 4.498 4.640 -0.316 0.000 0.228 180 D C 0.937 176.976 176.300 -0.434 0.000 1.183 180 D CA -0.639 53.210 54.000 -0.251 0.000 0.827 180 D CB -1.276 39.368 40.800 -0.260 0.000 0.989 180 D HN 0.229 8.569 8.370 -0.051 0.000 0.494 181 Q N -0.194 119.488 119.800 -0.196 0.000 2.364 181 Q HA -0.210 3.968 4.340 -0.270 0.000 0.209 181 Q C 0.953 176.881 176.000 -0.120 0.000 0.977 181 Q CA 2.686 58.350 55.803 -0.233 0.000 0.885 181 Q CB -0.009 28.510 28.738 -0.366 0.000 0.941 181 Q HN -0.170 7.985 8.270 -0.047 0.086 0.464 182 W N -6.451 114.868 121.300 0.032 0.000 2.678 182 W HA 0.040 4.721 4.660 0.036 0.000 0.256 182 W C -0.969 175.494 176.519 -0.093 0.000 1.280 182 W CA -1.900 55.436 57.345 -0.015 0.000 1.345 182 W CB -0.435 28.963 29.460 -0.103 0.000 1.118 182 W HN -0.328 7.817 8.180 0.007 0.039 0.629 183 K N 0.099 119.921 120.400 -0.963 0.000 2.350 183 K HA -0.071 3.937 4.320 -0.791 -0.162 0.279 183 K C 0.885 177.238 176.600 -0.412 0.000 1.027 183 K CA 0.137 55.904 56.287 -0.867 0.000 0.969 183 K CB 0.571 32.490 32.500 -0.969 0.000 0.954 183 K HN -0.723 6.672 8.250 -1.159 0.160 0.474 184 R N 3.255 123.540 120.500 -0.357 0.000 2.075 184 R HA -0.252 3.880 4.340 -0.347 0.000 0.226 184 R C -1.083 175.040 176.300 -0.296 0.000 1.114 184 R CA 2.348 58.213 56.100 -0.392 0.000 0.972 184 R CB 0.956 30.909 30.300 -0.580 0.000 0.869 184 R HN 0.532 8.989 8.270 -0.344 -0.394 0.437 185 T N -9.709 104.686 114.554 -0.265 0.000 2.865 185 T HA 0.334 4.698 4.350 -0.139 -0.097 0.294 185 T C 0.740 175.326 174.700 -0.191 0.000 1.119 185 T CA -2.431 59.559 62.100 -0.183 0.000 1.007 185 T CB 3.660 72.436 68.868 -0.154 0.000 1.225 185 T HN -0.964 7.099 8.240 -0.294 0.000 0.515 186 K N -0.503 119.815 120.400 -0.137 0.000 2.283 186 K HA -0.279 3.941 4.320 -0.167 0.000 0.202 186 K C -0.149 176.379 176.600 -0.119 0.000 1.048 186 K CA 3.378 59.586 56.287 -0.131 0.000 0.948 186 K CB -0.550 31.897 32.500 -0.089 0.000 0.742 186 K HN 0.312 8.768 8.250 -0.104 -0.269 0.458 187 D N -2.297 118.039 120.400 -0.106 0.000 2.328 187 D HA -0.002 4.598 4.640 -0.067 0.000 0.221 187 D C -0.274 175.973 176.300 -0.088 0.000 1.072 187 D CA 0.258 54.208 54.000 -0.083 0.000 0.850 187 D CB -0.511 40.249 40.800 -0.065 0.000 0.922 187 D HN -0.731 7.539 8.370 -0.109 0.035 0.516 188 D N 1.137 121.458 120.400 -0.132 0.000 2.487 188 D HA -0.273 4.307 4.640 -0.100 0.000 0.243 188 D C -0.069 176.220 176.300 -0.019 0.000 1.154 188 D CA 1.496 55.430 54.000 -0.110 0.000 0.876 188 D CB 0.367 41.043 40.800 -0.206 0.000 1.161 188 D HN -0.602 7.492 8.370 -0.175 0.171 0.478 189 K N 4.651 125.060 120.400 0.014 0.000 2.372 189 K HA 0.151 4.508 4.320 0.062 0.000 0.200 189 K C 0.196 176.850 176.600 0.090 0.000 1.022 189 K CA -1.772 54.542 56.287 0.045 0.000 1.125 189 K CB 0.391 32.888 32.500 -0.006 0.000 0.855 189 K HN 0.352 8.593 8.250 -0.015 0.000 0.524 190 N N 0.495 119.291 118.700 0.160 0.000 2.381 190 N HA -0.139 4.656 4.740 0.092 0.000 0.241 190 N C -0.819 174.743 175.510 0.087 0.000 1.279 190 N CA 1.045 54.185 53.050 0.150 0.000 0.896 190 N CB 1.032 39.650 38.487 0.218 0.000 1.118 190 N HN -0.106 8.675 8.380 0.164 -0.302 0.438 191 I N 1.117 121.625 120.570 -0.103 0.000 2.339 191 I HA -0.017 4.045 4.170 -0.180 0.000 0.290 191 I C -1.343 174.483 176.117 -0.485 0.000 0.994 191 I CA -0.942 60.218 61.300 -0.234 0.000 1.191 191 I CB 0.913 38.813 38.000 -0.167 0.000 1.343 191 I HN -0.019 8.130 8.210 -0.102 0.000 0.458 192 L N 7.447 128.213 121.223 -0.761 0.000 2.462 192 L HA -0.015 3.829 4.340 -1.017 -0.114 0.272 192 L C -0.539 176.054 176.870 -0.461 0.000 1.166 192 L CA 0.578 54.888 54.840 -0.883 0.000 0.880 192 L CB 0.876 42.237 42.059 -1.162 0.000 1.142 192 L HN 0.184 7.986 8.230 -0.714 0.000 0.473 193 M N 8.050 127.422 119.600 -0.379 0.000 2.080 193 M HA 0.669 5.023 4.480 -0.210 0.000 0.350 193 M C -0.406 175.792 176.300 -0.171 0.000 1.173 193 M CA -1.785 53.374 55.300 -0.235 0.000 1.052 193 M CB -0.747 31.729 32.600 -0.208 0.000 1.577 193 M HN 0.526 8.561 8.290 -0.425 0.000 0.455 194 T N 0.166 114.648 114.554 -0.121 0.000 2.907 194 T HA 0.689 5.001 4.350 -0.062 0.000 0.290 194 T C -1.629 173.053 174.700 -0.030 0.000 1.066 194 T CA -3.095 58.963 62.100 -0.071 0.000 1.012 194 T CB 1.178 70.005 68.868 -0.068 0.000 1.184 194 T HN 0.536 8.704 8.240 -0.120 0.000 0.522 195 P HA -0.182 4.257 4.420 0.031 0.000 0.216 195 P C 1.185 178.513 177.300 0.046 0.000 1.153 195 P CA 2.753 65.867 63.100 0.024 0.000 0.858 195 P CB -0.146 31.567 31.700 0.022 0.000 0.789 196 A N -4.003 118.825 122.820 0.013 0.000 1.898 196 A HA -0.078 4.433 4.320 0.017 -0.181 0.216 196 A C 1.686 179.305 177.584 0.058 0.000 1.181 196 A CA 2.364 54.411 52.037 0.017 0.000 0.620 196 A CB -0.370 18.613 19.000 -0.027 0.000 0.819 196 A HN 0.311 8.450 8.150 -0.008 0.006 0.442 197 S N -1.955 113.753 115.700 0.012 0.000 2.446 197 S HA -0.246 4.232 4.470 0.014 0.000 0.225 197 S C 2.056 176.658 174.600 0.003 0.000 1.016 197 S CA 2.497 60.696 58.200 -0.002 0.000 0.943 197 S CB 0.114 63.275 63.200 -0.065 0.000 0.786 197 S HN -0.581 7.719 8.310 -0.017 0.000 0.508 198 R N 3.175 123.678 120.500 0.004 0.000 2.092 198 R HA -0.208 4.110 4.340 -0.038 0.000 0.231 198 R C 1.824 178.142 176.300 0.030 0.000 1.119 198 R CA 3.074 59.172 56.100 -0.004 0.000 0.970 198 R CB -0.184 30.113 30.300 -0.006 0.000 0.864 198 R HN 0.260 8.529 8.270 -0.001 0.000 0.440 199 F N -1.442 118.486 119.950 -0.038 0.000 2.091 199 F HA -0.269 4.451 4.527 -0.025 -0.208 0.299 199 F C 0.612 176.402 175.800 -0.017 0.000 1.103 199 F CA 3.059 61.043 58.000 -0.028 0.000 1.228 199 F CB -0.019 38.961 39.000 -0.033 0.000 0.984 199 F HN -0.260 8.172 8.300 0.220 0.000 0.477 200 V N -4.583 115.403 119.914 0.121 0.000 2.358 200 V HA -0.390 3.768 4.120 0.063 0.000 0.246 200 V C 2.084 178.149 176.094 -0.048 0.000 1.047 200 V CA 3.412 65.737 62.300 0.042 0.000 1.035 200 V CB 0.190 32.064 31.823 0.085 0.000 0.658 200 V HN -0.790 7.531 8.190 0.219 0.000 0.452 201 S N 0.212 115.885 115.700 -0.046 0.000 2.419 201 S HA -0.409 4.040 4.470 -0.036 0.000 0.233 201 S C 1.503 176.069 174.600 -0.058 0.000 1.016 201 S CA 3.176 61.347 58.200 -0.049 0.000 0.974 201 S CB -0.151 63.012 63.200 -0.063 0.000 0.786 201 S HN -0.120 8.100 8.310 -0.029 0.072 0.492 202 N N -0.329 118.304 118.700 -0.112 0.000 2.280 202 N HA 0.076 4.792 4.740 -0.039 0.000 0.192 202 N C 0.828 176.217 175.510 -0.203 0.000 1.109 202 N CA 0.323 53.301 53.050 -0.120 0.000 0.855 202 N CB 0.105 38.503 38.487 -0.148 0.000 0.974 202 N HN -0.413 7.751 8.380 -0.144 0.130 0.482 203 A N -0.467 122.200 122.820 -0.255 0.000 2.119 203 A HA -0.125 3.936 4.320 -0.432 0.000 0.217 203 A C 0.091 177.593 177.584 -0.136 0.000 1.153 203 A CA 2.290 54.147 52.037 -0.300 0.000 0.692 203 A CB -0.252 18.578 19.000 -0.283 0.000 0.799 203 A HN -0.505 7.343 8.150 -0.201 0.181 0.458 204 D N -4.011 116.349 120.400 -0.067 0.000 2.355 204 D HA -0.098 4.529 4.640 -0.023 0.000 0.218 204 D C 0.223 176.517 176.300 -0.011 0.000 1.004 204 D CA -0.016 53.972 54.000 -0.019 0.000 0.880 204 D CB -0.218 40.590 40.800 0.014 0.000 0.911 204 D HN 0.194 8.492 8.370 -0.060 0.036 0.528 205 L N 0.083 121.289 121.223 -0.028 0.000 2.379 205 L HA 0.133 4.459 4.340 -0.023 0.000 0.269 205 L C -1.010 175.831 176.870 -0.048 0.000 1.084 205 L CA -0.234 54.588 54.840 -0.030 0.000 0.802 205 L CB 0.407 42.455 42.059 -0.018 0.000 1.175 205 L HN -0.604 7.414 8.230 -0.056 0.179 0.448 206 Q N -2.391 117.382 119.800 -0.046 0.000 2.534 206 Q HA 0.107 4.434 4.340 -0.022 0.000 0.290 206 Q C -1.886 174.090 176.000 -0.040 0.000 0.991 206 Q CA -2.036 53.748 55.803 -0.032 0.000 0.783 206 Q CB 2.936 31.662 28.738 -0.020 0.000 1.470 206 Q HN -0.207 8.029 8.270 -0.057 0.000 0.406 207 T N 2.652 117.192 114.554 -0.024 0.000 2.761 207 T HA -0.049 4.442 4.350 -0.047 -0.169 0.296 207 T C -0.295 174.386 174.700 -0.032 0.000 0.934 207 T CA 0.533 62.615 62.100 -0.030 0.000 1.091 207 T CB 0.378 69.240 68.868 -0.009 0.000 0.896 207 T HN 0.188 8.424 8.240 -0.007 0.000 0.515 208 L N 7.875 129.070 121.223 -0.047 0.000 2.375 208 L HA 0.326 4.647 4.340 -0.031 0.000 0.271 208 L C -1.674 175.175 176.870 -0.035 0.000 1.107 208 L CA -2.642 52.174 54.840 -0.040 0.000 0.806 208 L CB -0.326 41.702 42.059 -0.051 0.000 1.146 208 L HN -0.001 8.559 8.230 -0.063 -0.367 0.447 209 P HA 0.039 4.447 4.420 -0.021 0.000 0.268 209 P C 0.271 177.554 177.300 -0.028 0.000 1.205 209 P CA -0.553 62.534 63.100 -0.022 0.000 0.771 209 P CB 0.571 32.263 31.700 -0.015 0.000 0.858 210 A N 4.647 127.450 122.820 -0.028 0.000 1.948 210 A HA -0.335 3.961 4.320 -0.040 0.000 0.220 210 A C 2.677 180.244 177.584 -0.029 0.000 1.177 210 A CA 2.879 54.897 52.037 -0.033 0.000 0.636 210 A CB -0.417 18.565 19.000 -0.030 0.000 0.815 210 A HN 0.490 8.625 8.150 -0.025 0.000 0.449 211 G N -2.042 106.745 108.800 -0.021 0.000 2.475 211 G HA2 -0.268 3.682 3.960 -0.016 0.000 0.220 211 G HA3 -0.268 3.685 3.960 -0.012 0.000 0.220 211 G C 1.355 176.245 174.900 -0.016 0.000 1.125 211 G CA 1.429 46.520 45.100 -0.016 0.000 0.755 211 G HN 0.302 8.565 8.290 -0.019 0.016 0.565 212 A N 0.113 122.922 122.820 -0.018 0.000 2.168 212 A HA -0.127 4.187 4.320 -0.009 0.000 0.215 212 A C -0.070 177.501 177.584 -0.022 0.000 1.152 212 A CA 1.460 53.487 52.037 -0.016 0.000 0.716 212 A CB 0.046 19.036 19.000 -0.017 0.000 0.794 212 A HN -0.164 7.845 8.150 -0.021 0.129 0.465 213 L N -5.887 115.317 121.223 -0.032 0.000 2.728 213 L HA 0.102 4.421 4.340 -0.036 0.000 0.238 213 L C -0.621 176.226 176.870 -0.038 0.000 1.143 213 L CA -1.764 53.051 54.840 -0.042 0.000 0.937 213 L CB -0.151 41.872 42.059 -0.061 0.000 1.225 213 L HN -0.340 7.693 8.230 -0.033 0.177 0.507 214 R N 1.083 121.565 120.500 -0.030 0.000 2.484 214 R HA -0.243 4.078 4.340 -0.032 0.000 0.293 214 R C 0.860 177.144 176.300 -0.027 0.000 1.023 214 R CA 1.690 57.773 56.100 -0.028 0.000 1.037 214 R CB 0.360 30.648 30.300 -0.019 0.000 0.951 214 R HN -0.922 7.259 8.270 -0.025 0.073 0.418 215 G N 4.053 112.834 108.800 -0.031 0.000 2.179 215 G HA2 -0.366 3.576 3.960 -0.031 0.000 0.257 215 G HA3 -0.366 3.573 3.960 -0.035 0.000 0.257 215 G C -0.573 174.311 174.900 -0.025 0.000 1.010 215 G CA 0.677 45.759 45.100 -0.031 0.000 0.736 215 G HN 0.574 8.844 8.290 -0.034 0.000 0.513 216 K N 0.462 120.846 120.400 -0.027 0.000 2.266 216 K HA 0.269 4.584 4.320 -0.008 0.000 0.274 216 K C -1.144 175.442 176.600 -0.022 0.000 1.090 216 K CA -1.967 54.310 56.287 -0.017 0.000 0.925 216 K CB -0.450 32.040 32.500 -0.016 0.000 1.225 216 K HN -0.675 7.523 8.250 -0.034 0.032 0.458 217 I N 5.031 125.593 120.570 -0.013 0.000 2.472 217 I HA 0.098 4.247 4.170 -0.035 0.000 0.290 217 I C -1.150 174.970 176.117 0.005 0.000 1.016 217 I CA -0.385 60.903 61.300 -0.020 0.000 1.348 217 I CB 1.213 39.206 38.000 -0.013 0.000 1.417 217 I HN 0.147 8.353 8.210 -0.007 0.000 0.521 218 V N 5.710 125.632 119.914 0.014 0.000 2.588 218 V HA 0.292 nan 4.120 nan 0.000 0.304 218 V C -2.101 174.029 176.094 0.060 0.000 1.042 218 V CA -3.699 58.666 62.300 0.108 0.000 0.877 218 V CB 2.343 34.253 31.823 0.144 0.000 0.996 218 V HN -0.289 7.892 8.190 -0.014 0.000 0.425 219 P HA 0.181 4.887 4.420 0.223 -0.152 0.269 219 P C -0.321 176.953 177.300 -0.043 0.000 1.215 219 P CA -0.752 62.369 63.100 0.035 0.000 0.780 219 P CB 0.904 32.563 31.700 -0.067 0.000 0.898 220 T N 5.814 120.362 114.554 -0.010 0.000 2.866 220 T HA -0.025 4.432 4.350 -0.091 -0.162 0.293 220 T C -1.751 172.884 174.700 -0.109 0.000 1.005 220 T CA 1.349 63.336 62.100 -0.188 0.000 1.162 220 T CB -0.240 68.253 68.868 -0.624 0.000 0.968 220 T HN 0.083 8.897 8.240 0.074 -0.530 0.530 221 P HA -0.002 4.952 4.420 0.254 -0.381 0.274 221 P C -0.852 176.522 177.300 0.124 0.000 1.231 221 P CA -0.919 62.256 63.100 0.124 0.000 0.790 221 P CB 0.783 32.532 31.700 0.083 0.000 0.951 222 M N 0.068 119.772 119.600 0.173 0.000 2.149 222 M HA -0.348 4.248 4.480 0.193 0.000 0.261 222 M C 0.736 177.083 176.300 0.077 0.000 1.064 222 M CA 3.058 58.434 55.300 0.126 0.000 1.102 222 M CB 0.415 33.042 32.600 0.044 0.000 1.369 222 M HN 0.093 8.805 8.290 0.206 -0.299 0.408 223 Q N -3.740 116.089 119.800 0.048 0.000 2.295 223 Q HA 0.170 4.532 4.340 0.038 0.000 0.268 223 Q C -2.687 173.328 176.000 0.025 0.000 1.010 223 Q CA -0.439 55.384 55.803 0.033 0.000 0.856 223 Q CB 3.041 31.792 28.738 0.022 0.000 1.349 223 Q HN -0.696 7.584 8.270 0.044 0.017 0.412 224 V N 3.924 123.848 119.914 0.016 0.000 2.932 224 V HA 0.337 4.566 4.120 0.008 -0.105 0.307 224 V C -2.077 174.002 176.094 -0.026 0.000 1.147 224 V CA -1.472 60.827 62.300 -0.001 0.000 0.951 224 V CB 3.254 35.077 31.823 -0.001 0.000 1.031 224 V HN 0.229 8.430 8.190 0.019 0.000 0.426 225 K N 9.284 129.641 120.400 -0.072 0.000 2.535 225 K HA 0.417 4.683 4.320 -0.090 0.000 0.253 225 K C -1.857 174.521 176.600 -0.369 0.000 0.953 225 K CA -1.275 54.930 56.287 -0.137 0.000 0.863 225 K CB 2.364 34.830 32.500 -0.057 0.000 1.111 225 K HN 0.893 8.992 8.250 -0.070 0.109 0.431 226 V N 7.091 126.836 119.914 -0.283 0.000 2.465 226 V HA 0.064 3.987 4.120 -0.328 0.000 0.279 226 V C 0.046 175.965 176.094 -0.293 0.000 1.045 226 V CA -0.427 61.696 62.300 -0.295 0.000 0.938 226 V CB 0.689 32.444 31.823 -0.112 0.000 0.986 226 V HN 0.335 8.433 8.190 -0.153 0.000 0.467 227 H N 7.925 127.009 119.070 0.024 0.000 2.615 227 H HA 0.275 4.844 4.556 0.020 0.000 0.346 227 H C 0.331 175.669 175.328 0.017 0.000 1.200 227 H CA -1.630 54.431 56.048 0.021 0.000 1.264 227 H CB 1.710 31.487 29.762 0.026 0.000 1.699 227 H HN 0.549 8.571 8.280 -0.251 0.108 0.567 228 A N 0.962 123.873 122.820 0.151 0.000 2.016 228 A HA -0.091 4.265 4.320 0.060 0.000 0.217 228 A C 0.409 178.031 177.584 0.063 0.000 1.162 228 A CA 1.736 53.820 52.037 0.078 0.000 0.662 228 A CB 0.157 19.192 19.000 0.058 0.000 0.812 228 A HN 0.536 8.791 8.150 0.175 0.000 0.450 229 Q N -1.189 118.657 119.800 0.077 0.000 2.368 229 Q HA 0.000 4.364 4.340 0.039 0.000 0.237 229 Q C -1.372 174.659 176.000 0.050 0.000 0.987 229 Q CA -0.108 55.728 55.803 0.055 0.000 0.896 229 Q CB 1.277 30.049 28.738 0.056 0.000 1.241 229 Q HN -0.099 8.235 8.270 0.107 0.000 0.485 230 D N -0.751 119.665 120.400 0.027 0.000 2.269 230 D HA 0.597 5.354 4.640 0.005 -0.114 0.244 230 D C -1.396 174.899 176.300 -0.007 0.000 0.992 230 D CA -0.868 53.134 54.000 0.004 0.000 0.894 230 D CB 3.293 44.084 40.800 -0.014 0.000 1.248 230 D HN -0.054 8.330 8.370 0.023 0.000 0.468 231 A N -0.691 122.096 122.820 -0.056 0.000 2.306 231 A HA 0.166 4.458 4.320 -0.047 0.000 0.314 231 A C -2.220 175.242 177.584 -0.204 0.000 1.164 231 A CA -1.389 50.564 52.037 -0.139 0.000 0.822 231 A CB 2.347 21.170 19.000 -0.294 0.000 1.130 231 A HN 0.939 8.940 8.150 -0.063 0.111 0.496 232 D N 1.960 122.252 120.400 -0.180 0.000 2.329 232 D HA 0.203 4.767 4.640 -0.127 0.000 0.232 232 D C 0.070 176.263 176.300 -0.177 0.000 1.088 232 D CA -0.823 53.099 54.000 -0.130 0.000 0.835 232 D CB 0.516 41.290 40.800 -0.044 0.000 1.078 232 D HN 0.489 8.787 8.370 -0.119 0.000 0.495 233 L N 3.783 124.908 121.223 -0.163 0.000 2.769 233 L HA 0.292 4.553 4.340 -0.131 0.000 0.240 233 L C 1.307 178.149 176.870 -0.047 0.000 1.163 233 L CA -0.916 53.849 54.840 -0.124 0.000 0.962 233 L CB -0.473 41.512 42.059 -0.123 0.000 1.258 233 L HN 0.805 8.851 8.230 -0.137 0.103 0.513 234 R N 0.762 121.240 120.500 -0.037 0.000 2.120 234 R HA -0.280 4.049 4.340 -0.019 0.000 0.234 234 R C 1.058 177.352 176.300 -0.009 0.000 1.123 234 R CA 3.244 59.332 56.100 -0.020 0.000 0.975 234 R CB 0.091 30.380 30.300 -0.018 0.000 0.866 234 R HN -0.664 7.800 8.270 -0.047 -0.222 0.446 235 K N -3.152 117.246 120.400 -0.004 0.000 2.417 235 K HA 0.046 4.364 4.320 -0.002 0.000 0.196 235 K C -0.569 176.031 176.600 0.000 0.000 1.023 235 K CA -0.492 55.796 56.287 0.001 0.000 1.122 235 K CB 0.055 32.558 32.500 0.006 0.000 0.850 235 K HN -0.096 8.134 8.250 -0.003 0.018 0.521 236 G N -2.486 106.313 108.800 -0.001 0.000 2.525 236 G HA2 -0.206 3.823 3.960 -0.013 0.000 0.685 236 G HA3 -0.206 3.755 3.960 -0.019 -0.012 0.685 236 G C -2.392 172.500 174.900 -0.014 0.000 1.290 236 G CA -0.527 44.565 45.100 -0.013 0.000 0.915 236 G HN -0.509 7.585 8.290 -0.003 0.194 0.548 237 V N -5.233 114.633 119.914 -0.080 0.000 2.823 237 V HA 0.808 5.086 4.120 0.010 -0.152 0.312 237 V C -1.934 174.073 176.094 -0.144 0.000 1.072 237 V CA -3.315 58.919 62.300 -0.111 0.000 0.937 237 V CB 3.214 34.843 31.823 -0.323 0.000 1.013 237 V HN 0.344 8.468 8.190 -0.110 0.000 0.430 238 A N 3.879 126.629 122.820 -0.116 0.000 2.277 238 A HA 0.631 4.959 4.320 -0.113 -0.076 0.318 238 A C -1.638 175.861 177.584 -0.142 0.000 1.339 238 A CA -1.706 50.261 52.037 -0.116 0.000 0.875 238 A CB 0.765 19.713 19.000 -0.087 0.000 1.158 238 A HN 1.014 8.985 8.150 -0.081 0.131 0.514 239 L N 4.780 125.907 121.223 -0.160 0.000 2.276 239 L HA 0.270 4.512 4.340 -0.163 0.000 0.286 239 L C -0.009 176.803 176.870 -0.096 0.000 1.061 239 L CA -0.763 53.984 54.840 -0.155 0.000 0.807 239 L CB 0.857 42.797 42.059 -0.197 0.000 1.177 239 L HN 0.414 8.552 8.230 -0.154 0.000 0.429 240 D N 4.599 124.954 120.400 -0.076 0.000 2.499 240 D HA 0.140 4.752 4.640 -0.048 0.000 0.225 240 D C -1.071 175.209 176.300 -0.033 0.000 1.124 240 D CA -0.840 53.130 54.000 -0.050 0.000 0.938 240 D CB -0.325 40.448 40.800 -0.045 0.000 1.014 240 D HN 0.358 8.679 8.370 -0.081 0.000 0.517 241 L N 3.336 124.541 121.223 -0.029 0.000 2.928 241 L HA 0.301 4.636 4.340 -0.009 0.000 0.246 241 L C 0.906 177.771 176.870 -0.009 0.000 1.239 241 L CA -0.952 53.880 54.840 -0.014 0.000 1.035 241 L CB -1.026 41.027 42.059 -0.011 0.000 1.360 241 L HN 0.026 8.235 8.230 -0.035 0.000 0.529 242 S N 1.886 117.578 115.700 -0.013 0.000 2.419 242 S HA -0.236 4.226 4.470 -0.013 0.000 0.233 242 S C 1.160 175.755 174.600 -0.008 0.000 1.016 242 S CA 2.885 61.078 58.200 -0.012 0.000 0.974 242 S CB 0.187 63.379 63.200 -0.013 0.000 0.786 242 S HN -0.502 7.878 8.310 -0.016 -0.080 0.492 243 T N -2.554 111.998 114.554 -0.003 0.000 3.035 243 T HA -0.092 4.255 4.350 -0.005 0.000 0.268 243 T C 0.060 174.758 174.700 -0.003 0.000 1.109 243 T CA 1.409 63.509 62.100 -0.001 0.000 1.119 243 T CB 0.412 69.286 68.868 0.010 0.000 0.900 243 T HN -0.553 7.648 8.240 -0.002 0.039 0.503 244 L N 0.747 121.970 121.223 0.000 0.000 2.331 244 L HA 0.135 4.648 4.340 -0.008 -0.178 0.275 244 L C 0.061 176.924 176.870 -0.011 0.000 1.022 244 L CA -1.276 53.564 54.840 0.000 0.000 0.812 244 L CB 2.809 44.885 42.059 0.028 0.000 1.257 244 L HN -0.684 7.378 8.230 0.001 0.169 0.435 245 V N -0.789 119.111 119.914 -0.024 0.000 2.843 245 V HA -0.001 4.105 4.120 -0.024 0.000 0.305 245 V C 0.668 176.747 176.094 -0.025 0.000 1.065 245 V CA -0.545 61.738 62.300 -0.029 0.000 1.116 245 V CB 1.018 32.817 31.823 -0.041 0.000 0.968 245 V HN 0.042 8.502 8.190 -0.033 -0.290 0.487 246 K N 6.356 126.742 120.400 -0.022 0.000 2.059 246 K HA -0.259 4.053 4.320 -0.014 0.000 0.212 246 K C -0.561 176.025 176.600 -0.023 0.000 1.050 246 K CA 4.979 61.255 56.287 -0.019 0.000 0.927 246 K CB -2.031 30.458 32.500 -0.018 0.000 0.714 246 K HN 0.705 8.941 8.250 -0.023 0.000 0.447 247 P HA -0.159 4.232 4.420 -0.048 0.000 0.217 247 P C 0.938 178.203 177.300 -0.059 0.000 1.150 247 P CA 2.610 65.676 63.100 -0.056 0.000 0.832 247 P CB -0.638 31.018 31.700 -0.074 0.000 0.787 248 A N -2.478 120.312 122.820 -0.050 0.000 1.930 248 A HA -0.147 4.307 4.320 -0.013 -0.141 0.217 248 A C 1.784 179.426 177.584 0.096 0.000 1.175 248 A CA 2.622 54.659 52.037 0.001 0.000 0.627 248 A CB -0.742 18.229 19.000 -0.049 0.000 0.815 248 A HN -0.515 7.601 8.150 -0.057 0.000 0.443 249 A N -1.836 121.011 122.820 0.046 0.000 1.930 249 A HA -0.303 4.052 4.320 0.059 0.000 0.217 249 A C 1.732 179.332 177.584 0.027 0.000 1.175 249 A CA 3.054 55.115 52.037 0.039 0.000 0.627 249 A CB -0.661 18.347 19.000 0.013 0.000 0.815 249 A HN -0.022 8.058 8.150 0.015 0.079 0.443 250 D N -0.898 119.507 120.400 0.009 0.000 2.144 250 D HA -0.236 4.405 4.640 0.000 0.000 0.199 250 D C 2.465 178.764 176.300 -0.001 0.000 0.984 250 D CA 3.350 57.349 54.000 -0.002 0.000 0.834 250 D CB -0.504 40.286 40.800 -0.017 0.000 0.955 250 D HN 0.155 8.422 8.370 -0.000 0.103 0.465 251 V N 0.025 119.940 119.914 0.002 0.000 2.287 251 V HA -0.446 3.649 4.120 -0.042 0.000 0.248 251 V C 2.129 178.218 176.094 -0.008 0.000 1.053 251 V CA 4.000 66.299 62.300 -0.002 0.000 1.027 251 V CB -0.468 31.397 31.823 0.071 0.000 0.646 251 V HN -0.543 7.570 8.190 0.009 0.082 0.447 252 V N -0.257 119.662 119.914 0.008 0.000 2.295 252 V HA -0.534 3.508 4.120 -0.130 0.000 0.246 252 V C 1.906 178.075 176.094 0.124 0.000 1.049 252 V CA 4.808 67.098 62.300 -0.017 0.000 1.024 252 V CB -0.478 31.342 31.823 -0.005 0.000 0.648 252 V HN -0.603 7.622 8.190 0.058 0.000 0.447 253 S N 0.384 116.147 115.700 0.106 0.000 2.370 253 S HA -0.501 4.079 4.470 0.184 0.000 0.226 253 S C 2.251 176.911 174.600 0.099 0.000 1.033 253 S CA 3.775 62.042 58.200 0.112 0.000 1.011 253 S CB -0.263 62.957 63.200 0.033 0.000 0.852 253 S HN -0.191 8.155 8.310 0.060 0.000 0.457 254 Q N 0.716 120.539 119.800 0.040 0.000 2.084 254 Q HA -0.328 4.023 4.340 0.018 0.000 0.202 254 Q C 2.342 178.338 176.000 -0.007 0.000 0.978 254 Q CA 3.150 58.960 55.803 0.012 0.000 0.844 254 Q CB -0.248 28.484 28.738 -0.009 0.000 0.898 254 Q HN -0.171 8.106 8.270 0.025 0.008 0.426 255 R N 0.337 120.810 120.500 -0.045 0.000 2.092 255 R HA -0.275 3.990 4.340 -0.124 0.000 0.231 255 R C 2.382 178.579 176.300 -0.170 0.000 1.119 255 R CA 3.318 59.334 56.100 -0.141 0.000 0.970 255 R CB -0.245 29.911 30.300 -0.241 0.000 0.864 255 R HN -0.322 7.840 8.270 -0.035 0.087 0.440 256 F N -1.264 118.627 119.950 -0.098 0.000 2.069 256 F HA -0.443 4.027 4.527 -0.094 0.000 0.298 256 F C 1.801 177.560 175.800 -0.067 0.000 1.113 256 F CA 4.038 61.988 58.000 -0.084 0.000 1.214 256 F CB -0.387 38.570 39.000 -0.072 0.000 0.978 256 F HN 0.064 8.431 8.300 0.111 0.000 0.474 257 A N -1.084 121.813 122.820 0.128 0.000 1.908 257 A HA -0.289 4.065 4.320 0.056 0.000 0.218 257 A C 2.412 180.002 177.584 0.010 0.000 1.181 257 A CA 2.874 54.944 52.037 0.056 0.000 0.627 257 A CB -0.852 18.171 19.000 0.038 0.000 0.818 257 A HN -0.312 7.928 8.150 0.151 0.000 0.445 258 L N -1.723 119.489 121.223 -0.019 0.000 2.042 258 L HA -0.257 4.066 4.340 -0.029 0.000 0.210 258 L C 1.403 178.241 176.870 -0.053 0.000 1.076 258 L CA 2.345 57.160 54.840 -0.042 0.000 0.749 258 L CB 0.174 42.194 42.059 -0.065 0.000 0.893 258 L HN -0.206 7.834 8.230 -0.019 0.178 0.432 259 L N -5.820 115.360 121.223 -0.072 0.000 2.627 259 L HA 0.036 4.329 4.340 -0.077 0.000 0.232 259 L C 0.308 177.151 176.870 -0.044 0.000 1.150 259 L CA -0.297 54.495 54.840 -0.081 0.000 0.917 259 L CB -0.337 41.638 42.059 -0.140 0.000 1.104 259 L HN -0.593 7.575 8.230 -0.082 0.013 0.445 260 G N -2.686 106.104 108.800 -0.017 0.000 2.132 260 G HA2 -0.301 3.658 3.960 -0.001 0.000 0.234 260 G HA3 -0.301 3.652 3.960 -0.011 0.000 0.234 260 G C -0.611 174.302 174.900 0.021 0.000 0.989 260 G CA 0.139 45.238 45.100 -0.002 0.000 0.676 260 G HN -0.364 7.696 8.290 -0.015 0.220 0.522 261 V N 1.662 121.614 119.914 0.063 0.000 2.294 261 V HA 0.346 4.499 4.120 0.054 0.000 0.272 261 V C -1.840 174.309 176.094 0.091 0.000 1.027 261 V CA -3.023 59.337 62.300 0.101 0.000 0.823 261 V CB 0.743 32.700 31.823 0.224 0.000 1.030 261 V HN -0.261 7.970 8.190 0.070 0.000 0.457 262 P HA 0.014 4.444 4.420 0.017 0.000 0.269 262 P C -1.184 176.101 177.300 -0.025 0.000 1.209 262 P CA -0.672 62.434 63.100 0.010 0.000 0.776 262 P CB 1.145 32.844 31.700 -0.001 0.000 0.876 263 V N 2.007 121.899 119.914 -0.037 0.000 2.364 263 V HA 0.344 4.538 4.120 -0.128 -0.151 0.272 263 V C -0.566 175.494 176.094 -0.056 0.000 1.036 263 V CA -0.876 61.377 62.300 -0.080 0.000 0.880 263 V CB -0.221 31.555 31.823 -0.079 0.000 0.991 263 V HN 0.036 8.217 8.190 -0.015 0.000 0.460 264 Q N 7.193 126.956 119.800 -0.061 0.000 2.353 264 Q HA 0.473 4.789 4.340 -0.041 0.000 0.275 264 Q C -0.431 175.541 176.000 -0.047 0.000 1.029 264 Q CA -0.877 54.901 55.803 -0.043 0.000 0.848 264 Q CB 2.559 31.279 28.738 -0.029 0.000 1.390 264 Q HN 0.676 8.793 8.270 -0.079 0.105 0.401 265 T N -1.172 113.358 114.554 -0.040 0.000 2.849 265 T HA -0.372 3.949 4.350 -0.050 0.000 0.270 265 T C 0.567 175.244 174.700 -0.039 0.000 1.066 265 T CA 3.023 65.098 62.100 -0.042 0.000 1.130 265 T CB -0.268 68.579 68.868 -0.034 0.000 0.864 265 T HN 0.190 8.409 8.240 -0.035 0.000 0.481 266 N N 0.955 119.637 118.700 -0.030 0.000 2.398 266 N HA -0.026 4.698 4.740 -0.026 0.000 0.188 266 N C 0.644 176.145 175.510 -0.014 0.000 1.122 266 N CA -0.011 53.026 53.050 -0.022 0.000 0.866 266 N CB 0.945 39.422 38.487 -0.016 0.000 0.970 266 N HN -0.467 8.071 8.380 -0.028 -0.175 0.462 267 G N -1.054 107.736 108.800 -0.016 0.000 2.563 267 G HA2 -0.074 3.901 3.960 0.025 0.000 0.283 267 G HA3 -0.074 3.886 3.960 0.001 0.001 0.283 267 G C -1.199 173.720 174.900 0.031 0.000 1.309 267 G CA -0.788 44.318 45.100 0.010 0.000 1.022 267 G HN -0.587 7.496 8.290 -0.030 0.189 0.501 268 Y N 2.034 122.295 120.300 -0.064 0.000 2.650 268 Y HA 0.015 4.539 4.550 -0.044 0.000 0.331 268 Y C -1.678 174.174 175.900 -0.080 0.000 1.165 268 Y CA -1.310 56.755 58.100 -0.058 0.000 1.473 268 Y CB 0.705 39.137 38.460 -0.046 0.000 1.224 268 Y HN -0.125 8.261 8.280 0.176 0.000 0.533 269 P HA 0.445 4.968 4.420 -0.191 -0.217 0.282 269 P C -1.558 175.532 177.300 -0.349 0.000 1.262 269 P CA -0.437 62.481 63.100 -0.303 0.000 0.773 269 P CB 0.499 32.049 31.700 -0.250 0.000 0.879 270 I N 4.597 125.066 120.570 -0.168 0.000 2.411 270 I HA 0.407 4.693 4.170 -0.099 -0.177 0.284 270 I C -1.260 174.813 176.117 -0.074 0.000 1.012 270 I CA -0.979 60.267 61.300 -0.091 0.000 1.119 270 I CB 2.044 40.028 38.000 -0.028 0.000 1.261 270 I HN 0.940 9.062 8.210 -0.147 0.000 0.448 271 K N 7.441 127.807 120.400 -0.057 0.000 2.138 271 K HA 0.370 4.666 4.320 -0.039 0.000 0.263 271 K C -0.919 175.680 176.600 -0.002 0.000 0.965 271 K CA -1.588 54.678 56.287 -0.035 0.000 0.868 271 K CB 1.734 34.212 32.500 -0.037 0.000 1.083 271 K HN 0.961 9.065 8.250 -0.060 0.110 0.443 272 T N -0.067 114.488 114.554 0.003 0.000 2.907 272 T HA 0.913 5.492 4.350 0.040 -0.205 0.292 272 T C -0.635 174.083 174.700 0.030 0.000 1.043 272 T CA -1.838 60.276 62.100 0.024 0.000 1.003 272 T CB 2.792 71.671 68.868 0.019 0.000 1.084 272 T HN 0.011 8.468 8.240 -0.008 -0.221 0.483 273 D N 1.101 121.533 120.400 0.053 0.000 2.654 273 D HA 0.259 4.922 4.640 0.038 0.000 0.231 273 D C -1.806 174.543 176.300 0.081 0.000 1.239 273 D CA -0.733 53.300 54.000 0.055 0.000 0.790 273 D CB 4.108 44.941 40.800 0.055 0.000 1.480 273 D HN 0.259 8.672 8.370 0.073 0.000 0.442 274 I N 2.083 122.689 120.570 0.059 0.000 2.355 274 I HA 0.445 4.859 4.170 0.100 -0.184 0.288 274 I C -0.725 175.431 176.117 0.065 0.000 0.999 274 I CA -0.651 60.684 61.300 0.057 0.000 1.163 274 I CB 1.894 39.892 38.000 -0.003 0.000 1.316 274 I HN 0.229 8.461 8.210 0.037 0.000 0.454 275 Q N 7.117 126.999 119.800 0.137 0.000 3.429 275 Q HA 0.434 4.820 4.340 0.077 0.000 0.237 275 Q C -1.558 174.597 176.000 0.258 0.000 0.932 275 Q CA -2.997 52.895 55.803 0.149 0.000 0.731 275 Q CB 0.499 29.324 28.738 0.146 0.000 1.383 275 Q HN 0.497 8.901 8.270 0.223 0.000 0.446 276 P HA -0.170 4.278 4.420 0.045 0.000 0.216 276 P C 1.288 178.783 177.300 0.326 0.000 1.150 276 P CA 2.190 65.318 63.100 0.047 0.000 0.843 276 P CB 0.080 31.585 31.700 -0.324 0.000 0.787 277 G N -3.177 105.731 108.800 0.181 0.000 2.470 277 G HA2 -0.209 3.841 3.960 0.150 0.000 0.220 277 G HA3 -0.209 3.805 3.960 0.089 0.000 0.220 277 G C 0.485 175.455 174.900 0.116 0.000 1.121 277 G CA 1.027 46.212 45.100 0.142 0.000 0.766 277 G HN 0.256 8.592 8.290 0.107 0.019 0.553 278 K N -0.919 119.527 120.400 0.077 0.000 2.486 278 K HA -0.125 4.132 4.320 -0.106 0.000 0.194 278 K C 0.181 176.591 176.600 -0.316 0.000 1.033 278 K CA 0.529 56.717 56.287 -0.164 0.000 1.004 278 K CB 0.084 32.361 32.500 -0.371 0.000 0.798 278 K HN -0.656 7.661 8.250 0.161 0.030 0.495 279 F N -0.887 119.149 119.950 0.143 0.000 2.469 279 F HA 0.090 4.658 4.527 0.069 0.000 0.332 279 F C -0.697 175.148 175.800 0.076 0.000 1.103 279 F CA -0.384 57.685 58.000 0.115 0.000 0.979 279 F CB 1.388 40.490 39.000 0.169 0.000 1.137 279 F HN -0.704 7.781 8.300 0.425 0.069 0.463 280 K N 1.570 122.065 120.400 0.158 0.000 2.443 280 K HA 0.297 4.676 4.320 0.099 0.000 0.251 280 K C 0.107 176.730 176.600 0.039 0.000 0.972 280 K CA -1.231 55.108 56.287 0.086 0.000 0.833 280 K CB 2.725 35.251 32.500 0.043 0.000 1.317 280 K HN 0.337 8.667 8.250 0.134 0.000 0.441 281 G N 1.781 110.590 108.800 0.016 0.000 2.634 281 G HA2 -0.428 3.526 3.960 -0.011 0.000 0.318 281 G HA3 -0.428 3.522 3.960 -0.017 0.000 0.318 281 G C 0.694 175.564 174.900 -0.049 0.000 1.207 281 G CA 1.460 46.551 45.100 -0.014 0.000 0.987 281 G HN 0.447 8.755 8.290 0.030 0.000 0.547 282 A N 2.164 124.945 122.820 -0.065 0.000 2.251 282 A HA -0.010 4.243 4.320 -0.112 0.000 0.209 282 A C 0.492 177.995 177.584 -0.135 0.000 1.187 282 A CA 1.327 53.300 52.037 -0.106 0.000 0.823 282 A CB -0.351 18.585 19.000 -0.106 0.000 0.846 282 A HN 0.194 8.312 8.150 -0.053 0.000 0.486 283 M N -2.851 116.694 119.600 -0.091 0.000 2.509 283 M HA -0.016 4.389 4.480 -0.126 0.000 0.250 283 M C -0.500 175.704 176.300 -0.160 0.000 1.132 283 M CA 0.683 55.940 55.300 -0.072 0.000 1.080 283 M CB 1.043 33.679 32.600 0.061 0.000 1.408 283 M HN -0.494 7.715 8.290 -0.050 0.051 0.484 284 A N 0.846 123.542 122.820 -0.208 0.000 3.078 284 A HA 0.135 4.024 4.320 -0.718 0.000 0.279 284 A C -0.991 176.098 177.584 -0.825 0.000 1.594 284 A CA -0.832 50.929 52.037 -0.460 0.000 1.301 284 A CB -1.057 17.904 19.000 -0.066 0.000 1.162 284 A HN -0.621 7.277 8.150 -0.130 0.174 0.585 285 V N -1.441 117.833 119.914 -1.067 0.000 3.049 285 V HA 0.350 4.077 4.120 -0.655 0.000 0.309 285 V C -1.712 174.004 176.094 -0.630 0.000 1.148 285 V CA -2.538 59.329 62.300 -0.722 0.000 0.990 285 V CB 3.152 34.768 31.823 -0.344 0.000 1.039 285 V HN -0.598 6.918 8.190 -1.024 0.060 0.430 286 S N 2.130 117.737 115.700 -0.156 0.000 2.563 286 S HA -0.364 4.535 4.470 0.320 -0.237 0.294 286 S C 0.693 175.369 174.600 0.126 0.000 1.279 286 S CA 2.191 60.463 58.200 0.121 0.000 1.069 286 S CB 0.009 63.299 63.200 0.150 0.000 0.828 286 S HN 0.296 8.549 8.310 -0.095 0.000 0.497 287 G N 5.085 114.033 108.800 0.246 0.000 2.195 287 G HA2 -0.385 3.961 3.960 0.508 0.000 0.246 287 G HA3 -0.385 3.967 3.960 0.652 0.000 0.246 287 G C -0.519 174.680 174.900 0.499 0.000 0.984 287 G CA -0.113 45.287 45.100 0.500 0.000 0.633 287 G HN 0.237 8.999 8.290 0.245 -0.325 0.525 288 A N 2.159 125.057 122.820 0.130 0.000 2.407 288 A HA 0.315 4.841 4.320 0.087 -0.153 0.248 288 A C -1.786 175.855 177.584 0.095 0.000 1.082 288 A CA -0.032 51.997 52.037 -0.013 0.000 0.785 288 A CB 1.654 20.427 19.000 -0.379 0.000 1.020 288 A HN -0.486 7.580 8.150 -0.020 0.072 0.489 289 Y N -3.733 116.692 120.300 0.208 0.000 2.656 289 Y HA 0.601 5.439 4.550 0.313 -0.100 0.334 289 Y C -2.703 173.457 175.900 0.433 0.000 1.179 289 Y CA -1.780 56.521 58.100 0.335 0.000 1.050 289 Y CB 2.476 41.092 38.460 0.261 0.000 1.308 289 Y HN 0.540 8.761 8.280 -0.098 0.000 0.456 290 E N -0.360 120.164 120.200 0.540 0.000 2.187 290 E HA 0.598 5.227 4.350 0.210 -0.152 0.268 290 E C -2.013 174.822 176.600 0.392 0.000 0.896 290 E CA -1.515 55.082 56.400 0.328 0.000 0.766 290 E CB 3.910 33.724 29.700 0.189 0.000 1.142 290 E HN 0.530 9.168 8.360 0.646 0.109 0.408 291 L N 5.074 126.496 121.223 0.332 0.000 2.385 291 L HA 0.643 5.275 4.340 0.284 -0.122 0.273 291 L C -2.566 174.416 176.870 0.187 0.000 0.990 291 L CA -1.029 53.986 54.840 0.293 0.000 0.821 291 L CB 4.258 46.538 42.059 0.369 0.000 1.279 291 L HN 0.882 9.260 8.230 0.247 0.000 0.412 292 K N 7.822 128.316 120.400 0.158 0.000 2.579 292 K HA 0.546 5.094 4.320 0.144 -0.142 0.250 292 K C -1.942 174.743 176.600 0.142 0.000 0.952 292 K CA -0.879 55.490 56.287 0.138 0.000 0.857 292 K CB 2.844 35.410 32.500 0.111 0.000 1.123 292 K HN 0.671 9.015 8.250 0.156 0.000 0.433 293 I N 7.084 127.748 120.570 0.158 0.000 2.328 293 I HA 0.327 4.625 4.170 0.214 0.000 0.287 293 I C -1.561 174.676 176.117 0.199 0.000 1.012 293 I CA -0.912 60.499 61.300 0.186 0.000 1.195 293 I CB 1.340 39.429 38.000 0.149 0.000 1.350 293 I HN 0.894 9.197 8.210 0.154 0.000 0.464 294 G N 5.645 114.574 108.800 0.214 0.000 2.597 294 G HA2 0.181 4.236 3.960 0.159 0.000 0.317 294 G HA3 0.181 4.213 3.960 0.121 0.000 0.317 294 G C -2.072 172.967 174.900 0.231 0.000 1.230 294 G CA -1.071 44.133 45.100 0.173 0.000 0.996 294 G HN -0.193 8.238 8.290 0.235 0.000 0.490 295 K N -1.809 118.684 120.400 0.155 0.000 2.147 295 K HA -0.201 4.216 4.320 0.162 0.000 0.205 295 K C 1.103 177.844 176.600 0.235 0.000 1.049 295 K CA 1.963 58.348 56.287 0.163 0.000 0.936 295 K CB 0.054 32.606 32.500 0.087 0.000 0.722 295 K HN 0.097 8.410 8.250 0.105 0.000 0.446 296 K N -6.087 114.397 120.400 0.140 0.000 2.367 296 K HA 0.010 4.393 4.320 0.106 0.000 0.195 296 K C -0.975 175.483 176.600 -0.237 0.000 1.060 296 K CA -0.113 56.197 56.287 0.038 0.000 1.022 296 K CB 1.078 33.571 32.500 -0.012 0.000 0.894 296 K HN -0.002 8.283 8.250 0.091 0.019 0.540 297 E N -5.680 114.332 120.200 -0.313 0.000 2.416 297 E HA 0.345 3.999 4.350 -1.346 -0.111 0.280 297 E C -2.483 173.952 176.600 -0.276 0.000 1.055 297 E CA -1.202 54.813 56.400 -0.641 0.000 0.825 297 E CB 2.827 32.321 29.700 -0.343 0.000 1.312 297 E HN -0.617 7.708 8.360 -0.058 0.000 0.452 298 A N -1.324 121.330 122.820 -0.278 0.000 2.380 298 A HA 0.797 5.295 4.320 0.076 -0.132 0.315 298 A C -2.405 175.179 177.584 -0.001 0.000 1.101 298 A CA -2.050 50.006 52.037 0.033 0.000 0.771 298 A CB 4.522 23.663 19.000 0.235 0.000 1.287 298 A HN 0.942 8.688 8.150 -0.492 0.109 0.436 299 Q N 1.519 121.350 119.800 0.052 0.000 2.285 299 Q HA 1.009 5.623 4.340 0.035 -0.252 0.269 299 Q C -1.900 174.156 176.000 0.093 0.000 1.030 299 Q CA -1.535 54.298 55.803 0.051 0.000 0.788 299 Q CB 4.506 33.269 28.738 0.041 0.000 1.266 299 Q HN 0.805 9.018 8.270 0.085 0.108 0.438 300 V N 7.215 127.183 119.914 0.089 0.000 2.384 300 V HA 0.535 4.918 4.120 0.172 -0.160 0.287 300 V C -1.686 174.501 176.094 0.155 0.000 1.020 300 V CA -1.587 60.790 62.300 0.128 0.000 0.850 300 V CB 1.542 33.407 31.823 0.070 0.000 0.987 300 V HN 1.133 9.249 8.190 0.061 0.111 0.436 301 I N 6.747 127.458 120.570 0.235 0.000 2.359 301 I HA 0.711 5.281 4.170 0.222 -0.266 0.284 301 I C -0.481 175.886 176.117 0.417 0.000 1.018 301 I CA -1.516 59.946 61.300 0.269 0.000 1.173 301 I CB 1.670 39.817 38.000 0.245 0.000 1.326 301 I HN 0.900 9.281 8.210 0.284 0.000 0.462 302 G N 5.042 114.026 108.800 0.306 0.000 2.437 302 G HA2 0.551 4.836 3.960 0.340 0.000 0.319 302 G HA3 0.551 4.625 3.960 0.190 0.000 0.319 302 G C -1.200 173.809 174.900 0.181 0.000 1.158 302 G CA -1.681 43.579 45.100 0.266 0.000 0.899 302 G HN 0.895 9.215 8.290 0.214 0.099 0.502 303 F N 1.181 120.938 119.950 -0.322 0.000 2.234 303 F HA -0.160 4.180 4.527 -0.312 0.000 0.299 303 F C -1.428 174.309 175.800 -0.105 0.000 1.087 303 F CA 2.359 60.105 58.000 -0.424 0.000 1.340 303 F CB 1.087 39.657 39.000 -0.717 0.000 1.031 303 F HN 0.368 8.593 8.300 -0.125 0.000 0.500 304 D N -5.748 114.619 120.400 -0.055 0.000 2.759 304 D HA 0.112 4.656 4.640 -0.159 0.000 0.321 304 D C -0.545 175.748 176.300 -0.012 0.000 1.267 304 D CA -1.271 52.681 54.000 -0.080 0.000 0.933 304 D CB 0.447 41.233 40.800 -0.024 0.000 1.431 304 D HN -0.852 7.537 8.370 0.076 0.027 0.504 305 Q N -1.004 118.774 119.800 -0.036 0.000 2.135 305 Q HA -0.392 3.939 4.340 -0.015 0.000 0.204 305 Q C 1.978 177.940 176.000 -0.063 0.000 0.981 305 Q CA 4.358 60.138 55.803 -0.038 0.000 0.856 305 Q CB -0.321 28.379 28.738 -0.063 0.000 0.902 305 Q HN 0.500 8.738 8.270 -0.053 0.000 0.425 306 A N -0.506 122.247 122.820 -0.111 0.000 1.908 306 A HA -0.240 3.838 4.320 -0.404 0.000 0.218 306 A C 2.121 179.569 177.584 -0.227 0.000 1.181 306 A CA 2.705 54.569 52.037 -0.290 0.000 0.627 306 A CB -1.254 17.616 19.000 -0.217 0.000 0.818 306 A HN 0.209 8.317 8.150 -0.070 0.000 0.445 307 G N -1.524 107.307 108.800 0.051 0.000 2.446 307 G HA2 -0.324 3.985 3.960 0.418 0.000 0.217 307 G HA3 -0.324 3.903 3.960 0.233 -0.127 0.217 307 G C 1.415 176.411 174.900 0.160 0.000 1.168 307 G CA 2.082 47.321 45.100 0.232 0.000 0.771 307 G HN -0.161 8.475 8.290 0.066 -0.305 0.551 308 V N 2.858 122.824 119.914 0.085 0.000 2.295 308 V HA -0.429 3.724 4.120 0.055 0.000 0.246 308 V C 1.497 177.584 176.094 -0.012 0.000 1.049 308 V CA 4.342 66.670 62.300 0.047 0.000 1.024 308 V CB -0.179 31.674 31.823 0.049 0.000 0.648 308 V HN -0.168 8.064 8.190 0.069 0.000 0.447 309 F N 1.468 121.313 119.950 -0.174 0.000 2.120 309 F HA -0.502 3.935 4.527 -0.150 0.000 0.300 309 F C 1.212 176.907 175.800 -0.176 0.000 1.095 309 F CA 4.379 62.251 58.000 -0.214 0.000 1.249 309 F CB 0.289 39.091 39.000 -0.329 0.000 0.995 309 F HN 0.058 8.418 8.300 0.099 0.000 0.480 310 Y N -2.089 118.212 120.300 0.001 0.000 2.242 310 Y HA -0.300 4.098 4.550 -0.254 0.000 0.291 310 Y C 2.948 178.448 175.900 -0.667 0.000 1.137 310 Y CA 1.095 59.065 58.100 -0.216 0.000 1.181 310 Y CB -1.057 37.434 38.460 0.051 0.000 0.989 310 Y HN 0.554 8.696 8.280 -0.053 0.106 0.527 311 G N -1.246 107.075 108.800 -0.798 0.000 2.422 311 G HA2 -0.345 2.552 3.960 -1.771 0.000 0.218 311 G HA3 -0.345 3.121 3.960 -0.824 0.000 0.218 311 G C 1.130 175.766 174.900 -0.440 0.000 1.146 311 G CA 1.952 46.421 45.100 -1.052 0.000 0.769 311 G HN -0.192 7.806 8.290 -0.487 0.000 0.547 312 L N 0.800 121.835 121.223 -0.312 0.000 2.093 312 L HA -0.393 3.878 4.340 -0.114 0.000 0.208 312 L C 2.377 179.050 176.870 -0.329 0.000 1.085 312 L CA 2.865 57.570 54.840 -0.224 0.000 0.755 312 L CB -0.351 41.600 42.059 -0.180 0.000 0.904 312 L HN -0.308 7.732 8.230 -0.306 0.006 0.435 313 Q N -1.290 118.253 119.800 -0.429 0.000 2.170 313 Q HA -0.327 3.731 4.340 -0.469 0.000 0.203 313 Q C 2.912 178.709 176.000 -0.338 0.000 0.976 313 Q CA 2.658 58.207 55.803 -0.423 0.000 0.858 313 Q CB -0.788 27.722 28.738 -0.379 0.000 0.907 313 Q HN -0.082 7.843 8.270 -0.458 0.070 0.433 314 S N 0.703 116.225 115.700 -0.296 0.000 2.368 314 S HA -0.270 4.092 4.470 -0.180 0.000 0.225 314 S C 2.209 176.720 174.600 -0.148 0.000 1.030 314 S CA 3.439 61.522 58.200 -0.195 0.000 0.999 314 S CB -0.088 63.041 63.200 -0.119 0.000 0.844 314 S HN -0.126 7.875 8.310 -0.350 0.098 0.459 315 I N 1.769 122.254 120.570 -0.141 0.000 2.252 315 I HA -0.459 3.679 4.170 -0.053 0.000 0.245 315 I C 1.389 177.404 176.117 -0.168 0.000 1.102 315 I CA 3.856 65.108 61.300 -0.081 0.000 1.385 315 I CB 0.002 38.024 38.000 0.036 0.000 1.064 315 I HN -0.691 7.338 8.210 -0.168 0.080 0.414 316 L N -2.109 118.920 121.223 -0.324 0.000 2.131 316 L HA -0.444 3.591 4.340 -0.509 0.000 0.210 316 L C 2.164 178.851 176.870 -0.305 0.000 1.092 316 L CA 3.162 57.734 54.840 -0.447 0.000 0.759 316 L CB -0.507 41.186 42.059 -0.610 0.000 0.903 316 L HN -0.136 7.891 8.230 -0.338 0.000 0.435 317 S N -1.427 114.121 115.700 -0.252 0.000 2.423 317 S HA -0.276 4.079 4.470 -0.192 0.000 0.231 317 S C 1.838 176.360 174.600 -0.131 0.000 1.014 317 S CA 2.925 61.016 58.200 -0.182 0.000 0.965 317 S CB -0.089 63.026 63.200 -0.142 0.000 0.785 317 S HN 0.126 8.167 8.310 -0.259 0.113 0.495 318 L N -0.058 121.092 121.223 -0.121 0.000 2.240 318 L HA -0.131 4.161 4.340 -0.080 0.000 0.211 318 L C -0.043 176.769 176.870 -0.097 0.000 1.106 318 L CA 0.438 55.223 54.840 -0.091 0.000 0.793 318 L CB 0.336 42.353 42.059 -0.069 0.000 0.927 318 L HN -0.862 7.155 8.230 -0.134 0.133 0.446 319 V N -0.370 119.473 119.914 -0.118 0.000 2.539 319 V HA -0.141 3.927 4.120 -0.086 0.000 0.300 319 V C -1.442 174.594 176.094 -0.096 0.000 1.019 319 V CA -1.368 60.868 62.300 -0.106 0.000 1.160 319 V CB -1.167 30.579 31.823 -0.128 0.000 0.901 319 V HN -0.938 7.062 8.190 -0.148 0.101 0.481 320 P HA 0.202 4.577 4.420 -0.076 0.000 0.276 320 P C -0.234 177.025 177.300 -0.067 0.000 1.252 320 P CA -0.898 62.159 63.100 -0.071 0.000 0.802 320 P CB 0.811 32.475 31.700 -0.059 0.000 1.035 321 S N -0.236 115.425 115.700 -0.065 0.000 2.572 321 S HA 0.114 4.549 4.470 -0.058 0.000 0.228 321 S C -0.299 174.273 174.600 -0.046 0.000 0.963 321 S CA 0.343 58.508 58.200 -0.058 0.000 0.939 321 S CB 0.120 63.281 63.200 -0.065 0.000 0.804 321 S HN 0.573 8.843 8.310 -0.066 0.000 0.480 322 D N -1.996 118.379 120.400 -0.042 0.000 2.349 322 D HA 0.029 4.652 4.640 -0.029 0.000 0.214 322 D C 1.050 177.332 176.300 -0.030 0.000 1.063 322 D CA -0.898 53.082 54.000 -0.033 0.000 0.847 322 D CB -0.733 40.048 40.800 -0.032 0.000 0.933 322 D HN -0.272 7.997 8.370 -0.047 0.072 0.513 323 G N -0.392 108.388 108.800 -0.032 0.000 2.205 323 G HA2 -0.314 3.629 3.960 -0.029 0.000 0.261 323 G HA3 -0.314 3.631 3.960 -0.024 0.000 0.261 323 G C 0.786 175.670 174.900 -0.027 0.000 0.980 323 G CA 0.675 45.759 45.100 -0.028 0.000 0.632 323 G HN -0.083 8.124 8.290 -0.038 0.060 0.533 324 S N 1.742 117.424 115.700 -0.030 0.000 2.474 324 S HA -0.189 4.266 4.470 -0.026 0.000 0.235 324 S C 1.404 175.983 174.600 -0.036 0.000 0.997 324 S CA 1.209 59.390 58.200 -0.031 0.000 0.949 324 S CB 0.248 63.429 63.200 -0.032 0.000 0.766 324 S HN -0.366 8.121 8.310 -0.033 -0.197 0.517 325 G N 1.025 109.801 108.800 -0.040 0.000 2.309 325 G HA2 -0.441 3.492 3.960 -0.046 0.000 0.286 325 G HA3 -0.441 3.494 3.960 -0.041 0.000 0.286 325 G C -1.205 173.655 174.900 -0.067 0.000 1.002 325 G CA 0.925 45.996 45.100 -0.047 0.000 0.786 325 G HN 0.630 8.846 8.290 -0.039 0.050 0.511 326 K N -1.452 118.909 120.400 -0.064 0.000 2.182 326 K HA 0.845 5.289 4.320 -0.097 -0.183 0.262 326 K C -0.250 176.305 176.600 -0.075 0.000 0.957 326 K CA -1.722 54.520 56.287 -0.075 0.000 0.842 326 K CB 2.030 34.498 32.500 -0.054 0.000 1.099 326 K HN -0.942 7.222 8.250 -0.054 0.053 0.438 327 I N -3.939 116.576 120.570 -0.091 0.000 2.934 327 I HA 0.480 4.613 4.170 -0.062 0.000 0.306 327 I C -1.902 174.183 176.117 -0.053 0.000 1.110 327 I CA -2.713 58.543 61.300 -0.074 0.000 1.019 327 I CB 4.136 42.087 38.000 -0.082 0.000 1.227 327 I HN 0.413 8.551 8.210 -0.119 0.000 0.434 328 A N 2.870 125.671 122.820 -0.032 0.000 2.425 328 A HA 0.372 4.907 4.320 -0.006 -0.219 0.249 328 A C 0.757 178.350 177.584 0.015 0.000 1.084 328 A CA -0.416 51.615 52.037 -0.010 0.000 0.781 328 A CB 0.640 19.630 19.000 -0.018 0.000 1.019 328 A HN 0.214 8.342 8.150 -0.036 0.000 0.490 329 T N 0.613 115.200 114.554 0.055 0.000 2.918 329 T HA -0.040 4.472 4.350 0.118 -0.092 0.302 329 T C -0.882 173.863 174.700 0.076 0.000 1.045 329 T CA -0.474 61.699 62.100 0.121 0.000 1.114 329 T CB 0.974 69.957 68.868 0.191 0.000 0.965 329 T HN 0.301 8.575 8.240 0.056 0.000 0.540 330 L N -3.673 117.603 121.223 0.087 0.000 3.020 330 L HA 0.695 4.842 4.340 -0.532 -0.125 0.273 330 L C -2.640 174.250 176.870 0.034 0.000 1.018 330 L CA -0.292 54.470 54.840 -0.129 0.000 0.950 330 L CB 3.137 45.128 42.059 -0.114 0.000 1.510 330 L HN 0.460 8.789 8.230 0.165 0.000 0.404 331 D N -0.207 120.183 120.400 -0.016 0.000 2.593 331 D HA 0.853 5.778 4.640 0.105 -0.222 0.251 331 D C -1.361 174.965 176.300 0.044 0.000 1.140 331 D CA -0.318 53.732 54.000 0.084 0.000 0.855 331 D CB 3.886 44.776 40.800 0.150 0.000 1.267 331 D HN 0.157 8.404 8.370 -0.205 0.000 0.532 332 A N 4.083 126.953 122.820 0.082 0.000 2.454 332 A HA 0.913 5.380 4.320 0.042 -0.122 0.302 332 A C -2.342 175.275 177.584 0.055 0.000 1.079 332 A CA -1.651 50.427 52.037 0.068 0.000 0.731 332 A CB 4.263 23.322 19.000 0.099 0.000 1.299 332 A HN 1.094 9.206 8.150 0.116 0.107 0.413 333 S N 0.264 115.965 115.700 0.002 0.000 2.594 333 S HA 0.910 5.502 4.470 -0.096 -0.180 0.296 333 S C -1.709 172.830 174.600 -0.103 0.000 1.124 333 S CA -1.510 56.668 58.200 -0.037 0.000 1.011 333 S CB 2.674 65.879 63.200 0.007 0.000 1.016 333 S HN 0.387 8.702 8.310 0.008 0.000 0.485 334 D N 3.854 124.095 120.400 -0.265 0.000 2.596 334 D HA 0.418 5.042 4.640 -0.027 0.000 0.234 334 D C -2.514 173.715 176.300 -0.118 0.000 1.181 334 D CA -1.060 52.818 54.000 -0.203 0.000 0.856 334 D CB 4.703 45.263 40.800 -0.400 0.000 1.498 334 D HN 0.378 8.564 8.370 -0.308 0.000 0.446 335 A N -0.263 122.529 122.820 -0.045 0.000 2.594 335 A HA 0.299 4.503 4.320 -0.192 0.000 0.296 335 A C -2.968 174.149 177.584 -0.778 0.000 1.056 335 A CA -2.033 49.862 52.037 -0.238 0.000 0.693 335 A CB 2.213 21.082 19.000 -0.218 0.000 1.278 335 A HN -0.130 8.022 8.150 0.003 0.000 0.408 336 P HA 0.101 3.011 4.420 -2.517 0.000 0.275 336 P C -0.156 176.636 177.300 -0.846 0.000 1.227 336 P CA -0.611 61.548 63.100 -1.569 0.000 0.781 336 P CB 1.080 32.111 31.700 -1.116 0.000 0.906 337 R N 1.192 121.222 120.500 -0.784 0.000 2.148 337 R HA -0.113 3.878 4.340 -0.581 0.000 0.223 337 R C 0.048 175.958 176.300 -0.649 0.000 1.088 337 R CA 2.110 57.790 56.100 -0.700 0.000 0.985 337 R CB 0.519 30.313 30.300 -0.843 0.000 0.880 337 R HN 0.179 7.815 8.270 -0.879 0.107 0.451 338 F N -2.971 116.794 119.950 -0.309 0.000 2.565 338 F HA 0.436 4.786 4.527 -0.295 0.000 0.313 338 F C -2.064 173.576 175.800 -0.267 0.000 1.091 338 F CA -4.137 53.699 58.000 -0.274 0.000 0.915 338 F CB 1.577 40.460 39.000 -0.195 0.000 1.208 338 F HN -0.898 7.154 8.300 -0.370 0.025 0.453 339 P HA -0.098 4.287 4.420 -0.058 0.000 0.225 339 P C -1.676 175.609 177.300 -0.025 0.000 1.156 339 P CA 0.937 63.974 63.100 -0.105 0.000 0.787 339 P CB 0.466 32.090 31.700 -0.126 0.000 0.802 340 Y N 0.879 121.040 120.300 -0.231 0.000 2.388 340 Y HA 0.114 4.669 4.550 0.009 0.000 0.328 340 Y C -2.731 173.165 175.900 -0.007 0.000 0.963 340 Y CA -1.077 56.969 58.100 -0.090 0.000 1.240 340 Y CB 1.222 39.617 38.460 -0.109 0.000 1.118 340 Y HN -0.962 7.178 8.280 -0.165 0.041 0.484 341 R N 7.860 128.427 120.500 0.112 0.000 2.415 341 R HA 0.593 5.246 4.340 0.266 -0.154 0.292 341 R C -1.346 175.019 176.300 0.108 0.000 1.295 341 R CA -1.461 54.753 56.100 0.190 0.000 1.137 341 R CB 1.577 32.007 30.300 0.216 0.000 1.135 341 R HN 0.418 8.922 8.270 -0.057 -0.268 0.560 342 G N 2.415 111.331 108.800 0.193 0.000 2.441 342 G HA2 0.818 5.018 3.960 0.054 0.000 0.334 342 G HA3 0.818 4.937 3.960 0.265 0.000 0.334 342 G C -2.516 172.496 174.900 0.187 0.000 1.161 342 G CA -1.800 43.398 45.100 0.163 0.000 0.935 342 G HN 0.931 9.414 8.290 0.323 0.000 0.488 343 I N 0.621 121.295 120.570 0.173 0.000 2.466 343 I HA 0.867 5.336 4.170 0.116 -0.230 0.289 343 I C -1.899 174.304 176.117 0.143 0.000 1.026 343 I CA -3.094 58.294 61.300 0.148 0.000 1.078 343 I CB 2.945 41.020 38.000 0.126 0.000 1.249 343 I HN 0.506 8.820 8.210 0.174 0.000 0.429 344 F N 8.968 128.819 119.950 -0.165 0.000 2.443 344 F HA 0.872 5.356 4.527 -0.453 -0.229 0.335 344 F C -2.479 173.066 175.800 -0.425 0.000 1.104 344 F CA -2.926 54.819 58.000 -0.425 0.000 1.013 344 F CB 3.543 42.141 39.000 -0.669 0.000 1.136 344 F HN 0.903 9.270 8.300 0.111 0.000 0.470 345 L N 7.710 128.288 121.223 -1.076 0.000 2.406 345 L HA 0.626 4.736 4.340 -0.673 -0.173 0.272 345 L C -2.316 173.985 176.870 -0.948 0.000 0.980 345 L CA -1.115 53.274 54.840 -0.752 0.000 0.831 345 L CB 4.604 46.549 42.059 -0.190 0.000 1.253 345 L HN 0.686 8.151 8.230 -1.275 0.000 0.406 346 D N 6.396 126.368 120.400 -0.714 0.000 2.339 346 D HA 0.131 4.549 4.640 -0.370 0.000 0.241 346 D C -0.271 176.043 176.300 0.024 0.000 1.183 346 D CA -0.723 53.074 54.000 -0.340 0.000 0.859 346 D CB 0.824 41.507 40.800 -0.196 0.000 1.067 346 D HN 0.192 8.220 8.370 -0.569 0.000 0.484 347 V N -0.358 119.617 119.914 0.102 0.000 3.578 347 V HA 0.493 4.888 4.120 0.182 -0.165 0.290 347 V C 0.199 176.393 176.094 0.167 0.000 1.376 347 V CA -1.347 61.062 62.300 0.182 0.000 1.083 347 V CB -0.103 31.887 31.823 0.279 0.000 0.911 347 V HN -0.360 7.856 8.190 0.044 0.000 0.433 348 A N 2.261 125.170 122.820 0.148 0.000 1.878 348 A HA -0.077 4.317 4.320 0.124 0.000 0.213 348 A C 1.746 179.450 177.584 0.202 0.000 1.192 348 A CA 2.998 55.127 52.037 0.154 0.000 0.619 348 A CB -0.404 18.686 19.000 0.149 0.000 0.837 348 A HN 0.017 8.396 8.150 0.160 -0.133 0.446 349 R N -2.549 118.068 120.500 0.194 0.000 2.073 349 R HA -0.224 4.300 4.340 0.307 0.000 0.234 349 R C -0.645 175.726 176.300 0.119 0.000 1.134 349 R CA 2.466 58.656 56.100 0.150 0.000 0.952 349 R CB 0.307 30.562 30.300 -0.075 0.000 0.850 349 R HN -0.242 8.484 8.270 0.194 -0.340 0.433 350 N N -4.957 113.787 118.700 0.074 0.000 2.287 350 N HA 0.091 5.008 4.740 0.295 0.000 0.289 350 N C -2.257 173.222 175.510 -0.052 0.000 1.066 350 N CA -0.647 52.463 53.050 0.099 0.000 0.841 350 N CB 3.757 42.236 38.487 -0.014 0.000 1.599 350 N HN -0.617 7.797 8.380 0.058 0.000 0.476 351 F N 3.035 122.907 119.950 -0.131 0.000 2.418 351 F HA 0.007 4.556 4.527 -0.228 -0.159 0.341 351 F C -1.239 174.218 175.800 -0.571 0.000 1.120 351 F CA -0.380 57.453 58.000 -0.278 0.000 1.232 351 F CB 1.564 40.414 39.000 -0.250 0.000 1.175 351 F HN -0.041 8.516 8.300 0.429 0.000 0.569 352 H N 4.297 122.979 119.070 -0.646 0.000 2.589 352 H HA 0.360 4.997 4.556 -0.249 -0.231 0.351 352 H C -0.712 174.171 175.328 -0.742 0.000 1.074 352 H CA -1.873 53.909 56.048 -0.443 0.000 1.203 352 H CB 2.928 32.606 29.762 -0.141 0.000 1.558 352 H HN -0.150 7.477 8.280 -1.088 0.000 0.522 353 K N 3.505 123.720 120.400 -0.307 0.000 2.276 353 K HA -0.005 4.160 4.320 -0.259 0.000 0.259 353 K C 0.791 177.421 176.600 0.049 0.000 1.001 353 K CA -1.488 54.710 56.287 -0.147 0.000 0.927 353 K CB 0.619 33.125 32.500 0.010 0.000 0.969 353 K HN -0.185 8.397 8.250 -0.097 -0.390 0.490 354 K N 3.034 123.560 120.400 0.210 0.000 2.074 354 K HA -0.506 3.880 4.320 0.109 0.000 0.209 354 K C 1.215 177.790 176.600 -0.042 0.000 1.048 354 K CA 3.973 60.349 56.287 0.149 0.000 0.926 354 K CB -0.222 32.380 32.500 0.170 0.000 0.713 354 K HN 0.695 9.095 8.250 0.251 0.000 0.444 355 D N -3.337 117.044 120.400 -0.032 0.000 2.144 355 D HA -0.226 4.338 4.640 -0.126 0.000 0.199 355 D C 1.521 177.772 176.300 -0.082 0.000 0.984 355 D CA 2.851 56.805 54.000 -0.076 0.000 0.834 355 D CB -1.196 39.582 40.800 -0.037 0.000 0.955 355 D HN -0.023 8.351 8.370 0.014 0.004 0.465 356 A N 0.306 123.102 122.820 -0.040 0.000 1.897 356 A HA -0.203 4.101 4.320 -0.026 0.000 0.215 356 A C 2.062 179.601 177.584 -0.074 0.000 1.181 356 A CA 2.597 54.617 52.037 -0.029 0.000 0.620 356 A CB -0.204 18.803 19.000 0.012 0.000 0.821 356 A HN -0.543 7.490 8.150 -0.013 0.109 0.443 357 V N -0.735 119.118 119.914 -0.102 0.000 2.332 357 V HA -0.478 3.518 4.120 -0.208 0.000 0.248 357 V C 2.107 177.999 176.094 -0.337 0.000 1.055 357 V CA 4.557 66.723 62.300 -0.223 0.000 1.038 357 V CB -0.739 30.945 31.823 -0.233 0.000 0.651 357 V HN -0.215 7.944 8.190 -0.053 0.000 0.450 358 L N -1.718 119.289 121.223 -0.359 0.000 2.017 358 L HA -0.475 3.505 4.340 -0.600 0.000 0.208 358 L C 2.235 178.996 176.870 -0.181 0.000 1.073 358 L CA 3.448 57.989 54.840 -0.500 0.000 0.745 358 L CB -1.031 40.537 42.059 -0.817 0.000 0.894 358 L HN 0.101 8.147 8.230 -0.306 0.000 0.432 359 R N -1.817 118.609 120.500 -0.122 0.000 2.091 359 R HA -0.333 3.993 4.340 -0.024 0.000 0.238 359 R C 2.851 179.141 176.300 -0.017 0.000 1.136 359 R CA 3.273 59.344 56.100 -0.047 0.000 0.959 359 R CB -0.307 29.965 30.300 -0.046 0.000 0.856 359 R HN -0.328 7.856 8.270 -0.144 0.000 0.437 360 L N 0.045 121.256 121.223 -0.020 0.000 2.046 360 L HA -0.248 4.243 4.340 0.252 0.000 0.208 360 L C 1.323 178.172 176.870 -0.035 0.000 1.077 360 L CA 3.093 57.962 54.840 0.048 0.000 0.747 360 L CB -0.324 41.706 42.059 -0.049 0.000 0.896 360 L HN -0.354 7.834 8.230 -0.071 0.000 0.432 361 L N -1.604 119.523 121.223 -0.159 0.000 2.083 361 L HA -0.483 3.751 4.340 -0.178 0.000 0.209 361 L C 2.043 178.923 176.870 0.018 0.000 1.083 361 L CA 3.356 58.120 54.840 -0.126 0.000 0.752 361 L CB -0.930 41.056 42.059 -0.121 0.000 0.899 361 L HN -0.232 7.790 8.230 -0.219 0.076 0.433 362 D N -0.665 119.782 120.400 0.077 0.000 2.092 362 D HA -0.367 4.292 4.640 0.031 0.000 0.193 362 D C 2.610 178.920 176.300 0.015 0.000 0.994 362 D CA 3.836 57.861 54.000 0.043 0.000 0.828 362 D CB -0.442 40.382 40.800 0.041 0.000 0.963 362 D HN -0.058 8.372 8.370 0.100 0.000 0.450 363 Q N -1.113 118.716 119.800 0.048 0.000 2.119 363 Q HA -0.242 4.125 4.340 0.045 0.000 0.201 363 Q C 2.663 178.802 176.000 0.232 0.000 0.972 363 Q CA 2.197 58.077 55.803 0.128 0.000 0.847 363 Q CB -0.318 28.505 28.738 0.141 0.000 0.903 363 Q HN -0.499 7.799 8.270 0.046 0.000 0.433 364 M N -0.735 118.981 119.600 0.194 0.000 2.080 364 M HA -0.464 4.162 4.480 0.244 0.000 0.260 364 M C 2.016 178.405 176.300 0.147 0.000 1.068 364 M CA 3.892 59.300 55.300 0.179 0.000 1.109 364 M CB -0.203 32.448 32.600 0.086 0.000 1.342 364 M HN 0.162 8.541 8.290 0.149 0.000 0.405 365 A N -1.722 121.165 122.820 0.112 0.000 1.930 365 A HA -0.207 4.300 4.320 0.313 0.000 0.217 365 A C 2.528 180.167 177.584 0.092 0.000 1.175 365 A CA 2.722 54.880 52.037 0.201 0.000 0.627 365 A CB -0.739 18.403 19.000 0.236 0.000 0.815 365 A HN -0.258 7.939 8.150 0.078 0.000 0.443 366 A N -1.782 120.962 122.820 -0.127 0.000 2.024 366 A HA -0.150 4.142 4.320 -0.387 -0.204 0.220 366 A C -0.152 177.020 177.584 -0.686 0.000 1.164 366 A CA 2.177 53.929 52.037 -0.474 0.000 0.643 366 A CB 0.114 18.695 19.000 -0.700 0.000 0.806 366 A HN -0.358 7.673 8.150 -0.078 0.073 0.451 367 Y N -6.623 113.666 120.300 -0.017 0.000 2.660 367 Y HA 0.091 4.577 4.550 -0.107 0.000 0.254 367 Y C -1.024 174.815 175.900 -0.102 0.000 1.176 367 Y CA -2.017 56.054 58.100 -0.049 0.000 1.195 367 Y CB -0.374 38.113 38.460 0.045 0.000 1.190 367 Y HN -0.842 7.264 8.280 -0.055 0.141 0.535 368 K N -6.167 114.191 120.400 -0.069 0.000 3.281 368 K HA -0.450 3.821 4.320 -0.082 0.000 0.295 368 K C -1.104 175.500 176.600 0.008 0.000 1.233 368 K CA 1.029 57.165 56.287 -0.251 0.000 0.866 368 K CB -2.862 29.138 32.500 -0.833 0.000 1.265 368 K HN -0.514 7.530 8.250 -0.022 0.193 0.482 369 L N -2.436 118.869 121.223 0.137 0.000 2.380 369 L HA -0.131 4.313 4.340 0.175 0.000 0.273 369 L C -0.554 176.409 176.870 0.154 0.000 1.138 369 L CA 0.880 55.817 54.840 0.162 0.000 0.832 369 L CB 0.226 42.384 42.059 0.164 0.000 1.124 369 L HN -0.147 8.133 8.230 0.155 0.042 0.454 370 N N 0.478 119.253 118.700 0.124 0.000 2.143 370 N HA 0.116 4.921 4.740 0.108 0.000 0.222 370 N C -1.117 174.390 175.510 -0.004 0.000 1.264 370 N CA -0.857 52.255 53.050 0.105 0.000 0.897 370 N CB 1.876 40.475 38.487 0.187 0.000 1.092 370 N HN 0.497 8.937 8.380 0.099 0.000 0.516 371 K N 0.532 120.893 120.400 -0.065 0.000 2.507 371 K HA 0.604 5.036 4.320 -0.113 -0.180 0.252 371 K C -2.719 173.905 176.600 0.041 0.000 0.943 371 K CA -1.500 54.691 56.287 -0.161 0.000 0.808 371 K CB 2.272 34.373 32.500 -0.666 0.000 1.142 371 K HN -0.548 7.690 8.250 -0.020 0.000 0.426 372 F N 7.017 126.909 119.950 -0.097 0.000 2.325 372 F HA 0.643 5.339 4.527 -0.072 -0.212 0.369 372 F C -1.874 173.930 175.800 0.007 0.000 1.095 372 F CA -2.833 55.114 58.000 -0.087 0.000 1.082 372 F CB 2.244 41.134 39.000 -0.184 0.000 1.289 372 F HN 0.752 9.133 8.300 0.135 0.000 0.462 373 H N 11.196 130.067 119.070 -0.333 0.000 2.761 373 H HA 0.402 5.014 4.556 -0.224 -0.191 0.284 373 H C -1.887 173.058 175.328 -0.637 0.000 1.105 373 H CA -2.650 53.217 56.048 -0.302 0.000 1.352 373 H CB 1.286 31.037 29.762 -0.018 0.000 1.423 373 H HN 0.719 9.004 8.280 0.008 0.000 0.464 374 F N 10.079 129.718 119.950 -0.518 0.000 2.313 374 F HA 0.401 4.388 4.527 -0.900 0.000 0.369 374 F C -1.904 173.648 175.800 -0.413 0.000 1.109 374 F CA -4.055 53.535 58.000 -0.683 0.000 1.132 374 F CB 0.452 39.136 39.000 -0.526 0.000 1.291 374 F HN 0.932 9.109 8.300 -0.025 0.108 0.496 375 H N 9.194 127.987 119.070 -0.462 0.000 3.008 375 H HA 0.164 4.541 4.556 -0.298 0.000 0.268 375 H C -0.534 174.580 175.328 -0.357 0.000 1.323 375 H CA -0.494 55.295 56.048 -0.431 0.000 1.401 375 H CB -0.364 28.996 29.762 -0.671 0.000 1.556 375 H HN 0.596 8.578 8.280 -0.497 0.000 0.502 376 L N 5.230 126.128 121.223 -0.542 0.000 2.509 376 L HA -0.050 3.992 4.340 -0.497 0.000 0.222 376 L C -1.180 175.330 176.870 -0.600 0.000 1.123 376 L CA 0.730 55.216 54.840 -0.591 0.000 0.856 376 L CB 0.433 42.057 42.059 -0.725 0.000 0.985 376 L HN -0.396 7.493 8.230 -0.569 0.000 0.456 377 S N -6.256 109.083 115.700 -0.602 0.000 2.556 377 S HA 0.739 5.207 4.470 -0.305 -0.181 0.271 377 S C -1.450 173.009 174.600 -0.235 0.000 1.135 377 S CA -1.337 56.605 58.200 -0.430 0.000 0.858 377 S CB 2.682 65.535 63.200 -0.578 0.000 1.114 377 S HN -0.805 7.019 8.310 -0.730 0.048 0.468 378 D N -0.025 120.385 120.400 0.016 0.000 3.376 378 D HA 0.398 5.324 4.640 0.171 -0.183 0.344 378 D C -0.631 175.738 176.300 0.115 0.000 1.428 378 D CA -0.881 53.214 54.000 0.159 0.000 0.949 378 D CB 2.468 43.462 40.800 0.324 0.000 1.451 378 D HN 0.068 8.468 8.370 0.050 0.000 0.578 379 D N 0.448 120.900 120.400 0.087 0.000 2.144 379 D HA -0.234 4.362 4.640 -0.225 -0.091 0.200 379 D C 0.157 176.379 176.300 -0.130 0.000 0.978 379 D CA 3.559 57.447 54.000 -0.188 0.000 0.833 379 D CB 0.319 40.824 40.800 -0.491 0.000 0.961 379 D HN 0.507 9.009 8.370 0.221 0.000 0.470 380 E N -4.726 115.531 120.200 0.094 0.000 2.476 380 E HA 0.118 4.529 4.350 0.100 0.000 0.196 380 E C -1.079 175.628 176.600 0.178 0.000 1.029 380 E CA 0.022 56.526 56.400 0.174 0.000 0.896 380 E CB 0.037 29.960 29.700 0.372 0.000 1.012 380 E HN -0.120 8.324 8.360 0.183 0.026 0.475 381 G N -2.717 106.172 108.800 0.148 0.000 2.556 381 G HA2 0.113 4.347 3.960 0.130 0.000 0.294 381 G HA3 0.113 4.267 3.960 0.136 -0.112 0.294 381 G C -3.404 171.588 174.900 0.154 0.000 1.516 381 G CA 0.505 45.689 45.100 0.140 0.000 0.824 381 G HN -0.808 7.504 8.290 0.133 0.058 0.535 382 W N 2.704 123.981 121.300 -0.039 0.000 2.554 382 W HA 0.632 5.263 4.660 -0.049 0.000 0.324 382 W C -2.043 174.423 176.519 -0.088 0.000 1.018 382 W CA -1.636 55.672 57.345 -0.062 0.000 1.243 382 W CB 3.521 32.940 29.460 -0.069 0.000 1.345 382 W HN 0.459 8.662 8.180 0.196 0.095 0.441 383 R N 4.347 124.675 120.500 -0.286 0.000 2.509 383 R HA 0.186 4.510 4.340 -0.026 0.000 0.300 383 R C -1.624 174.665 176.300 -0.019 0.000 0.985 383 R CA -1.378 54.656 56.100 -0.110 0.000 1.092 383 R CB 0.595 30.855 30.300 -0.066 0.000 1.237 383 R HN 0.327 8.187 8.270 -0.683 0.000 0.546 384 I N 0.520 121.042 120.570 -0.079 0.000 2.478 384 I HA 0.490 4.931 4.170 0.174 -0.167 0.287 384 I C -2.379 173.861 176.117 0.204 0.000 1.042 384 I CA -3.048 58.269 61.300 0.029 0.000 1.067 384 I CB 3.536 41.372 38.000 -0.273 0.000 1.233 384 I HN -0.715 7.344 8.210 -0.252 0.000 0.431 385 E N 9.594 129.897 120.200 0.171 0.000 2.417 385 E HA -0.082 4.226 4.350 -0.069 0.000 0.261 385 E C -1.944 174.687 176.600 0.052 0.000 1.000 385 E CA 0.647 57.083 56.400 0.060 0.000 0.919 385 E CB 0.740 30.523 29.700 0.138 0.000 0.955 385 E HN -0.004 8.525 8.360 0.282 0.000 0.455 386 I N 6.242 126.807 120.570 -0.007 0.000 2.382 386 I HA 0.427 4.582 4.170 -0.024 0.000 0.285 386 I C -2.428 173.637 176.117 -0.087 0.000 1.007 386 I CA -4.689 56.586 61.300 -0.041 0.000 1.142 386 I CB 0.462 38.407 38.000 -0.091 0.000 1.289 386 I HN 0.267 8.434 8.210 -0.071 0.000 0.453 387 P HA -0.015 4.383 4.420 -0.036 0.000 0.261 387 P C -0.004 177.249 177.300 -0.079 0.000 1.183 387 P CA 1.083 64.156 63.100 -0.044 0.000 0.761 387 P CB 0.037 31.730 31.700 -0.011 0.000 0.785 388 G N 1.183 109.939 108.800 -0.073 0.000 2.195 388 G HA2 -0.394 3.543 3.960 -0.039 0.000 0.246 388 G HA3 -0.394 3.523 3.960 -0.073 0.000 0.246 388 G C -1.099 173.722 174.900 -0.132 0.000 0.984 388 G CA 0.506 45.560 45.100 -0.076 0.000 0.633 388 G HN 0.345 8.601 8.290 -0.057 0.000 0.525 389 L N -0.780 120.329 121.223 -0.189 0.000 2.678 389 L HA 0.621 4.844 4.340 -0.195 0.000 0.250 389 L C -1.759 174.977 176.870 -0.224 0.000 1.455 389 L CA -2.714 51.983 54.840 -0.238 0.000 0.823 389 L CB 0.117 41.955 42.059 -0.370 0.000 1.107 389 L HN -0.151 7.899 8.230 -0.173 0.077 0.514 390 P HA -0.138 4.162 4.420 -0.201 0.000 0.216 390 P C 1.492 178.664 177.300 -0.212 0.000 1.150 390 P CA 2.118 65.113 63.100 -0.175 0.000 0.837 390 P CB 0.442 32.074 31.700 -0.113 0.000 0.786 391 E N -2.040 118.050 120.200 -0.183 0.000 2.209 391 E HA -0.278 3.975 4.350 -0.160 0.000 0.196 391 E C 2.537 178.981 176.600 -0.261 0.000 0.993 391 E CA 3.102 59.394 56.400 -0.179 0.000 0.819 391 E CB -1.293 28.329 29.700 -0.131 0.000 0.745 391 E HN 0.294 8.547 8.360 -0.151 0.016 0.477 392 L N -2.572 118.422 121.223 -0.382 0.000 2.042 392 L HA -0.331 3.660 4.340 -0.581 0.000 0.210 392 L C 1.631 178.248 176.870 -0.420 0.000 1.076 392 L CA 3.067 57.539 54.840 -0.612 0.000 0.749 392 L CB -0.288 41.084 42.059 -1.146 0.000 0.893 392 L HN -0.408 7.572 8.230 -0.364 0.032 0.432 393 T N -4.420 109.889 114.554 -0.409 0.000 3.010 393 T HA -0.061 4.136 4.350 -0.359 -0.063 0.252 393 T C 2.237 176.673 174.700 -0.440 0.000 1.047 393 T CA 2.503 64.270 62.100 -0.556 0.000 1.140 393 T CB 0.119 68.252 68.868 -1.225 0.000 0.885 393 T HN -0.635 7.353 8.240 -0.420 0.000 0.464 394 E N 2.345 122.357 120.200 -0.313 0.000 2.077 394 E HA -0.230 4.038 4.350 -0.137 0.000 0.193 394 E C 1.190 177.721 176.600 -0.114 0.000 0.989 394 E CA 2.858 59.154 56.400 -0.173 0.000 0.800 394 E CB 0.081 29.702 29.700 -0.132 0.000 0.746 394 E HN -0.114 8.055 8.360 -0.319 0.000 0.452 395 V N -3.235 116.604 119.914 -0.124 0.000 2.599 395 V HA 0.085 4.318 4.120 -0.066 -0.153 0.237 395 V C 2.280 178.332 176.094 -0.071 0.000 1.081 395 V CA 1.302 63.550 62.300 -0.086 0.000 1.107 395 V CB 0.990 32.762 31.823 -0.084 0.000 0.808 395 V HN -0.307 7.676 8.190 -0.162 0.109 0.486 396 G N -1.351 107.397 108.800 -0.087 0.000 2.470 396 G HA2 -0.220 3.742 3.960 0.003 0.000 0.220 396 G HA3 -0.220 3.889 3.960 -0.002 -0.150 0.220 396 G C 0.771 175.692 174.900 0.034 0.000 1.121 396 G CA 2.309 47.402 45.100 -0.012 0.000 0.766 396 G HN -0.261 7.944 8.290 -0.142 0.000 0.553 397 G N -1.459 107.325 108.800 -0.027 0.000 2.920 397 G HA2 -0.012 4.079 3.960 0.001 0.000 0.208 397 G HA3 -0.012 4.048 3.960 -0.014 -0.109 0.208 397 G C -1.883 172.986 174.900 -0.052 0.000 1.159 397 G CA -0.341 44.748 45.100 -0.019 0.000 0.784 397 G HN -0.419 7.672 8.290 -0.094 0.142 0.535 398 Q N -3.853 115.927 119.800 -0.032 0.000 2.418 398 Q HA 0.944 5.487 4.340 -0.045 -0.229 0.282 398 Q C -1.752 174.262 176.000 0.023 0.000 1.044 398 Q CA -2.249 53.532 55.803 -0.037 0.000 0.813 398 Q CB 3.638 32.350 28.738 -0.044 0.000 1.428 398 Q HN -0.555 7.642 8.270 -0.021 0.060 0.402 399 R N 0.589 121.134 120.500 0.076 0.000 2.637 399 R HA 1.039 5.608 4.340 0.080 -0.181 0.291 399 R C -1.048 175.310 176.300 0.096 0.000 0.963 399 R CA -1.319 54.850 56.100 0.115 0.000 0.901 399 R CB 3.996 34.419 30.300 0.205 0.000 1.160 399 R HN 0.924 9.122 8.270 0.074 0.116 0.457 400 c N -1.780 116.854 118.600 0.057 0.000 3.275 400 c HA 0.700 5.463 4.570 0.033 -0.173 0.340 400 c C -1.652 172.441 174.090 0.004 0.000 1.366 400 c CA -2.458 53.890 56.329 0.032 0.000 1.227 400 c CB 3.371 45.890 42.510 0.014 0.000 1.512 400 c HN 0.795 9.051 8.230 0.043 0.000 0.461 401 H N 2.805 121.815 119.070 -0.099 0.000 3.224 401 H HA -0.065 4.431 4.556 -0.100 0.000 0.265 401 H C -1.466 173.817 175.328 -0.074 0.000 1.461 401 H CA 1.387 57.365 56.048 -0.116 0.000 1.509 401 H CB -0.875 28.767 29.762 -0.201 0.000 1.686 401 H HN 0.120 8.424 8.280 0.039 0.000 0.514 402 D N 7.117 127.326 120.400 -0.319 0.000 2.346 402 D HA 0.148 4.666 4.640 -0.202 0.000 0.255 402 D C 0.141 176.296 176.300 -0.242 0.000 1.276 402 D CA -1.088 52.780 54.000 -0.219 0.000 0.941 402 D CB 0.642 41.380 40.800 -0.104 0.000 1.199 402 D HN -0.222 7.949 8.370 -0.286 0.028 0.537 403 L N 4.642 125.689 121.223 -0.292 0.000 2.275 403 L HA -0.200 4.003 4.340 -0.228 0.000 0.215 403 L C 1.311 178.115 176.870 -0.110 0.000 1.119 403 L CA 2.217 56.933 54.840 -0.206 0.000 0.790 403 L CB -0.207 41.754 42.059 -0.163 0.000 0.919 403 L HN 0.403 8.442 8.230 -0.319 0.000 0.443 404 S N -2.317 113.331 115.700 -0.087 0.000 2.496 404 S HA -0.149 4.292 4.470 -0.048 0.000 0.224 404 S C 0.254 174.824 174.600 -0.050 0.000 0.996 404 S CA 0.457 58.625 58.200 -0.054 0.000 0.927 404 S CB 0.702 63.879 63.200 -0.037 0.000 0.774 404 S HN -0.583 7.801 8.310 -0.097 -0.132 0.524 405 E N -2.363 117.799 120.200 -0.063 0.000 2.269 405 E HA -0.314 4.142 4.350 -0.058 -0.141 0.223 405 E C -0.792 175.784 176.600 -0.040 0.000 1.244 405 E CA 0.871 57.240 56.400 -0.052 0.000 0.713 405 E CB -1.758 27.915 29.700 -0.046 0.000 1.178 405 E HN -0.304 7.911 8.360 -0.085 0.094 0.370 406 T N -2.632 111.899 114.554 -0.038 0.000 3.037 406 T HA 0.032 4.365 4.350 -0.029 0.000 0.252 406 T C -0.337 174.343 174.700 -0.034 0.000 1.073 406 T CA 1.135 63.216 62.100 -0.031 0.000 1.091 406 T CB 1.003 69.857 68.868 -0.024 0.000 0.935 406 T HN -0.346 8.055 8.240 -0.043 -0.186 0.488 407 T N -0.675 113.858 114.554 -0.036 0.000 2.954 407 T HA 0.329 nan 4.350 nan 0.000 0.252 407 T C -0.768 173.911 174.700 -0.034 0.000 0.983 407 T CA 0.445 62.524 62.100 -0.034 0.000 0.941 407 T CB 1.258 70.110 68.868 -0.027 0.000 1.141 407 T HN -0.206 8.336 8.240 -0.039 -0.325 0.500 408 c N -0.091 118.489 118.600 -0.034 0.000 3.241 408 c HA 0.330 4.977 4.570 -0.022 -0.090 0.312 408 c C -2.046 172.030 174.090 -0.023 0.000 1.350 408 c CA -1.352 54.963 56.329 -0.024 0.000 1.415 408 c CB 4.065 46.566 42.510 -0.014 0.000 1.770 408 c HN -0.700 7.668 8.230 -0.039 -0.161 0.466 409 L N -1.196 120.026 121.223 -0.003 0.000 2.418 409 L HA 0.182 4.650 4.340 -0.010 -0.135 0.265 409 L C 0.025 176.910 176.870 0.026 0.000 1.143 409 L CA -0.682 54.163 54.840 0.008 0.000 0.809 409 L CB 0.616 42.691 42.059 0.027 0.000 1.124 409 L HN 0.284 8.518 8.230 0.007 0.000 0.456 410 L N 1.695 122.934 121.223 0.026 0.000 2.506 410 L HA 0.043 4.556 4.340 0.007 -0.168 0.281 410 L C -1.390 175.546 176.870 0.111 0.000 1.228 410 L CA -0.613 54.248 54.840 0.034 0.000 0.850 410 L CB -0.740 41.335 42.059 0.028 0.000 1.110 410 L HN -0.311 8.244 8.230 0.020 -0.313 0.496 411 P HA -0.095 4.438 4.420 0.188 0.000 0.266 411 P C -1.815 175.661 177.300 0.294 0.000 1.195 411 P CA 0.299 63.541 63.100 0.236 0.000 0.768 411 P CB 0.262 32.159 31.700 0.328 0.000 0.838 412 Q N -1.211 118.666 119.800 0.128 0.000 2.456 412 Q HA 0.259 4.771 4.340 -0.014 -0.181 0.284 412 Q C -0.585 175.194 176.000 -0.368 0.000 1.061 412 Q CA -1.498 54.224 55.803 -0.135 0.000 0.799 412 Q CB 4.360 32.972 28.738 -0.210 0.000 1.445 412 Q HN -0.017 8.318 8.270 0.107 0.000 0.411 413 Y N -3.086 116.994 120.300 -0.366 0.000 4.272 413 Y HA -0.432 4.125 4.550 -0.094 -0.063 0.232 413 Y C -0.114 175.598 175.900 -0.315 0.000 1.149 413 Y CA 1.391 59.348 58.100 -0.238 0.000 1.961 413 Y CB -2.067 36.349 38.460 -0.074 0.000 1.611 413 Y HN 0.767 9.201 8.280 -0.625 -0.529 0.682 414 G N -5.533 102.950 108.800 -0.527 0.000 2.295 414 G HA2 -0.478 3.603 3.960 0.093 0.000 0.287 414 G HA3 -0.478 3.578 3.960 0.111 -0.029 0.287 414 G C 0.522 175.410 174.900 -0.020 0.000 1.055 414 G CA 0.445 45.505 45.100 -0.065 0.000 0.922 414 G HN 0.328 7.587 8.290 -1.660 0.035 0.503 415 Q N -1.293 118.434 119.800 -0.122 0.000 2.247 415 Q HA 0.115 4.365 4.340 -0.150 0.000 0.204 415 Q C -0.106 175.882 176.000 -0.019 0.000 0.872 415 Q CA -1.463 54.235 55.803 -0.175 0.000 0.951 415 Q CB 0.691 29.063 28.738 -0.609 0.000 1.099 415 Q HN -0.234 7.919 8.270 -0.194 0.000 0.501 416 G N -0.555 108.296 108.800 0.084 0.000 2.712 416 G HA2 -0.168 3.863 3.960 0.119 0.000 0.683 416 G HA3 -0.168 3.810 3.960 0.030 0.000 0.683 416 G C -2.274 172.587 174.900 -0.065 0.000 1.320 416 G CA -0.816 44.319 45.100 0.059 0.000 0.847 416 G HN -0.506 7.812 8.290 0.155 0.065 0.553 417 P HA 0.026 4.116 4.420 -0.549 0.000 0.230 417 P C -1.116 176.056 177.300 -0.213 0.000 1.168 417 P CA 0.639 63.380 63.100 -0.599 0.000 0.793 417 P CB 0.676 31.672 31.700 -1.172 0.000 0.851 418 D N -0.927 119.408 120.400 -0.108 0.000 2.354 418 D HA -0.024 4.596 4.640 -0.035 0.000 0.247 418 D C 0.111 176.430 176.300 0.032 0.000 1.138 418 D CA -0.439 53.544 54.000 -0.029 0.000 0.958 418 D CB 0.474 41.267 40.800 -0.012 0.000 1.144 418 D HN -0.294 7.976 8.370 -0.107 0.036 0.458 419 V N 0.165 120.097 119.914 0.030 0.000 2.583 419 V HA -0.213 4.144 4.120 0.047 -0.210 0.302 419 V C -0.570 175.574 176.094 0.084 0.000 1.033 419 V CA 1.420 63.744 62.300 0.039 0.000 1.194 419 V CB -0.233 31.592 31.823 0.003 0.000 0.879 419 V HN 0.165 8.363 8.190 0.012 0.000 0.482 420 Y N 8.665 128.964 120.300 -0.001 0.000 2.373 420 Y HA 0.200 4.753 4.550 0.004 0.000 0.336 420 Y C -2.177 173.718 175.900 -0.008 0.000 0.979 420 Y CA -1.116 56.988 58.100 0.007 0.000 1.080 420 Y CB 3.241 41.720 38.460 0.032 0.000 1.190 420 Y HN 0.657 9.014 8.280 0.129 0.000 0.446 421 G N 5.053 113.252 108.800 -1.002 0.000 2.360 421 G HA2 0.179 3.557 3.960 -0.971 0.000 0.276 421 G HA3 0.179 4.029 3.960 -0.472 -0.172 0.276 421 G C -2.578 171.873 174.900 -0.749 0.000 1.256 421 G CA 0.311 44.931 45.100 -0.800 0.000 0.890 421 G HN -0.188 7.552 8.290 -0.916 0.000 0.486 422 G N -2.788 105.540 108.800 -0.786 0.000 2.350 422 G HA2 0.172 3.615 3.960 -0.861 0.000 0.305 422 G HA3 0.172 3.119 3.960 -1.687 0.000 0.305 422 G C -3.503 170.586 174.900 -1.353 0.000 1.479 422 G CA 0.409 44.774 45.100 -1.225 0.000 0.949 422 G HN 0.158 8.123 8.290 -0.541 0.000 0.651 423 F N -4.036 115.196 119.950 -1.195 0.000 2.719 423 F HA 0.298 4.280 4.527 -0.908 0.000 0.309 423 F C -2.590 172.942 175.800 -0.447 0.000 1.138 423 F CA -1.946 55.592 58.000 -0.770 0.000 0.943 423 F CB 3.065 41.855 39.000 -0.350 0.000 1.304 423 F HN -0.239 7.189 8.300 -1.453 0.000 0.445 424 F N 1.907 122.019 119.950 0.269 0.000 2.421 424 F HA 0.293 5.052 4.527 0.160 -0.136 0.358 424 F C 0.549 176.540 175.800 0.319 0.000 1.115 424 F CA -1.588 56.561 58.000 0.248 0.000 1.160 424 F CB -0.183 38.997 39.000 0.299 0.000 1.123 424 F HN 0.369 8.543 8.300 -0.042 0.101 0.508 425 S N 4.637 120.553 115.700 0.360 0.000 2.587 425 S HA 0.055 4.901 4.470 0.449 -0.106 0.260 425 S C 1.306 176.096 174.600 0.316 0.000 1.353 425 S CA -0.127 58.285 58.200 0.353 0.000 0.995 425 S CB 1.660 64.992 63.200 0.220 0.000 0.912 425 S HN 0.079 8.770 8.310 0.209 -0.255 0.568 426 R N 0.613 121.257 120.500 0.239 0.000 2.096 426 R HA -0.378 4.099 4.340 0.229 0.000 0.235 426 R C 2.445 178.873 176.300 0.214 0.000 1.127 426 R CA 3.874 60.100 56.100 0.211 0.000 0.968 426 R CB -0.116 30.273 30.300 0.148 0.000 0.861 426 R HN 0.362 9.093 8.270 0.219 -0.330 0.440 427 Q N -1.841 118.061 119.800 0.169 0.000 2.083 427 Q HA -0.235 4.177 4.340 0.119 0.000 0.198 427 Q C 2.089 178.169 176.000 0.134 0.000 0.969 427 Q CA 2.825 58.706 55.803 0.130 0.000 0.838 427 Q CB -0.947 27.849 28.738 0.097 0.000 0.900 427 Q HN 0.174 8.536 8.270 0.161 0.005 0.436 428 D N 0.580 121.087 120.400 0.178 0.000 2.116 428 D HA -0.309 4.404 4.640 0.120 0.000 0.193 428 D C 2.296 178.682 176.300 0.143 0.000 0.998 428 D CA 3.552 57.662 54.000 0.183 0.000 0.836 428 D CB -0.384 40.616 40.800 0.334 0.000 0.951 428 D HN -0.365 8.123 8.370 0.197 0.000 0.449 429 Y N 0.863 121.218 120.300 0.092 0.000 2.145 429 Y HA -0.385 4.154 4.550 -0.018 0.000 0.286 429 Y C 1.908 177.799 175.900 -0.015 0.000 1.145 429 Y CA 3.817 61.937 58.100 0.033 0.000 1.148 429 Y CB 0.144 38.658 38.460 0.091 0.000 0.981 429 Y HN -0.309 8.197 8.280 0.386 0.005 0.507 430 I N -0.799 119.799 120.570 0.046 0.000 2.208 430 I HA -0.643 3.446 4.170 -0.135 0.000 0.245 430 I C 1.856 177.919 176.117 -0.090 0.000 1.097 430 I CA 4.495 65.766 61.300 -0.049 0.000 1.363 430 I CB -0.423 37.601 38.000 0.040 0.000 1.051 430 I HN -0.045 8.280 8.210 0.192 0.000 0.413 431 D N 0.270 120.643 120.400 -0.045 0.000 2.104 431 D HA -0.287 4.342 4.640 -0.018 0.000 0.194 431 D C 2.736 178.984 176.300 -0.086 0.000 0.994 431 D CA 3.698 57.672 54.000 -0.043 0.000 0.830 431 D CB -0.547 40.239 40.800 -0.024 0.000 0.959 431 D HN -0.042 8.255 8.370 0.002 0.074 0.452 432 I N -0.191 120.273 120.570 -0.176 0.000 2.226 432 I HA -0.564 3.471 4.170 -0.224 0.000 0.245 432 I C 1.739 177.725 176.117 -0.218 0.000 1.100 432 I CA 4.341 65.498 61.300 -0.239 0.000 1.374 432 I CB -0.061 37.745 38.000 -0.322 0.000 1.057 432 I HN -0.254 7.780 8.210 -0.169 0.074 0.413 433 I N 0.176 120.555 120.570 -0.317 0.000 2.252 433 I HA -0.594 3.396 4.170 -0.300 0.000 0.245 433 I C 1.888 177.913 176.117 -0.153 0.000 1.102 433 I CA 4.524 65.645 61.300 -0.299 0.000 1.385 433 I CB -0.531 37.188 38.000 -0.469 0.000 1.064 433 I HN -0.235 7.739 8.210 -0.394 0.000 0.414 434 K N 0.070 120.406 120.400 -0.106 0.000 2.057 434 K HA -0.312 3.964 4.320 -0.073 0.000 0.207 434 K C 2.419 178.995 176.600 -0.039 0.000 1.049 434 K CA 3.497 59.748 56.287 -0.059 0.000 0.931 434 K CB -0.150 32.333 32.500 -0.028 0.000 0.714 434 K HN -0.137 8.041 8.250 -0.120 0.000 0.440 435 Y N 0.184 120.395 120.300 -0.147 0.000 2.145 435 Y HA -0.477 4.002 4.550 -0.119 0.000 0.286 435 Y C 1.772 177.571 175.900 -0.169 0.000 1.145 435 Y CA 3.564 61.577 58.100 -0.146 0.000 1.148 435 Y CB 0.100 38.465 38.460 -0.158 0.000 0.981 435 Y HN -0.223 8.113 8.280 0.093 0.000 0.507 436 A N -2.128 120.680 122.820 -0.020 0.000 1.902 436 A HA -0.402 3.855 4.320 -0.106 0.000 0.217 436 A C 1.962 179.452 177.584 -0.156 0.000 1.181 436 A CA 3.155 55.128 52.037 -0.106 0.000 0.623 436 A CB -1.027 17.909 19.000 -0.105 0.000 0.818 436 A HN 0.288 8.438 8.150 -0.000 0.000 0.443 437 Q N 0.489 120.205 119.800 -0.140 0.000 2.096 437 Q HA -0.293 3.961 4.340 -0.143 0.000 0.204 437 Q C 2.636 178.504 176.000 -0.220 0.000 0.982 437 Q CA 2.388 58.102 55.803 -0.149 0.000 0.850 437 Q CB -0.583 28.092 28.738 -0.105 0.000 0.901 437 Q HN 0.071 8.272 8.270 -0.115 0.000 0.422 438 A N -1.208 121.470 122.820 -0.236 0.000 2.019 438 A HA -0.187 3.995 4.320 -0.231 0.000 0.219 438 A C 1.451 178.777 177.584 -0.430 0.000 1.164 438 A CA 2.686 54.557 52.037 -0.276 0.000 0.644 438 A CB -0.432 18.416 19.000 -0.254 0.000 0.805 438 A HN -0.313 7.712 8.150 -0.207 0.000 0.449 439 R N -5.212 115.023 120.500 -0.443 0.000 2.388 439 R HA -0.038 3.861 4.340 -0.734 0.000 0.247 439 R C -0.942 174.977 176.300 -0.636 0.000 0.931 439 R CA -0.409 55.366 56.100 -0.542 0.000 1.082 439 R CB -0.073 30.081 30.300 -0.244 0.000 1.135 439 R HN -0.729 7.177 8.270 -0.343 0.159 0.525 440 Q N -7.031 112.426 119.800 -0.573 0.000 2.503 440 Q HA -0.426 3.720 4.340 -0.323 0.000 0.267 440 Q C -1.318 174.589 176.000 -0.156 0.000 1.030 440 Q CA 1.158 56.717 55.803 -0.407 0.000 1.041 440 Q CB -2.948 25.431 28.738 -0.599 0.000 1.406 440 Q HN -0.428 7.361 8.270 -0.512 0.174 0.524 441 I N -1.316 119.176 120.570 -0.130 0.000 2.354 441 I HA -0.010 4.332 4.170 -0.010 -0.178 0.292 441 I C -0.615 175.484 176.117 -0.029 0.000 0.989 441 I CA -0.770 60.502 61.300 -0.048 0.000 1.188 441 I CB 1.327 39.295 38.000 -0.053 0.000 1.342 441 I HN 0.035 8.098 8.210 -0.187 0.036 0.457 442 E N 8.188 128.389 120.200 0.002 0.000 2.194 442 E HA 0.057 4.618 4.350 0.050 -0.181 0.284 442 E C -0.702 175.942 176.600 0.075 0.000 1.035 442 E CA -1.118 55.300 56.400 0.030 0.000 0.836 442 E CB 1.842 31.555 29.700 0.022 0.000 1.070 442 E HN 0.334 8.692 8.360 -0.003 0.000 0.401 443 V N 8.008 127.996 119.914 0.123 0.000 2.406 443 V HA 0.148 4.563 4.120 0.185 -0.184 0.272 443 V C -1.024 175.193 176.094 0.206 0.000 1.043 443 V CA 0.264 62.677 62.300 0.188 0.000 0.915 443 V CB 0.477 32.404 31.823 0.173 0.000 0.988 443 V HN 0.252 8.854 8.190 0.118 -0.341 0.466 444 I N 7.372 128.005 120.570 0.104 0.000 2.371 444 I HA 0.542 4.716 4.170 0.008 0.000 0.282 444 I C -2.432 173.668 176.117 -0.030 0.000 1.031 444 I CA -3.567 57.744 61.300 0.019 0.000 1.180 444 I CB 1.988 39.964 38.000 -0.039 0.000 1.336 444 I HN 0.833 9.082 8.210 0.066 0.000 0.467 445 P HA 0.369 4.732 4.420 -0.096 0.000 0.280 445 P C -1.525 175.455 177.300 -0.534 0.000 1.244 445 P CA -1.048 61.924 63.100 -0.213 0.000 0.784 445 P CB 0.594 32.188 31.700 -0.176 0.000 0.913 446 E N 3.609 123.552 120.200 -0.427 0.000 2.165 446 E HA 0.674 4.937 4.350 -0.508 -0.219 0.266 446 E C -1.495 174.832 176.600 -0.456 0.000 0.889 446 E CA -1.884 54.266 56.400 -0.417 0.000 0.756 446 E CB 3.293 32.879 29.700 -0.189 0.000 1.131 446 E HN 0.312 8.482 8.360 -0.317 0.000 0.411 447 I N 7.735 128.085 120.570 -0.366 0.000 2.460 447 I HA 0.405 4.376 4.170 -0.332 0.000 0.277 447 I C -1.363 174.768 176.117 0.025 0.000 1.057 447 I CA -2.839 58.359 61.300 -0.169 0.000 1.179 447 I CB -0.963 37.093 38.000 0.093 0.000 1.329 447 I HN -0.232 7.718 8.210 -0.434 0.000 0.478 448 D N 7.558 127.933 120.400 -0.041 0.000 2.450 448 D HA -0.184 4.517 4.640 0.102 0.000 0.247 448 D C -1.137 175.243 176.300 0.134 0.000 1.162 448 D CA 1.063 55.111 54.000 0.081 0.000 0.879 448 D CB 0.781 41.661 40.800 0.134 0.000 1.163 448 D HN -0.322 7.919 8.370 -0.215 0.000 0.472 449 M N -1.015 118.619 119.600 0.055 0.000 2.643 449 M HA 0.661 5.393 4.480 0.180 -0.145 0.276 449 M C -2.783 173.498 176.300 -0.031 0.000 1.200 449 M CA -1.898 53.473 55.300 0.118 0.000 0.863 449 M CB 1.462 34.258 32.600 0.327 0.000 1.711 449 M HN -0.524 7.713 8.290 -0.088 0.000 0.492 450 P HA 0.161 4.738 4.420 0.261 0.000 0.251 450 P C -1.590 175.908 177.300 0.329 0.000 1.223 450 P CA 0.569 63.852 63.100 0.305 0.000 0.796 450 P CB 0.177 32.044 31.700 0.278 0.000 1.068 451 A N -2.622 120.347 122.820 0.249 0.000 2.298 451 A HA 0.201 4.578 4.320 -0.127 -0.133 0.302 451 A C -0.873 176.709 177.584 -0.003 0.000 1.177 451 A CA -1.827 50.198 52.037 -0.020 0.000 0.912 451 A CB 1.846 20.777 19.000 -0.115 0.000 1.331 451 A HN -0.638 7.638 8.150 0.274 0.039 0.504 452 H N -6.191 112.780 119.070 -0.164 0.000 2.713 452 H HA -0.396 4.425 4.556 -0.114 -0.333 0.311 452 H C -1.212 174.095 175.328 -0.034 0.000 1.175 452 H CA 1.398 57.398 56.048 -0.080 0.000 1.143 452 H CB -2.687 27.086 29.762 0.017 0.000 1.434 452 H HN 0.531 8.388 8.280 -0.705 0.000 0.418 453 A N -3.831 118.969 122.820 -0.033 0.000 2.610 453 A HA 0.314 4.699 4.320 0.108 0.000 0.291 453 A C -0.500 177.058 177.584 -0.043 0.000 1.116 453 A CA -1.088 50.970 52.037 0.036 0.000 0.963 453 A CB 0.917 19.966 19.000 0.082 0.000 1.220 453 A HN -0.014 8.067 8.150 -0.169 -0.033 0.530 454 R N 1.558 121.960 120.500 -0.164 0.000 2.096 454 R HA -0.212 4.223 4.340 -0.183 -0.204 0.235 454 R C 1.465 177.690 176.300 -0.124 0.000 1.127 454 R CA 4.037 60.005 56.100 -0.221 0.000 0.968 454 R CB 0.111 30.118 30.300 -0.488 0.000 0.861 454 R HN -0.158 8.237 8.270 -0.221 -0.258 0.440 455 A N -1.539 121.256 122.820 -0.041 0.000 1.877 455 A HA -0.295 4.016 4.320 -0.016 0.000 0.216 455 A C 1.595 179.185 177.584 0.009 0.000 1.186 455 A CA 3.341 55.398 52.037 0.033 0.000 0.620 455 A CB -0.957 18.137 19.000 0.157 0.000 0.822 455 A HN -0.696 7.438 8.150 -0.027 0.000 0.443 456 A N -1.825 121.032 122.820 0.061 0.000 1.877 456 A HA -0.258 3.917 4.320 -0.241 0.000 0.216 456 A C 2.146 179.602 177.584 -0.214 0.000 1.186 456 A CA 2.990 54.959 52.037 -0.113 0.000 0.620 456 A CB -0.964 18.032 19.000 -0.006 0.000 0.822 456 A HN -0.084 8.167 8.150 0.168 0.000 0.443 457 V N -1.121 118.701 119.914 -0.154 0.000 2.295 457 V HA -0.455 3.554 4.120 -0.186 0.000 0.246 457 V C 2.318 178.341 176.094 -0.118 0.000 1.049 457 V CA 4.164 66.376 62.300 -0.147 0.000 1.024 457 V CB -0.548 31.220 31.823 -0.091 0.000 0.648 457 V HN 0.005 8.136 8.190 -0.098 0.000 0.447 458 V N -0.426 119.428 119.914 -0.099 0.000 2.427 458 V HA -0.410 3.670 4.120 -0.065 0.000 0.248 458 V C 2.263 178.310 176.094 -0.078 0.000 1.051 458 V CA 4.215 66.469 62.300 -0.078 0.000 1.048 458 V CB -0.565 31.215 31.823 -0.071 0.000 0.666 458 V HN 0.414 8.543 8.190 -0.101 0.000 0.456 459 S N 0.995 116.631 115.700 -0.107 0.000 2.368 459 S HA -0.370 4.038 4.470 -0.103 0.000 0.225 459 S C 1.953 176.490 174.600 -0.104 0.000 1.030 459 S CA 3.705 61.830 58.200 -0.125 0.000 0.999 459 S CB -0.111 62.968 63.200 -0.202 0.000 0.844 459 S HN -0.304 7.935 8.310 -0.117 0.000 0.459 460 M N 0.034 119.563 119.600 -0.119 0.000 2.394 460 M HA -0.162 4.313 4.480 -0.008 0.000 0.264 460 M C 2.132 178.438 176.300 0.009 0.000 1.073 460 M CA 1.468 56.731 55.300 -0.061 0.000 1.111 460 M CB -1.162 31.364 32.600 -0.123 0.000 1.401 460 M HN 0.036 8.228 8.290 -0.164 0.000 0.448 461 E N 0.049 120.243 120.200 -0.010 0.000 2.107 461 E HA -0.249 4.150 4.350 0.082 0.000 0.191 461 E C 2.362 179.007 176.600 0.075 0.000 0.982 461 E CA 2.616 59.041 56.400 0.041 0.000 0.809 461 E CB -0.547 29.149 29.700 -0.006 0.000 0.756 461 E HN -0.183 8.024 8.360 -0.052 0.121 0.459 462 A N 0.198 123.028 122.820 0.018 0.000 1.930 462 A HA -0.304 4.026 4.320 0.016 0.000 0.217 462 A C 1.641 179.232 177.584 0.011 0.000 1.175 462 A CA 3.308 55.349 52.037 0.006 0.000 0.627 462 A CB -0.590 18.393 19.000 -0.027 0.000 0.815 462 A HN 0.150 8.214 8.150 -0.014 0.079 0.443 463 R N -0.753 119.758 120.500 0.017 0.000 2.073 463 R HA -0.340 4.001 4.340 0.001 0.000 0.234 463 R C 1.625 177.951 176.300 0.044 0.000 1.134 463 R CA 3.200 59.315 56.100 0.026 0.000 0.952 463 R CB -0.121 30.205 30.300 0.043 0.000 0.850 463 R HN -0.174 8.100 8.270 0.006 0.000 0.433 464 Y N 0.427 120.732 120.300 0.009 0.000 2.128 464 Y HA -0.420 4.249 4.550 0.033 -0.100 0.284 464 Y C 1.728 177.653 175.900 0.042 0.000 1.154 464 Y CA 3.506 61.615 58.100 0.016 0.000 1.149 464 Y CB -0.133 38.313 38.460 -0.023 0.000 0.976 464 Y HN -0.127 8.162 8.280 0.191 0.106 0.505 465 K N -2.150 118.207 120.400 -0.073 0.000 2.026 465 K HA -0.490 3.739 4.320 -0.152 0.000 0.208 465 K C 2.304 178.853 176.600 -0.085 0.000 1.048 465 K CA 3.778 60.015 56.287 -0.083 0.000 0.929 465 K CB -0.359 32.168 32.500 0.045 0.000 0.713 465 K HN -0.008 8.315 8.250 0.122 0.000 0.439 466 K N -0.146 120.215 120.400 -0.064 0.000 2.026 466 K HA -0.277 4.016 4.320 -0.045 0.000 0.208 466 K C 2.603 179.155 176.600 -0.080 0.000 1.048 466 K CA 3.136 59.390 56.287 -0.055 0.000 0.929 466 K CB -0.034 32.442 32.500 -0.039 0.000 0.713 466 K HN -0.434 7.790 8.250 -0.042 0.000 0.439 467 L N -3.018 118.145 121.223 -0.100 0.000 2.109 467 L HA -0.342 3.949 4.340 -0.082 0.000 0.207 467 L C 1.937 178.724 176.870 -0.138 0.000 1.086 467 L CA 2.717 57.499 54.840 -0.097 0.000 0.760 467 L CB -0.134 41.887 42.059 -0.064 0.000 0.910 467 L HN -0.097 8.070 8.230 -0.105 0.000 0.437 468 H N 1.045 119.906 119.070 -0.349 0.000 2.387 468 H HA -0.232 4.150 4.556 -0.289 0.000 0.299 468 H C 2.483 177.695 175.328 -0.193 0.000 1.090 468 H CA 3.344 59.176 56.048 -0.359 0.000 1.332 468 H CB 0.044 29.390 29.762 -0.694 0.000 1.386 468 H HN 0.280 8.401 8.280 -0.265 0.000 0.516 469 A N 0.397 123.078 122.820 -0.232 0.000 1.972 469 A HA -0.208 3.956 4.320 -0.260 0.000 0.219 469 A C 0.745 178.217 177.584 -0.187 0.000 1.169 469 A CA 2.589 54.502 52.037 -0.206 0.000 0.635 469 A CB -0.925 18.023 19.000 -0.085 0.000 0.810 469 A HN 0.014 8.012 8.150 -0.112 0.084 0.446 470 A N -3.622 119.107 122.820 -0.151 0.000 2.251 470 A HA 0.014 4.276 4.320 -0.097 0.000 0.209 470 A C -0.026 177.485 177.584 -0.122 0.000 1.187 470 A CA -0.308 51.662 52.037 -0.112 0.000 0.823 470 A CB -0.403 18.551 19.000 -0.076 0.000 0.846 470 A HN -0.343 7.595 8.150 -0.144 0.126 0.486 471 G N -1.700 106.993 108.800 -0.179 0.000 2.143 471 G HA2 -0.391 3.440 3.960 -0.215 0.000 0.248 471 G HA3 -0.391 3.494 3.960 -0.124 0.000 0.248 471 G C -0.192 174.651 174.900 -0.094 0.000 0.991 471 G CA 0.161 45.168 45.100 -0.156 0.000 0.689 471 G HN -0.386 7.543 8.290 -0.254 0.209 0.522 472 K N 0.564 120.913 120.400 -0.085 0.000 2.535 472 K HA 0.123 4.424 4.320 -0.032 0.000 0.242 472 K C -1.057 175.529 176.600 -0.023 0.000 1.210 472 K CA -1.304 54.956 56.287 -0.045 0.000 1.178 472 K CB -1.276 31.200 32.500 -0.039 0.000 1.778 472 K HN -0.182 7.963 8.250 -0.111 0.038 0.372 473 E N 1.466 121.667 120.200 0.003 0.000 2.110 473 E HA -0.404 3.995 4.350 0.081 0.000 0.193 473 E C 1.380 178.019 176.600 0.064 0.000 0.988 473 E CA 3.506 59.943 56.400 0.061 0.000 0.804 473 E CB -0.133 29.623 29.700 0.093 0.000 0.745 473 E HN -0.362 7.960 8.360 -0.006 0.035 0.458 474 Q N -2.076 117.741 119.800 0.029 0.000 2.083 474 Q HA -0.268 4.086 4.340 0.023 0.000 0.198 474 Q C 2.239 178.238 176.000 -0.002 0.000 0.969 474 Q CA 3.313 59.124 55.803 0.013 0.000 0.838 474 Q CB -1.131 27.605 28.738 -0.003 0.000 0.900 474 Q HN 0.563 8.843 8.270 0.016 0.000 0.436 475 E N -0.238 119.963 120.200 0.001 0.000 2.077 475 E HA -0.379 3.961 4.350 -0.017 0.000 0.193 475 E C 1.684 178.307 176.600 0.038 0.000 0.989 475 E CA 2.485 58.889 56.400 0.008 0.000 0.800 475 E CB -0.625 29.084 29.700 0.015 0.000 0.746 475 E HN -0.167 8.194 8.360 0.001 0.000 0.452 476 A N -2.231 120.614 122.820 0.041 0.000 1.940 476 A HA -0.202 4.146 4.320 0.047 0.000 0.219 476 A C 1.350 179.084 177.584 0.249 0.000 1.176 476 A CA 2.650 54.732 52.037 0.074 0.000 0.631 476 A CB -0.307 18.624 19.000 -0.114 0.000 0.814 476 A HN -0.081 8.009 8.150 0.020 0.072 0.446 477 N N -4.553 114.260 118.700 0.188 0.000 2.373 477 N HA 0.018 4.872 4.740 0.191 0.000 0.181 477 N C 1.439 176.951 175.510 0.002 0.000 1.082 477 N CA 0.781 53.910 53.050 0.132 0.000 0.885 477 N CB 0.180 38.721 38.487 0.091 0.000 0.977 477 N HN -0.444 7.990 8.380 0.124 0.020 0.462 478 E N 2.198 122.347 120.200 -0.084 0.000 2.070 478 E HA -0.278 3.876 4.350 -0.327 0.000 0.197 478 E C 0.818 177.136 176.600 -0.470 0.000 1.004 478 E CA 3.375 59.564 56.400 -0.352 0.000 0.805 478 E CB 0.041 29.408 29.700 -0.555 0.000 0.744 478 E HN -0.671 7.497 8.360 -0.030 0.174 0.451 479 F N -7.308 112.699 119.950 0.096 0.000 2.735 479 F HA 0.348 4.966 4.527 0.152 0.000 0.304 479 F C -0.358 175.468 175.800 0.042 0.000 1.119 479 F CA -1.341 56.737 58.000 0.131 0.000 1.280 479 F CB 0.179 39.301 39.000 0.205 0.000 0.994 479 F HN -0.306 8.037 8.300 0.072 0.000 0.520 480 R N 1.889 122.460 120.500 0.118 0.000 2.537 480 R HA -0.092 4.263 4.340 0.024 0.000 0.280 480 R C -0.220 176.054 176.300 -0.043 0.000 1.058 480 R CA 0.580 56.693 56.100 0.021 0.000 1.057 480 R CB 0.645 30.931 30.300 -0.023 0.000 0.973 480 R HN -0.754 7.390 8.270 0.077 0.172 0.438 481 L N 3.484 124.642 121.223 -0.108 0.000 2.857 481 L HA 0.284 4.556 4.340 -0.113 0.000 0.249 481 L C -1.004 175.817 176.870 -0.082 0.000 1.172 481 L CA -0.640 54.121 54.840 -0.132 0.000 0.980 481 L CB 0.442 42.358 42.059 -0.239 0.000 1.299 481 L HN 0.477 8.640 8.230 -0.112 0.000 0.535 482 V N -1.700 118.163 119.914 -0.084 0.000 2.604 482 V HA 0.088 4.194 4.120 -0.023 0.000 0.305 482 V C -1.450 174.594 176.094 -0.084 0.000 1.043 482 V CA -1.671 60.589 62.300 -0.067 0.000 0.888 482 V CB 3.380 35.145 31.823 -0.095 0.000 0.995 482 V HN -0.656 7.400 8.190 -0.104 0.073 0.429 483 D N 7.038 127.410 120.400 -0.046 0.000 2.339 483 D HA 0.254 4.851 4.640 -0.072 0.000 0.241 483 D C 0.296 176.557 176.300 -0.064 0.000 1.183 483 D CA -4.263 49.707 54.000 -0.051 0.000 0.859 483 D CB 1.383 42.173 40.800 -0.015 0.000 1.067 483 D HN 0.101 8.468 8.370 -0.005 0.000 0.484 484 P HA -0.072 4.277 4.420 -0.117 0.000 0.223 484 P C 0.414 177.673 177.300 -0.069 0.000 1.144 484 P CA 1.616 64.650 63.100 -0.110 0.000 0.783 484 P CB 0.149 31.760 31.700 -0.150 0.000 0.771 485 T N -5.838 108.686 114.554 -0.050 0.000 3.067 485 T HA -0.189 4.139 4.350 -0.036 0.000 0.261 485 T C 0.088 174.773 174.700 -0.025 0.000 1.110 485 T CA 0.552 62.632 62.100 -0.034 0.000 1.113 485 T CB 0.360 69.213 68.868 -0.026 0.000 0.917 485 T HN -0.354 8.119 8.240 -0.050 -0.263 0.499 486 D N 2.764 123.152 120.400 -0.020 0.000 2.343 486 D HA -0.059 4.804 4.640 -0.004 -0.226 0.255 486 D C -0.250 176.035 176.300 -0.025 0.000 1.187 486 D CA 0.130 54.126 54.000 -0.008 0.000 0.875 486 D CB 0.634 41.448 40.800 0.022 0.000 1.136 486 D HN -0.329 7.837 8.370 -0.027 0.188 0.469 487 T N 1.075 115.611 114.554 -0.031 0.000 3.228 487 T HA 0.151 4.477 4.350 -0.040 0.000 0.278 487 T C 0.687 175.354 174.700 -0.056 0.000 1.014 487 T CA -1.372 60.704 62.100 -0.040 0.000 0.904 487 T CB 0.118 68.965 68.868 -0.035 0.000 1.110 487 T HN -0.301 7.923 8.240 -0.026 0.000 0.541 488 S N 4.319 119.975 115.700 -0.074 0.000 2.552 488 S HA -0.253 4.316 4.470 -0.100 -0.160 0.289 488 S C -1.639 172.887 174.600 -0.123 0.000 1.304 488 S CA 1.846 59.977 58.200 -0.115 0.000 1.063 488 S CB 0.467 63.556 63.200 -0.184 0.000 0.848 488 S HN -0.147 8.382 8.310 -0.062 -0.257 0.499 489 N N 5.567 124.194 118.700 -0.120 0.000 2.609 489 N HA 0.225 4.910 4.740 -0.092 0.000 0.234 489 N C -1.662 173.765 175.510 -0.138 0.000 1.001 489 N CA -1.072 51.915 53.050 -0.105 0.000 0.926 489 N CB 1.476 39.915 38.487 -0.081 0.000 1.130 489 N HN 0.534 9.244 8.380 -0.116 -0.400 0.510 490 T N 7.129 121.593 114.554 -0.151 0.000 2.912 490 T HA 0.382 4.634 4.350 -0.163 0.000 0.299 490 T C -2.157 172.519 174.700 -0.040 0.000 1.052 490 T CA -1.192 60.797 62.100 -0.185 0.000 0.996 490 T CB 2.254 70.851 68.868 -0.451 0.000 1.070 490 T HN -0.320 8.071 8.240 -0.120 -0.223 0.465 491 T N 9.875 124.430 114.554 0.002 0.000 2.786 491 T HA 0.624 5.235 4.350 0.125 -0.186 0.283 491 T C -0.517 174.236 174.700 0.088 0.000 0.992 491 T CA -0.682 61.465 62.100 0.079 0.000 0.954 491 T CB 2.250 71.157 68.868 0.065 0.000 0.934 491 T HN -0.026 8.480 8.240 -0.048 -0.294 0.440 492 S N 7.072 122.826 115.700 0.090 0.000 2.624 492 S HA 0.360 4.836 4.470 0.011 0.000 0.263 492 S C 1.467 175.923 174.600 -0.240 0.000 1.287 492 S CA -1.450 56.718 58.200 -0.054 0.000 0.990 492 S CB 1.657 64.749 63.200 -0.180 0.000 0.950 492 S HN 0.174 8.564 8.310 0.133 0.000 0.561 493 V N 1.424 121.170 119.914 -0.280 0.000 2.380 493 V HA -0.309 3.569 4.120 -0.404 0.000 0.251 493 V C 1.166 176.874 176.094 -0.645 0.000 1.063 493 V CA 3.687 65.750 62.300 -0.395 0.000 1.055 493 V CB -0.045 31.625 31.823 -0.254 0.000 0.657 493 V HN 0.795 8.844 8.190 -0.235 0.000 0.455 494 Q N -2.529 117.013 119.800 -0.430 0.000 2.246 494 Q HA 0.012 4.058 4.340 -0.491 0.000 0.202 494 Q C -0.924 174.822 176.000 -0.423 0.000 0.883 494 Q CA -0.526 55.060 55.803 -0.361 0.000 0.952 494 Q CB -0.091 28.655 28.738 0.013 0.000 1.078 494 Q HN -0.390 7.707 8.270 -0.259 0.018 0.493 495 F N -5.759 114.105 119.950 -0.144 0.000 3.058 495 F HA -0.474 4.075 4.527 -0.063 -0.060 0.295 495 F C -0.885 174.812 175.800 -0.171 0.000 0.875 495 F CA 1.039 58.956 58.000 -0.139 0.000 1.150 495 F CB -3.222 35.657 39.000 -0.201 0.000 1.175 495 F HN -0.099 7.584 8.300 -0.696 0.199 0.599 496 F N -2.322 117.677 119.950 0.083 0.000 2.368 496 F HA 0.626 5.177 4.527 0.041 0.000 0.315 496 F C 0.608 176.439 175.800 0.051 0.000 1.145 496 F CA -0.445 57.570 58.000 0.026 0.000 1.095 496 F CB 1.642 40.602 39.000 -0.066 0.000 1.286 496 F HN -0.488 7.782 8.300 0.011 0.037 0.530 497 N N 0.385 119.238 118.700 0.254 0.000 3.117 497 N HA 0.447 5.481 4.740 0.190 -0.180 0.332 497 N C 1.698 177.346 175.510 0.230 0.000 1.385 497 N CA -1.710 51.447 53.050 0.179 0.000 0.683 497 N CB 2.530 41.069 38.487 0.085 0.000 1.272 497 N HN 0.106 8.650 8.380 0.274 0.000 0.522 498 R N 0.626 121.197 120.500 0.119 0.000 2.285 498 R HA -0.275 4.154 4.340 0.149 0.000 0.213 498 R C 1.943 178.345 176.300 0.171 0.000 1.068 498 R CA 2.943 59.119 56.100 0.126 0.000 1.004 498 R CB -0.744 29.527 30.300 -0.048 0.000 0.873 498 R HN 0.559 8.861 8.270 0.053 0.000 0.467 499 Q N -1.411 118.444 119.800 0.093 0.000 2.488 499 Q HA -0.111 4.252 4.340 0.038 0.000 0.211 499 Q C 0.763 176.747 176.000 -0.026 0.000 0.967 499 Q CA 2.258 58.080 55.803 0.030 0.000 0.926 499 Q CB -0.711 28.020 28.738 -0.011 0.000 0.992 499 Q HN 0.186 8.475 8.270 0.080 0.030 0.506 500 S N -0.392 115.275 115.700 -0.055 0.000 2.489 500 S HA -0.097 nan 4.470 nan 0.000 0.228 500 S C -0.051 174.364 174.600 -0.308 0.000 0.995 500 S CA 1.920 59.943 58.200 -0.295 0.000 0.934 500 S CB 0.194 63.131 63.200 -0.438 0.000 0.771 500 S HN -0.355 7.938 8.310 0.062 0.054 0.522 501 Y N 2.205 122.491 120.300 -0.024 0.000 2.417 501 Y HA 0.565 5.326 4.550 0.121 -0.139 0.336 501 Y C 0.569 176.614 175.900 0.241 0.000 0.961 501 Y CA -1.679 56.484 58.100 0.106 0.000 1.215 501 Y CB 0.130 38.553 38.460 -0.062 0.000 1.120 501 Y HN -0.519 7.760 8.280 0.268 0.161 0.499 502 L N 2.382 123.781 121.223 0.294 0.000 2.456 502 L HA -0.003 4.388 4.340 0.085 0.000 0.272 502 L C -0.842 176.101 176.870 0.121 0.000 1.189 502 L CA -0.277 54.645 54.840 0.136 0.000 0.846 502 L CB 0.237 42.308 42.059 0.020 0.000 1.111 502 L HN 0.074 8.442 8.230 0.229 0.000 0.475 503 N N 3.276 121.956 118.700 -0.033 0.000 2.411 503 N HA 0.266 4.655 4.740 -0.586 0.000 0.259 503 N C -0.848 174.338 175.510 -0.541 0.000 1.103 503 N CA -2.470 50.395 53.050 -0.309 0.000 0.954 503 N CB 1.398 39.821 38.487 -0.107 0.000 1.085 503 N HN -0.236 8.130 8.380 -0.023 0.000 0.485 504 P HA 0.139 3.884 4.420 -1.124 0.000 0.245 504 P C -0.591 176.474 177.300 -0.393 0.000 1.212 504 P CA 0.898 63.398 63.100 -1.000 0.000 0.774 504 P CB 0.288 31.286 31.700 -1.169 0.000 0.999 505 c N -3.551 114.856 118.600 -0.321 0.000 2.780 505 c HA 0.020 4.558 4.570 -0.052 0.000 0.267 505 c C -0.347 173.712 174.090 -0.053 0.000 1.266 505 c CA -0.524 55.729 56.329 -0.126 0.000 1.709 505 c CB 1.028 43.457 42.510 -0.135 0.000 1.975 505 c HN -0.156 8.059 8.230 -0.437 -0.247 0.582 506 L N 0.736 121.920 121.223 -0.064 0.000 2.371 506 L HA -0.026 4.303 4.340 -0.018 0.000 0.272 506 L C 0.792 177.684 176.870 0.037 0.000 1.124 506 L CA 0.146 54.974 54.840 -0.019 0.000 0.816 506 L CB 0.601 42.639 42.059 -0.034 0.000 1.129 506 L HN -1.102 7.009 8.230 -0.128 0.042 0.448 507 D N 2.215 122.635 120.400 0.034 0.000 2.219 507 D HA -0.282 4.404 4.640 0.077 0.000 0.205 507 D C 1.727 178.066 176.300 0.065 0.000 0.970 507 D CA 3.694 57.726 54.000 0.053 0.000 0.851 507 D CB 0.090 40.907 40.800 0.028 0.000 0.943 507 D HN 0.599 8.977 8.370 0.014 0.000 0.488 508 S N -1.458 114.266 115.700 0.041 0.000 2.399 508 S HA -0.236 4.338 4.470 0.006 -0.100 0.231 508 S C 2.119 176.819 174.600 0.167 0.000 1.022 508 S CA 2.627 60.859 58.200 0.054 0.000 0.983 508 S CB 0.006 63.213 63.200 0.013 0.000 0.803 508 S HN 0.033 8.338 8.310 0.018 0.015 0.480 509 S N 3.693 119.481 115.700 0.147 0.000 2.368 509 S HA -0.317 4.302 4.470 0.249 0.000 0.224 509 S C 1.954 176.777 174.600 0.371 0.000 1.029 509 S CA 3.557 61.888 58.200 0.219 0.000 0.988 509 S CB -0.338 62.916 63.200 0.090 0.000 0.838 509 S HN -0.739 7.503 8.310 0.086 0.119 0.462 510 Q N 0.823 120.804 119.800 0.301 0.000 2.119 510 Q HA -0.386 4.159 4.340 0.342 0.000 0.201 510 Q C 2.203 178.349 176.000 0.243 0.000 0.972 510 Q CA 3.511 59.479 55.803 0.275 0.000 0.847 510 Q CB -0.164 28.689 28.738 0.191 0.000 0.903 510 Q HN -0.585 7.747 8.270 0.227 0.075 0.433 511 R N -0.787 119.857 120.500 0.240 0.000 2.081 511 R HA -0.323 4.138 4.340 0.202 0.000 0.235 511 R C 2.321 178.900 176.300 0.465 0.000 1.131 511 R CA 3.673 59.933 56.100 0.265 0.000 0.960 511 R CB -0.132 30.239 30.300 0.119 0.000 0.856 511 R HN -0.187 8.129 8.270 0.203 0.076 0.436 512 F N 0.823 121.013 119.950 0.399 0.000 2.102 512 F HA -0.301 4.431 4.527 0.341 0.000 0.298 512 F C 1.218 177.116 175.800 0.163 0.000 1.105 512 F CA 3.686 61.878 58.000 0.319 0.000 1.239 512 F CB -0.024 39.133 39.000 0.262 0.000 0.991 512 F HN -0.079 8.507 8.300 0.599 0.073 0.474 513 V N -0.364 119.724 119.914 0.289 0.000 2.295 513 V HA -0.612 3.576 4.120 0.113 0.000 0.246 513 V C 1.662 177.701 176.094 -0.091 0.000 1.049 513 V CA 5.396 67.775 62.300 0.132 0.000 1.024 513 V CB -0.408 31.564 31.823 0.248 0.000 0.648 513 V HN -0.197 8.283 8.190 0.483 0.000 0.447 514 D N -0.644 119.757 120.400 0.002 0.000 2.123 514 D HA -0.325 4.282 4.640 -0.056 0.000 0.196 514 D C 1.961 178.209 176.300 -0.087 0.000 0.992 514 D CA 3.379 57.374 54.000 -0.009 0.000 0.833 514 D CB 0.029 40.898 40.800 0.114 0.000 0.954 514 D HN -0.081 8.354 8.370 0.109 0.000 0.455 515 K N -0.303 120.055 120.400 -0.069 0.000 2.057 515 K HA -0.247 4.046 4.320 -0.045 0.000 0.207 515 K C 2.150 178.595 176.600 -0.260 0.000 1.049 515 K CA 2.565 58.769 56.287 -0.138 0.000 0.931 515 K CB -0.595 31.795 32.500 -0.184 0.000 0.714 515 K HN -0.471 7.784 8.250 0.007 0.000 0.440 516 V N 0.145 119.843 119.914 -0.360 0.000 2.358 516 V HA -0.388 3.605 4.120 -0.212 0.000 0.246 516 V C 2.107 178.068 176.094 -0.221 0.000 1.047 516 V CA 4.085 66.225 62.300 -0.266 0.000 1.035 516 V CB -0.412 31.259 31.823 -0.253 0.000 0.658 516 V HN -0.184 7.757 8.190 -0.415 0.000 0.452 517 I N -0.302 119.981 120.570 -0.478 0.000 2.163 517 I HA -0.546 3.051 4.170 -0.955 0.000 0.243 517 I C 1.825 177.559 176.117 -0.637 0.000 1.085 517 I CA 4.607 65.403 61.300 -0.839 0.000 1.347 517 I CB -0.645 36.648 38.000 -1.177 0.000 1.044 517 I HN 0.629 8.458 8.210 -0.457 0.107 0.408 518 G N -1.241 107.168 108.800 -0.651 0.000 2.476 518 G HA2 -0.411 3.313 3.960 -0.393 0.000 0.218 518 G HA3 -0.411 3.453 3.960 -0.160 0.000 0.218 518 G C 1.462 176.297 174.900 -0.109 0.000 1.164 518 G CA 2.342 47.241 45.100 -0.335 0.000 0.768 518 G HN 0.180 8.096 8.290 -0.623 0.000 0.560 519 E N 1.814 121.960 120.200 -0.090 0.000 2.072 519 E HA -0.256 4.094 4.350 0.000 0.000 0.191 519 E C 2.706 179.335 176.600 0.048 0.000 0.985 519 E CA 2.527 58.917 56.400 -0.016 0.000 0.801 519 E CB -0.302 29.374 29.700 -0.041 0.000 0.750 519 E HN -0.309 7.965 8.360 -0.144 0.000 0.452 520 I N -0.038 120.572 120.570 0.067 0.000 2.353 520 I HA -0.507 3.791 4.170 0.213 0.000 0.248 520 I C 1.757 178.047 176.117 0.288 0.000 1.119 520 I CA 3.925 65.349 61.300 0.205 0.000 1.417 520 I CB -0.302 37.863 38.000 0.275 0.000 1.078 520 I HN -0.018 8.198 8.210 0.010 0.000 0.421 521 A N -0.544 122.357 122.820 0.135 0.000 1.933 521 A HA -0.426 3.957 4.320 0.105 0.000 0.218 521 A C 1.710 179.395 177.584 0.168 0.000 1.175 521 A CA 3.343 55.447 52.037 0.112 0.000 0.628 521 A CB -0.936 18.075 19.000 0.017 0.000 0.814 521 A HN 0.429 8.593 8.150 0.023 0.000 0.444 522 Q N -1.006 118.876 119.800 0.137 0.000 2.084 522 Q HA -0.286 4.125 4.340 0.119 0.000 0.202 522 Q C 2.210 178.308 176.000 0.164 0.000 0.978 522 Q CA 2.490 58.371 55.803 0.130 0.000 0.844 522 Q CB -0.612 28.181 28.738 0.093 0.000 0.898 522 Q HN -0.396 7.933 8.270 0.098 0.000 0.426 523 M N -0.695 119.034 119.600 0.215 0.000 2.117 523 M HA -0.465 4.120 4.480 0.176 0.000 0.262 523 M C 2.416 178.845 176.300 0.215 0.000 1.065 523 M CA 4.428 59.867 55.300 0.232 0.000 1.114 523 M CB -0.203 32.603 32.600 0.345 0.000 1.361 523 M HN -0.619 7.803 8.290 0.220 0.000 0.408 524 H N -0.909 118.269 119.070 0.180 0.000 2.353 524 H HA -0.348 4.271 4.556 0.105 0.000 0.300 524 H C 2.322 177.700 175.328 0.083 0.000 1.090 524 H CA 4.262 60.388 56.048 0.128 0.000 1.327 524 H CB -0.026 29.825 29.762 0.148 0.000 1.383 524 H HN -0.350 8.251 8.280 0.536 0.000 0.508 525 K N -0.783 119.745 120.400 0.214 0.000 2.057 525 K HA -0.334 4.059 4.320 0.121 0.000 0.207 525 K C 3.273 179.928 176.600 0.090 0.000 1.049 525 K CA 3.375 59.739 56.287 0.128 0.000 0.931 525 K CB -0.153 32.412 32.500 0.108 0.000 0.714 525 K HN -0.105 8.289 8.250 0.241 0.000 0.440 526 E N -0.616 119.638 120.200 0.090 0.000 2.110 526 E HA -0.257 4.127 4.350 0.057 0.000 0.193 526 E C 1.350 177.974 176.600 0.041 0.000 0.988 526 E CA 2.368 58.806 56.400 0.063 0.000 0.804 526 E CB -0.163 29.579 29.700 0.069 0.000 0.745 526 E HN -0.228 8.201 8.360 0.114 0.000 0.458 527 A N -4.686 118.151 122.820 0.029 0.000 2.119 527 A HA 0.015 4.326 4.320 -0.014 0.000 0.216 527 A C -0.150 177.429 177.584 -0.008 0.000 1.152 527 A CA 0.473 52.501 52.037 -0.014 0.000 0.708 527 A CB 0.450 19.397 19.000 -0.088 0.000 0.805 527 A HN -0.313 7.759 8.150 0.050 0.107 0.460 528 G N -3.635 105.177 108.800 0.021 0.000 2.141 528 G HA2 -0.345 3.632 3.960 0.028 0.000 0.231 528 G HA3 -0.345 3.617 3.960 0.003 0.000 0.231 528 G C -0.719 174.197 174.900 0.026 0.000 0.984 528 G CA 0.167 45.278 45.100 0.019 0.000 0.660 528 G HN -0.578 7.569 8.290 0.043 0.169 0.525 529 Q N 0.725 120.559 119.800 0.055 0.000 3.064 529 Q HA 0.414 4.793 4.340 0.066 0.000 0.258 529 Q C -2.892 173.226 176.000 0.198 0.000 0.972 529 Q CA -3.376 52.482 55.803 0.091 0.000 0.761 529 Q CB 1.628 30.401 28.738 0.059 0.000 1.281 529 Q HN -0.373 7.888 8.270 0.060 0.046 0.455 530 P HA -0.107 4.420 4.420 0.179 0.000 0.264 530 P C -0.432 176.934 177.300 0.111 0.000 1.183 530 P CA -0.107 63.080 63.100 0.144 0.000 0.763 530 P CB 0.525 32.278 31.700 0.088 0.000 0.807 531 I N 1.551 122.124 120.570 0.006 0.000 2.752 531 I HA -0.377 3.724 4.170 -0.115 0.000 0.289 531 I C 0.673 176.801 176.117 0.020 0.000 1.197 531 I CA 1.910 63.154 61.300 -0.094 0.000 1.432 531 I CB -0.424 37.469 38.000 -0.179 0.000 1.359 531 I HN 0.440 8.653 8.210 0.004 0.000 0.571 532 K N 5.535 125.959 120.400 0.040 0.000 2.350 532 K HA 0.214 4.565 4.320 0.052 0.000 0.196 532 K C -0.580 176.056 176.600 0.061 0.000 1.084 532 K CA 1.097 57.417 56.287 0.055 0.000 0.967 532 K CB 1.423 33.961 32.500 0.063 0.000 0.950 532 K HN 0.552 8.825 8.250 0.038 0.000 0.512 533 T N -0.106 114.487 114.554 0.064 0.000 2.879 533 T HA 0.352 4.957 4.350 0.070 -0.213 0.290 533 T C -2.134 172.624 174.700 0.096 0.000 0.993 533 T CA 0.018 62.157 62.100 0.066 0.000 0.975 533 T CB 2.114 71.010 68.868 0.046 0.000 0.981 533 T HN -0.736 7.535 8.240 0.052 0.000 0.439 534 W N 8.162 129.436 121.300 -0.043 0.000 2.391 534 W HA 0.099 4.749 4.660 -0.016 0.000 0.311 534 W C -2.211 174.305 176.519 -0.005 0.000 1.087 534 W CA -0.879 56.454 57.345 -0.020 0.000 1.209 534 W CB 2.554 32.003 29.460 -0.017 0.000 1.273 534 W HN 0.426 8.738 8.180 0.220 0.000 0.482 535 H N 10.034 128.728 119.070 -0.628 0.000 2.556 535 H HA 0.356 5.002 4.556 -0.196 -0.208 0.310 535 H C -0.855 174.305 175.328 -0.280 0.000 1.057 535 H CA -1.014 54.796 56.048 -0.396 0.000 1.264 535 H CB 1.687 31.157 29.762 -0.488 0.000 1.404 535 H HN 0.259 8.024 8.280 -0.858 0.000 0.462 536 F N 8.881 128.857 119.950 0.042 0.000 2.558 536 F HA -0.206 4.557 4.527 0.393 0.000 0.298 536 F C -0.335 175.680 175.800 0.359 0.000 1.119 536 F CA 1.174 59.335 58.000 0.268 0.000 1.451 536 F CB 1.564 40.686 39.000 0.202 0.000 1.091 536 F HN 0.228 8.618 8.300 0.151 0.000 0.563 537 G N -2.546 106.479 108.800 0.374 0.000 2.652 537 G HA2 -0.520 4.001 3.960 0.691 0.000 0.278 537 G HA3 -0.520 3.785 3.960 0.263 -0.188 0.278 537 G C -0.128 174.992 174.900 0.366 0.000 1.263 537 G CA 0.338 45.688 45.100 0.417 0.000 0.966 537 G HN -0.473 8.231 8.290 0.773 0.050 0.544 538 G N 0.742 109.590 108.800 0.081 0.000 2.175 538 G HA2 -0.477 3.640 3.960 0.070 0.000 0.244 538 G HA3 -0.477 3.733 3.960 0.416 0.000 0.244 538 G C -1.415 173.718 174.900 0.389 0.000 0.982 538 G CA -0.301 44.934 45.100 0.225 0.000 0.641 538 G HN -0.189 8.255 8.290 -0.032 -0.173 0.527 539 D N 0.093 120.711 120.400 0.363 0.000 2.341 539 D HA -0.178 4.996 4.640 0.376 -0.308 0.245 539 D C 0.448 176.905 176.300 0.261 0.000 1.106 539 D CA -0.566 53.579 54.000 0.242 0.000 0.905 539 D CB 0.325 40.943 40.800 -0.303 0.000 1.202 539 D HN -0.783 7.776 8.370 0.391 0.046 0.426 540 E N -4.375 115.988 120.200 0.272 0.000 2.360 540 E HA -0.529 3.927 4.350 0.177 0.000 0.238 540 E C -1.063 175.639 176.600 0.171 0.000 1.186 540 E CA 0.997 57.517 56.400 0.200 0.000 0.719 540 E CB -2.441 27.359 29.700 0.167 0.000 1.236 540 E HN 0.372 9.331 8.360 0.354 -0.386 0.386 541 A N -0.815 122.152 122.820 0.246 0.000 3.015 541 A HA -0.014 4.497 4.320 0.318 0.000 0.293 541 A C -1.765 175.955 177.584 0.227 0.000 1.572 541 A CA -0.409 51.811 52.037 0.305 0.000 1.274 541 A CB -1.084 18.175 19.000 0.432 0.000 1.156 541 A HN 0.058 8.373 8.150 0.276 0.000 0.562 542 K N -0.654 119.859 120.400 0.188 0.000 2.578 542 K HA 0.218 4.540 4.320 0.004 0.000 0.287 542 K C -2.699 173.926 176.600 0.043 0.000 1.010 542 K CA -1.327 55.000 56.287 0.067 0.000 0.889 542 K CB 2.090 34.631 32.500 0.070 0.000 1.514 542 K HN -0.607 7.753 8.250 0.246 0.038 0.424 543 N N 0.429 119.104 118.700 -0.042 0.000 2.439 543 N HA 0.377 5.293 4.740 -0.015 -0.185 0.249 543 N C 2.309 177.811 175.510 -0.013 0.000 1.003 543 N CA -1.605 51.414 53.050 -0.052 0.000 0.942 543 N CB 0.171 38.584 38.487 -0.123 0.000 1.115 543 N HN 0.231 8.577 8.380 -0.057 0.000 0.505 544 I N 2.870 123.442 120.570 0.004 0.000 2.700 544 I HA -0.249 3.958 4.170 0.062 0.000 0.261 544 I C 1.266 177.425 176.117 0.070 0.000 1.219 544 I CA 2.472 63.801 61.300 0.049 0.000 1.463 544 I CB -0.110 37.920 38.000 0.051 0.000 1.092 544 I HN 0.671 8.882 8.210 0.002 0.000 0.452 545 R N -0.658 119.793 120.500 -0.081 0.000 2.280 545 R HA -0.128 3.853 4.340 -0.599 0.000 0.207 545 R C 0.846 177.082 176.300 -0.108 0.000 1.043 545 R CA 1.331 57.267 56.100 -0.274 0.000 1.006 545 R CB -0.505 29.613 30.300 -0.303 0.000 0.885 545 R HN -0.116 8.370 8.270 -0.075 -0.261 0.467 546 L N -2.845 118.363 121.223 -0.025 0.000 2.653 546 L HA 0.099 4.434 4.340 -0.008 0.000 0.231 546 L C 0.373 177.275 176.870 0.053 0.000 1.153 546 L CA -0.521 54.322 54.840 0.005 0.000 0.933 546 L CB -0.704 41.347 42.059 -0.013 0.000 1.175 546 L HN -0.661 7.400 8.230 -0.026 0.154 0.473 547 G N -1.914 106.955 108.800 0.116 0.000 2.651 547 G HA2 0.011 4.019 3.960 0.080 0.000 0.260 547 G HA3 0.011 4.049 3.960 0.128 0.000 0.260 547 G C 0.085 174.998 174.900 0.022 0.000 1.216 547 G CA -0.786 44.374 45.100 0.100 0.000 0.913 547 G HN -0.691 7.514 8.290 0.169 0.186 0.535 548 A N -0.874 121.940 122.820 -0.011 0.000 2.067 548 A HA -0.154 4.124 4.320 -0.071 0.000 0.219 548 A C 1.568 178.768 177.584 -0.640 0.000 1.158 548 A CA 2.236 54.207 52.037 -0.110 0.000 0.661 548 A CB 0.035 19.140 19.000 0.174 0.000 0.801 548 A HN 0.373 8.565 8.150 0.070 0.000 0.452 549 G N -4.804 103.351 108.800 -1.076 0.000 3.042 549 G HA2 0.039 2.085 3.960 -3.190 0.000 0.212 549 G HA3 0.039 2.555 3.960 -2.711 -0.183 0.212 549 G C -1.318 172.852 174.900 -1.217 0.000 1.166 549 G CA -0.154 43.637 45.100 -2.182 0.000 0.767 549 G HN 0.190 8.065 8.290 -0.631 0.036 0.546 550 Y N -1.262 118.732 120.300 -0.510 0.000 2.457 550 Y HA 0.667 5.186 4.550 -0.283 -0.139 0.333 550 Y C -1.012 174.752 175.900 -0.227 0.000 1.119 550 Y CA -0.591 57.331 58.100 -0.296 0.000 1.143 550 Y CB 2.718 41.062 38.460 -0.192 0.000 1.230 550 Y HN -0.727 7.230 8.280 -0.419 0.071 0.469 551 T N -0.540 114.021 114.554 0.013 0.000 2.883 551 T HA 0.276 4.613 4.350 -0.022 0.000 0.296 551 T C -1.963 172.733 174.700 -0.006 0.000 1.117 551 T CA -2.006 60.082 62.100 -0.019 0.000 1.006 551 T CB 2.736 71.580 68.868 -0.041 0.000 1.191 551 T HN 0.683 8.863 8.240 0.064 0.098 0.508 552 D N 2.418 122.811 120.400 -0.013 0.000 2.210 552 D HA 0.434 5.258 4.640 -0.022 -0.197 0.249 552 D C 0.726 177.017 176.300 -0.015 0.000 1.062 552 D CA -0.888 53.102 54.000 -0.017 0.000 0.891 552 D CB 1.844 42.634 40.800 -0.017 0.000 1.186 552 D HN 0.200 8.562 8.370 -0.013 0.000 0.432 553 K N 6.382 126.771 120.400 -0.019 0.000 2.173 553 K HA -0.375 3.935 4.320 -0.015 0.000 0.207 553 K C 0.872 177.464 176.600 -0.013 0.000 1.046 553 K CA 2.825 59.102 56.287 -0.017 0.000 0.929 553 K CB 0.071 32.558 32.500 -0.022 0.000 0.720 553 K HN 0.022 8.258 8.250 -0.024 0.000 0.453 554 A N -3.288 119.525 122.820 -0.012 0.000 1.898 554 A HA -0.058 4.257 4.320 -0.009 0.000 0.214 554 A C 0.290 177.870 177.584 -0.006 0.000 1.183 554 A CA 1.891 53.922 52.037 -0.009 0.000 0.622 554 A CB 0.703 19.697 19.000 -0.010 0.000 0.824 554 A HN -0.512 7.869 8.150 -0.015 -0.240 0.444 555 K N -2.113 118.284 120.400 -0.005 0.000 3.029 555 K HA 0.333 4.652 4.320 -0.000 0.000 0.169 555 K C -3.079 173.520 176.600 -0.001 0.000 1.090 555 K CA -3.101 53.186 56.287 -0.001 0.000 0.883 555 K CB 0.951 33.452 32.500 0.001 0.000 1.080 555 K HN -0.565 7.681 8.250 -0.007 0.000 0.613 556 P HA 0.006 4.579 4.420 -0.006 -0.158 0.266 556 P C -0.377 176.925 177.300 0.003 0.000 1.215 556 P CA -0.625 62.474 63.100 -0.002 0.000 0.763 556 P CB 0.460 32.158 31.700 -0.003 0.000 0.806 557 E N 5.227 125.428 120.200 0.001 0.000 2.343 557 E HA 0.223 4.584 4.350 0.019 0.000 0.269 557 E C -1.499 175.112 176.600 0.018 0.000 1.047 557 E CA -2.287 54.120 56.400 0.013 0.000 0.874 557 E CB -0.380 29.331 29.700 0.017 0.000 1.033 557 E HN -0.065 8.290 8.360 -0.007 0.000 0.409 558 P HA 0.007 4.448 4.420 0.036 0.000 0.269 558 P C 0.758 178.099 177.300 0.069 0.000 1.209 558 P CA 0.450 63.576 63.100 0.043 0.000 0.776 558 P CB 0.091 31.818 31.700 0.046 0.000 0.876 559 G N 0.298 109.143 108.800 0.075 0.000 2.148 559 G HA2 -0.491 3.540 3.960 0.118 0.000 0.254 559 G HA3 -0.491 3.573 3.960 0.173 0.000 0.254 559 G C -1.275 173.707 174.900 0.136 0.000 0.981 559 G CA 0.454 45.632 45.100 0.130 0.000 0.670 559 G HN 0.478 8.801 8.290 0.055 0.000 0.528 560 K N -1.169 119.239 120.400 0.013 0.000 2.435 560 K HA 0.450 4.726 4.320 -0.222 -0.089 0.251 560 K C -0.897 175.636 176.600 -0.111 0.000 0.954 560 K CA -1.727 54.477 56.287 -0.139 0.000 0.820 560 K CB 3.798 36.179 32.500 -0.197 0.000 1.292 560 K HN -0.919 7.301 8.250 0.013 0.038 0.436 561 G N 0.062 108.754 108.800 -0.180 0.000 2.354 561 G HA2 0.031 3.964 3.960 -0.037 0.000 0.266 561 G HA3 0.031 3.977 3.960 -0.001 0.013 0.266 561 G C -1.088 173.844 174.900 0.053 0.000 1.242 561 G CA 0.054 45.133 45.100 -0.035 0.000 0.923 561 G HN 0.563 8.626 8.290 -0.378 0.000 0.476 562 I N 8.281 128.863 120.570 0.020 0.000 2.363 562 I HA 0.040 4.364 4.170 0.007 -0.150 0.292 562 I C -0.288 175.829 176.117 0.000 0.000 1.075 562 I CA 0.935 62.239 61.300 0.008 0.000 1.333 562 I CB -0.498 37.499 38.000 -0.006 0.000 1.415 562 I HN 0.076 8.180 8.210 0.004 0.108 0.502 563 I N 0.943 121.506 120.570 -0.012 0.000 3.239 563 I HA 0.369 4.506 4.170 -0.056 0.000 0.314 563 I C -2.236 173.847 176.117 -0.058 0.000 1.126 563 I CA -2.639 58.627 61.300 -0.057 0.000 0.973 563 I CB 3.974 41.893 38.000 -0.134 0.000 1.252 563 I HN 0.315 8.524 8.210 -0.000 0.000 0.463 564 D N 0.325 120.683 120.400 -0.069 0.000 2.422 564 D HA 0.123 4.859 4.640 -0.049 -0.125 0.227 564 D C 0.403 176.661 176.300 -0.071 0.000 1.190 564 D CA -0.417 53.548 54.000 -0.059 0.000 0.905 564 D CB -0.619 40.149 40.800 -0.053 0.000 1.034 564 D HN 0.326 8.649 8.370 -0.079 0.000 0.507 565 Q N 5.856 125.619 119.800 -0.062 0.000 2.451 565 Q HA 0.007 4.296 4.340 -0.085 0.000 0.206 565 Q C 1.862 177.830 176.000 -0.053 0.000 0.947 565 Q CA 1.053 56.817 55.803 -0.065 0.000 0.937 565 Q CB 0.335 29.044 28.738 -0.048 0.000 1.025 565 Q HN -0.001 8.261 8.270 -0.054 -0.024 0.511 566 G N -1.810 106.962 108.800 -0.045 0.000 2.744 566 G HA2 -0.048 3.892 3.960 -0.034 0.000 0.211 566 G HA3 -0.048 3.893 3.960 -0.033 0.000 0.211 566 G C -0.533 174.342 174.900 -0.043 0.000 1.143 566 G CA 0.615 45.693 45.100 -0.038 0.000 0.788 566 G HN -0.352 8.163 8.290 -0.044 -0.252 0.534 567 N N -3.201 115.469 118.700 -0.051 0.000 2.177 567 N HA 0.028 4.739 4.740 -0.048 0.000 0.218 567 N C -0.682 174.789 175.510 -0.066 0.000 1.182 567 N CA -0.962 52.056 53.050 -0.053 0.000 0.882 567 N CB 1.093 39.550 38.487 -0.050 0.000 1.052 567 N HN -0.778 7.496 8.380 -0.056 0.072 0.519 568 E N 1.240 121.397 120.200 -0.072 0.000 2.200 568 E HA 0.072 4.365 4.350 -0.094 0.000 0.283 568 E C -1.237 175.311 176.600 -0.086 0.000 1.015 568 E CA -0.565 55.783 56.400 -0.087 0.000 0.819 568 E CB 0.369 30.012 29.700 -0.096 0.000 1.081 568 E HN -0.738 7.399 8.360 -0.066 0.184 0.397 569 D N 5.776 126.111 120.400 -0.109 0.000 2.228 569 D HA 0.249 4.835 4.640 -0.090 0.000 0.247 569 D C -1.139 175.068 176.300 -0.154 0.000 0.995 569 D CA -0.902 53.029 54.000 -0.116 0.000 0.903 569 D CB 2.923 43.645 40.800 -0.130 0.000 1.205 569 D HN 0.687 8.879 8.370 -0.123 0.105 0.459 570 K N 0.731 121.053 120.400 -0.129 0.000 2.258 570 K HA 0.049 4.262 4.320 -0.178 0.000 0.264 570 K C -1.886 174.524 176.600 -0.317 0.000 1.007 570 K CA -0.817 55.369 56.287 -0.168 0.000 0.941 570 K CB -0.498 31.962 32.500 -0.066 0.000 0.966 570 K HN 0.239 8.438 8.250 -0.085 0.000 0.480 571 P HA -0.154 3.578 4.420 -1.146 0.000 0.261 571 P C -0.827 176.037 177.300 -0.727 0.000 1.173 571 P CA 1.147 63.571 63.100 -1.127 0.000 0.760 571 P CB 0.022 30.593 31.700 -1.881 0.000 0.783 572 W N -4.375 116.815 121.300 -0.183 0.000 2.303 572 W HA -0.378 4.217 4.660 -0.108 0.000 0.267 572 W C 1.622 178.095 176.519 -0.076 0.000 1.054 572 W CA 0.686 57.966 57.345 -0.108 0.000 0.501 572 W CB -3.084 26.333 29.460 -0.073 0.000 2.076 572 W HN 0.046 7.786 8.180 -0.733 0.000 1.317 573 A N 0.565 123.403 122.820 0.031 0.000 1.940 573 A HA -0.321 4.030 4.320 0.051 0.000 0.219 573 A C 0.183 177.776 177.584 0.015 0.000 1.176 573 A CA 2.798 54.847 52.037 0.020 0.000 0.631 573 A CB -0.524 18.458 19.000 -0.030 0.000 0.814 573 A HN -0.459 7.558 8.150 -0.085 0.082 0.446 574 K N -4.440 115.959 120.400 -0.001 0.000 2.397 574 K HA 0.182 4.501 4.320 -0.003 0.000 0.202 574 K C -0.628 175.981 176.600 0.015 0.000 1.022 574 K CA -1.371 54.914 56.287 -0.003 0.000 1.141 574 K CB -0.215 32.270 32.500 -0.026 0.000 0.857 574 K HN -0.293 7.925 8.250 -0.023 0.018 0.514 575 S N 1.172 116.903 115.700 0.051 0.000 2.465 575 S HA 0.078 4.616 4.470 0.035 -0.047 0.279 575 S C 0.293 174.909 174.600 0.028 0.000 1.201 575 S CA -0.982 57.251 58.200 0.054 0.000 1.053 575 S CB 0.983 64.248 63.200 0.108 0.000 0.953 575 S HN -0.068 8.093 8.310 0.078 0.196 0.488 576 Q N 10.166 129.971 119.800 0.008 0.000 2.084 576 Q HA -0.269 4.218 4.340 0.001 -0.146 0.202 576 Q C 1.590 177.587 176.000 -0.004 0.000 0.978 576 Q CA 3.553 59.355 55.803 -0.001 0.000 0.844 576 Q CB 0.054 28.786 28.738 -0.009 0.000 0.898 576 Q HN 0.265 8.581 8.270 0.003 -0.044 0.426 577 V N -0.800 119.108 119.914 -0.008 0.000 2.343 577 V HA -0.311 3.799 4.120 -0.017 0.000 0.247 577 V C 2.235 178.318 176.094 -0.019 0.000 1.051 577 V CA 4.075 66.365 62.300 -0.017 0.000 1.036 577 V CB -0.387 31.420 31.823 -0.026 0.000 0.654 577 V HN -0.249 8.216 8.190 -0.008 -0.280 0.451 578 c N -1.401 117.192 118.600 -0.011 0.000 2.440 578 c HA -0.419 4.127 4.570 -0.039 0.000 0.278 578 c C 2.176 176.265 174.090 -0.002 0.000 1.295 578 c CA 4.375 60.697 56.329 -0.011 0.000 1.738 578 c CB -0.671 41.857 42.510 0.030 0.000 1.987 578 c HN -0.598 7.634 8.230 0.004 0.000 0.492 579 Q N -0.538 119.267 119.800 0.008 0.000 2.096 579 Q HA -0.424 3.918 4.340 0.004 0.000 0.204 579 Q C 2.355 178.347 176.000 -0.012 0.000 0.982 579 Q CA 3.614 59.417 55.803 0.001 0.000 0.850 579 Q CB -0.236 28.504 28.738 0.003 0.000 0.901 579 Q HN -0.040 8.239 8.270 0.015 0.000 0.422 580 T N -1.719 112.826 114.554 -0.014 0.000 2.915 580 T HA -0.313 4.025 4.350 -0.019 0.000 0.269 580 T C 1.495 176.179 174.700 -0.026 0.000 1.071 580 T CA 3.488 65.578 62.100 -0.018 0.000 1.132 580 T CB -0.323 68.537 68.868 -0.014 0.000 0.878 580 T HN -0.184 8.049 8.240 -0.011 0.000 0.479 581 M N 2.651 122.232 119.600 -0.033 0.000 2.229 581 M HA -0.226 4.413 4.480 -0.046 -0.187 0.264 581 M C 1.035 177.289 176.300 -0.077 0.000 1.063 581 M CA 3.602 58.871 55.300 -0.052 0.000 1.114 581 M CB -0.174 32.391 32.600 -0.057 0.000 1.387 581 M HN -0.695 7.463 8.290 -0.028 0.115 0.420 582 I N -0.912 119.621 120.570 -0.061 0.000 2.353 582 I HA -0.390 3.883 4.170 -0.096 -0.160 0.248 582 I C 2.673 178.756 176.117 -0.057 0.000 1.119 582 I CA 3.196 64.456 61.300 -0.066 0.000 1.417 582 I CB -0.108 37.867 38.000 -0.040 0.000 1.078 582 I HN -0.429 7.639 8.210 -0.042 0.117 0.421 583 K N -0.585 119.791 120.400 -0.040 0.000 2.097 583 K HA -0.222 4.077 4.320 -0.034 0.000 0.205 583 K C 1.566 178.145 176.600 -0.035 0.000 1.050 583 K CA 2.284 58.551 56.287 -0.033 0.000 0.938 583 K CB -0.388 32.098 32.500 -0.023 0.000 0.718 583 K HN -0.226 7.925 8.250 -0.034 0.078 0.442 584 E N -3.060 117.118 120.200 -0.037 0.000 2.485 584 E HA -0.067 4.268 4.350 -0.025 0.000 0.194 584 E C 0.815 177.391 176.600 -0.040 0.000 1.098 584 E CA -0.184 56.197 56.400 -0.032 0.000 0.878 584 E CB -0.851 28.834 29.700 -0.024 0.000 0.939 584 E HN -0.489 7.848 8.360 -0.039 0.000 0.503 585 G N 0.419 109.185 108.800 -0.055 0.000 2.184 585 G HA2 -0.400 3.518 3.960 -0.070 0.000 0.264 585 G HA3 -0.400 3.530 3.960 -0.051 0.000 0.264 585 G C 0.161 175.002 174.900 -0.098 0.000 0.975 585 G CA 0.991 46.051 45.100 -0.066 0.000 0.642 585 G HN -0.462 7.667 8.290 -0.056 0.128 0.536 586 K N -0.583 119.740 120.400 -0.129 0.000 2.026 586 K HA -0.273 3.971 4.320 -0.125 0.000 0.208 586 K C -0.395 175.947 176.600 -0.429 0.000 1.048 586 K CA 2.218 58.373 56.287 -0.221 0.000 0.929 586 K CB 0.672 33.044 32.500 -0.214 0.000 0.713 586 K HN -0.455 7.672 8.250 -0.106 0.060 0.439 587 V N -4.102 115.587 119.914 -0.374 0.000 2.823 587 V HA 0.160 4.066 4.120 -0.357 0.000 0.312 587 V C 0.174 176.144 176.094 -0.207 0.000 1.072 587 V CA -2.359 59.728 62.300 -0.354 0.000 0.937 587 V CB 2.357 33.980 31.823 -0.334 0.000 1.013 587 V HN -0.921 7.110 8.190 -0.265 0.000 0.430 588 A N 5.308 127.989 122.820 -0.232 0.000 1.873 588 A HA -0.175 4.041 4.320 -0.174 0.000 0.215 588 A C -0.460 177.038 177.584 -0.142 0.000 1.186 588 A CA 2.207 54.106 52.037 -0.230 0.000 0.616 588 A CB 0.320 19.049 19.000 -0.451 0.000 0.823 588 A HN 0.589 8.573 8.150 -0.277 0.000 0.442 589 D N -8.235 112.107 120.400 -0.096 0.000 2.665 589 D HA 0.062 4.707 4.640 0.007 0.000 0.287 589 D C -0.639 175.738 176.300 0.128 0.000 1.266 589 D CA -1.393 52.625 54.000 0.029 0.000 0.830 589 D CB 0.863 41.699 40.800 0.061 0.000 1.356 589 D HN -0.762 7.529 8.370 -0.131 0.000 0.437 590 M N -1.993 117.691 119.600 0.140 0.000 2.159 590 M HA -0.285 4.310 4.480 0.193 0.000 0.263 590 M C 1.677 178.138 176.300 0.268 0.000 1.063 590 M CA 3.136 58.553 55.300 0.195 0.000 1.110 590 M CB -0.430 32.261 32.600 0.153 0.000 1.374 590 M HN 0.104 8.457 8.290 0.106 0.000 0.411 591 E N -0.746 119.604 120.200 0.249 0.000 2.204 591 E HA -0.305 4.175 4.350 0.217 0.000 0.195 591 E C 2.467 179.213 176.600 0.243 0.000 0.990 591 E CA 2.581 59.125 56.400 0.240 0.000 0.821 591 E CB -0.460 29.362 29.700 0.202 0.000 0.750 591 E HN 0.525 8.937 8.360 0.223 0.082 0.477 592 H N -1.163 118.013 119.070 0.177 0.000 2.551 592 H HA 0.098 4.781 4.556 0.212 0.000 0.266 592 H C 1.712 177.187 175.328 0.244 0.000 0.977 592 H CA -0.565 55.600 56.048 0.195 0.000 1.163 592 H CB -0.425 29.415 29.762 0.131 0.000 1.381 592 H HN 0.097 nan 8.280 nan 0.000 0.581 593 L N 0.207 121.632 121.223 0.338 0.000 2.042 593 L HA -0.315 4.191 4.340 0.276 0.000 0.210 593 L C -1.037 176.044 176.870 0.351 0.000 1.076 593 L CA 4.360 59.369 54.840 0.281 0.000 0.749 593 L CB -2.325 39.799 42.059 0.108 0.000 0.893 593 L HN -0.220 8.044 8.230 0.337 0.169 0.432 594 P HA -0.367 4.399 4.420 0.576 0.000 0.215 594 P C 1.194 178.821 177.300 0.546 0.000 1.157 594 P CA 3.175 66.595 63.100 0.534 0.000 0.868 594 P CB -0.702 31.313 31.700 0.524 0.000 0.788 595 S N -1.643 114.313 115.700 0.426 0.000 2.368 595 S HA -0.247 4.619 4.470 0.406 -0.152 0.225 595 S C 2.102 176.880 174.600 0.296 0.000 1.030 595 S CA 3.443 61.862 58.200 0.365 0.000 0.999 595 S CB 0.013 63.392 63.200 0.297 0.000 0.844 595 S HN -0.172 8.361 8.310 0.371 0.000 0.459 596 Y N 3.122 123.552 120.300 0.215 0.000 2.165 596 Y HA -0.426 4.176 4.550 0.087 0.000 0.286 596 Y C 1.221 177.223 175.900 0.170 0.000 1.155 596 Y CA 3.558 61.750 58.100 0.154 0.000 1.164 596 Y CB -0.068 38.487 38.460 0.159 0.000 0.978 596 Y HN -0.341 8.222 8.280 0.471 0.000 0.513 597 F N -0.226 119.824 119.950 0.167 0.000 2.171 597 F HA -0.294 4.280 4.527 0.078 0.000 0.300 597 F C 1.914 177.711 175.800 -0.005 0.000 1.090 597 F CA 2.960 61.037 58.000 0.129 0.000 1.293 597 F CB -0.047 39.108 39.000 0.257 0.000 1.013 597 F HN 0.387 9.024 8.300 0.562 0.000 0.486 598 G N -1.807 106.881 108.800 -0.186 0.000 2.418 598 G HA2 -0.431 2.398 3.960 -1.885 0.000 0.217 598 G HA3 -0.431 3.126 3.960 -0.670 0.000 0.217 598 G C 1.113 175.820 174.900 -0.321 0.000 1.158 598 G CA 1.990 46.586 45.100 -0.839 0.000 0.771 598 G HN 0.035 8.355 8.290 0.186 0.082 0.545 599 Q N 1.610 121.289 119.800 -0.201 0.000 2.096 599 Q HA -0.389 3.777 4.340 -0.290 0.000 0.204 599 Q C 2.853 178.662 176.000 -0.320 0.000 0.982 599 Q CA 3.138 58.744 55.803 -0.329 0.000 0.850 599 Q CB -0.089 28.330 28.738 -0.531 0.000 0.901 599 Q HN -0.235 7.940 8.270 -0.159 0.000 0.422 600 E N -1.130 118.831 120.200 -0.398 0.000 2.072 600 E HA -0.259 3.922 4.350 -0.282 0.000 0.191 600 E C 2.602 179.028 176.600 -0.291 0.000 0.985 600 E CA 2.395 58.599 56.400 -0.326 0.000 0.801 600 E CB -0.279 29.259 29.700 -0.270 0.000 0.750 600 E HN -0.444 7.647 8.360 -0.448 0.000 0.452 601 V N -0.767 118.896 119.914 -0.418 0.000 2.407 601 V HA -0.464 3.481 4.120 -0.292 0.000 0.248 601 V C 1.511 177.488 176.094 -0.195 0.000 1.055 601 V CA 4.339 66.444 62.300 -0.325 0.000 1.049 601 V CB -0.439 31.186 31.823 -0.329 0.000 0.662 601 V HN 0.284 8.137 8.190 -0.562 0.000 0.455 602 S N 0.188 115.797 115.700 -0.151 0.000 2.400 602 S HA -0.366 4.075 4.470 -0.047 0.000 0.232 602 S C 2.076 176.644 174.600 -0.054 0.000 1.025 602 S CA 3.480 61.655 58.200 -0.042 0.000 0.993 602 S CB -0.351 62.918 63.200 0.114 0.000 0.808 602 S HN -0.031 8.081 8.310 -0.190 0.084 0.478 603 K N 2.349 122.696 120.400 -0.087 0.000 2.057 603 K HA -0.253 4.030 4.320 -0.061 0.000 0.206 603 K C 2.572 179.131 176.600 -0.069 0.000 1.050 603 K CA 2.929 59.170 56.287 -0.076 0.000 0.935 603 K CB -0.228 32.217 32.500 -0.092 0.000 0.715 603 K HN -0.766 7.309 8.250 -0.122 0.102 0.439 604 L N -1.218 119.957 121.223 -0.080 0.000 2.093 604 L HA -0.319 4.007 4.340 -0.023 0.000 0.208 604 L C 2.248 179.109 176.870 -0.016 0.000 1.085 604 L CA 2.863 57.678 54.840 -0.043 0.000 0.755 604 L CB -0.311 41.708 42.059 -0.067 0.000 0.904 604 L HN -0.711 7.376 8.230 -0.109 0.078 0.435 605 V N -0.101 119.752 119.914 -0.101 0.000 2.295 605 V HA -0.538 3.475 4.120 -0.177 0.000 0.246 605 V C 1.838 177.920 176.094 -0.019 0.000 1.049 605 V CA 4.642 66.878 62.300 -0.106 0.000 1.024 605 V CB -0.387 31.389 31.823 -0.078 0.000 0.648 605 V HN 0.177 8.199 8.190 -0.117 0.098 0.447 606 K N 0.551 120.937 120.400 -0.023 0.000 2.057 606 K HA -0.166 4.419 4.320 -0.006 -0.269 0.207 606 K C 2.537 179.117 176.600 -0.034 0.000 1.049 606 K CA 1.985 58.261 56.287 -0.018 0.000 0.931 606 K CB -0.487 32.000 32.500 -0.022 0.000 0.714 606 K HN 0.130 8.252 8.250 -0.035 0.108 0.440 607 A N -1.712 121.071 122.820 -0.062 0.000 2.070 607 A HA -0.121 4.128 4.320 -0.118 0.000 0.220 607 A C 1.164 178.604 177.584 -0.240 0.000 1.159 607 A CA 2.432 54.385 52.037 -0.139 0.000 0.656 607 A CB -0.610 18.287 19.000 -0.172 0.000 0.800 607 A HN -0.101 8.018 8.150 -0.053 0.000 0.453 608 H N -3.979 115.042 119.070 -0.081 0.000 2.517 608 H HA 0.110 4.628 4.556 -0.065 0.000 0.282 608 H C 0.095 175.395 175.328 -0.046 0.000 1.023 608 H CA -0.088 55.915 56.048 -0.075 0.000 1.169 608 H CB 0.178 29.866 29.762 -0.123 0.000 1.454 608 H HN -0.683 7.480 8.280 0.044 0.144 0.556 609 G N -0.687 108.128 108.800 0.025 0.000 2.137 609 G HA2 -0.400 3.563 3.960 0.005 0.000 0.237 609 G HA3 -0.400 3.576 3.960 0.027 0.000 0.237 609 G C -0.994 173.926 174.900 0.033 0.000 1.002 609 G CA 0.443 45.556 45.100 0.022 0.000 0.702 609 G HN -0.194 7.903 8.290 -0.010 0.187 0.515 610 I N -0.243 120.349 120.570 0.037 0.000 2.354 610 I HA 0.065 4.261 4.170 0.044 0.000 0.292 610 I C -1.605 174.529 176.117 0.029 0.000 0.989 610 I CA -0.568 60.758 61.300 0.042 0.000 1.188 610 I CB 1.587 39.624 38.000 0.062 0.000 1.342 610 I HN -0.615 7.584 8.210 0.036 0.032 0.457 611 D N 6.143 126.559 120.400 0.026 0.000 2.501 611 D HA 0.199 4.844 4.640 0.009 0.000 0.226 611 D C -1.669 174.633 176.300 0.003 0.000 1.198 611 D CA -0.787 53.220 54.000 0.012 0.000 0.830 611 D CB 0.816 41.621 40.800 0.009 0.000 1.014 611 D HN 0.597 8.986 8.370 0.031 0.000 0.496 612 R N -2.284 118.223 120.500 0.012 0.000 2.548 612 R HA 0.667 5.229 4.340 -0.040 -0.246 0.280 612 R C -2.637 173.664 176.300 0.001 0.000 1.061 612 R CA -0.967 55.124 56.100 -0.015 0.000 0.915 612 R CB 3.300 33.590 30.300 -0.017 0.000 1.210 612 R HN -0.774 7.456 8.270 0.033 0.060 0.442 613 M N 5.679 125.247 119.600 -0.052 0.000 2.535 613 M HA 0.779 5.432 4.480 0.019 -0.161 0.314 613 M C -2.521 173.665 176.300 -0.190 0.000 1.153 613 M CA -1.115 54.150 55.300 -0.058 0.000 0.924 613 M CB 4.847 37.407 32.600 -0.066 0.000 1.710 613 M HN 0.222 8.458 8.290 -0.090 0.000 0.451 614 Q N 3.538 123.165 119.800 -0.289 0.000 2.423 614 Q HA 0.941 5.245 4.340 -0.429 -0.221 0.278 614 Q C -2.531 172.947 176.000 -0.869 0.000 1.097 614 Q CA -2.005 53.472 55.803 -0.542 0.000 0.809 614 Q CB 5.185 33.579 28.738 -0.574 0.000 1.391 614 Q HN 0.637 8.774 8.270 -0.221 0.000 0.428 615 A N 0.660 123.031 122.820 -0.749 0.000 2.609 615 A HA 0.357 4.282 4.320 -0.715 -0.033 0.291 615 A C -2.324 175.092 177.584 -0.281 0.000 1.096 615 A CA -0.356 51.417 52.037 -0.440 0.000 0.684 615 A CB 3.559 22.611 19.000 0.085 0.000 1.282 615 A HN 0.112 7.918 8.150 -0.573 0.000 0.412 616 W N -0.332 121.091 121.300 0.205 0.000 2.216 616 W HA 0.114 5.003 4.660 0.155 -0.137 0.326 616 W C 2.178 178.770 176.519 0.122 0.000 1.319 616 W CA -0.057 57.395 57.345 0.178 0.000 1.213 616 W CB 0.365 29.899 29.460 0.125 0.000 1.171 616 W HN 0.685 8.892 8.180 0.235 0.113 0.557 617 Q N 5.685 125.585 119.800 0.167 0.000 2.181 617 Q HA -0.395 3.672 4.340 -0.454 0.000 0.205 617 Q C 0.988 176.965 176.000 -0.039 0.000 0.980 617 Q CA 3.603 59.178 55.803 -0.379 0.000 0.862 617 Q CB -0.788 27.297 28.738 -1.088 0.000 0.905 617 Q HN 0.062 8.536 8.270 0.339 0.000 0.429 618 D N -1.152 119.383 120.400 0.224 0.000 2.263 618 D HA -0.215 4.582 4.640 0.262 0.000 0.208 618 D C 2.078 178.588 176.300 0.350 0.000 0.971 618 D CA 1.924 56.090 54.000 0.275 0.000 0.867 618 D CB -1.352 39.585 40.800 0.228 0.000 0.929 618 D HN 0.172 8.763 8.370 0.397 0.018 0.492 619 G N -1.302 107.743 108.800 0.408 0.000 2.484 619 G HA2 -0.140 4.129 3.960 0.471 0.000 0.218 619 G HA3 -0.140 4.196 3.960 0.568 -0.035 0.218 619 G C -0.193 174.996 174.900 0.482 0.000 1.130 619 G CA 1.329 46.722 45.100 0.488 0.000 0.784 619 G HN -0.212 8.297 8.290 0.422 0.033 0.543 620 L N -1.943 119.532 121.223 0.420 0.000 2.857 620 L HA 0.258 4.884 4.340 0.477 0.000 0.249 620 L C 0.840 178.018 176.870 0.513 0.000 1.172 620 L CA -1.154 53.961 54.840 0.458 0.000 0.980 620 L CB -0.556 41.712 42.059 0.349 0.000 1.299 620 L HN -0.450 7.843 8.230 0.360 0.154 0.535 621 K N -0.263 120.435 120.400 0.495 0.000 2.209 621 K HA -0.245 4.375 4.320 0.499 0.000 0.204 621 K C 0.533 177.253 176.600 0.199 0.000 1.048 621 K CA 2.815 59.348 56.287 0.411 0.000 0.940 621 K CB -0.594 32.122 32.500 0.360 0.000 0.729 621 K HN -0.785 7.666 8.250 0.440 0.063 0.451 622 D N -2.333 118.166 120.400 0.165 0.000 2.339 622 D HA 0.103 4.771 4.640 0.046 0.000 0.217 622 D C -0.339 176.058 176.300 0.161 0.000 1.050 622 D CA 0.575 54.609 54.000 0.058 0.000 0.856 622 D CB 0.315 40.972 40.800 -0.239 0.000 0.922 622 D HN -0.460 8.014 8.370 0.215 0.025 0.518 623 A N 1.230 124.193 122.820 0.239 0.000 2.407 623 A HA 0.049 4.449 4.320 0.134 0.000 0.248 623 A C 0.473 178.176 177.584 0.197 0.000 1.082 623 A CA -0.327 51.843 52.037 0.222 0.000 0.785 623 A CB 1.336 20.551 19.000 0.359 0.000 1.020 623 A HN -0.681 7.494 8.150 0.304 0.157 0.489 624 E N 0.258 120.528 120.200 0.118 0.000 2.038 624 E HA -0.251 4.149 4.350 0.083 0.000 0.195 624 E C -0.317 176.345 176.600 0.103 0.000 1.000 624 E CA 2.343 58.794 56.400 0.085 0.000 0.803 624 E CB 0.317 30.040 29.700 0.037 0.000 0.750 624 E HN 0.442 8.841 8.360 0.066 0.000 0.448 625 S N -6.595 109.182 115.700 0.128 0.000 2.669 625 S HA 0.075 4.593 4.470 0.081 0.000 0.266 625 S C 0.468 175.065 174.600 -0.004 0.000 1.149 625 S CA -1.059 57.172 58.200 0.050 0.000 0.842 625 S CB 1.996 65.175 63.200 -0.035 0.000 1.160 625 S HN -0.852 7.528 8.310 0.118 0.000 0.487 626 S N 0.528 115.984 115.700 -0.406 0.000 2.442 626 S HA -0.256 4.148 4.470 -0.111 0.000 0.236 626 S C 2.104 176.747 174.600 0.071 0.000 1.007 626 S CA 3.008 61.049 58.200 -0.264 0.000 0.965 626 S CB -0.179 62.729 63.200 -0.486 0.000 0.773 626 S HN 0.586 8.551 8.310 -0.575 0.000 0.504 627 K N 1.177 121.568 120.400 -0.014 0.000 2.360 627 K HA -0.203 4.114 4.320 -0.004 0.000 0.201 627 K C 0.819 177.398 176.600 -0.036 0.000 1.046 627 K CA 1.713 57.991 56.287 -0.015 0.000 0.945 627 K CB -0.562 31.916 32.500 -0.036 0.000 0.750 627 K HN -0.526 7.643 8.250 -0.069 0.040 0.464 628 A N -2.482 120.280 122.820 -0.097 0.000 2.235 628 A HA -0.012 4.171 4.320 -0.229 0.000 0.208 628 A C -0.105 177.135 177.584 -0.574 0.000 1.172 628 A CA 0.923 52.756 52.037 -0.340 0.000 0.786 628 A CB 0.462 19.193 19.000 -0.448 0.000 0.804 628 A HN -0.483 7.508 8.150 -0.013 0.152 0.479 629 F N -3.799 116.123 119.950 -0.048 0.000 2.470 629 F HA 0.068 4.547 4.527 -0.080 0.000 0.329 629 F C -0.018 175.741 175.800 -0.069 0.000 1.072 629 F CA -1.026 56.936 58.000 -0.064 0.000 0.989 629 F CB 2.294 41.266 39.000 -0.047 0.000 1.193 629 F HN -0.874 7.433 8.300 0.135 0.073 0.481 630 A N -0.535 122.339 122.820 0.090 0.000 2.067 630 A HA -0.060 4.263 4.320 0.005 0.000 0.217 630 A C -0.193 177.410 177.584 0.031 0.000 1.156 630 A CA 1.243 53.295 52.037 0.024 0.000 0.683 630 A CB -0.069 18.923 19.000 -0.014 0.000 0.808 630 A HN 0.191 8.406 8.150 0.108 0.000 0.455 631 T N -4.852 109.735 114.554 0.054 0.000 2.910 631 T HA -0.044 4.313 4.350 0.011 0.000 0.293 631 T C 0.394 175.101 174.700 0.012 0.000 1.015 631 T CA -0.383 61.729 62.100 0.020 0.000 1.094 631 T CB 1.895 70.767 68.868 0.007 0.000 0.968 631 T HN -0.764 7.511 8.240 0.102 0.026 0.521 632 S N 1.719 117.414 115.700 -0.008 0.000 2.489 632 S HA -0.135 4.326 4.470 -0.015 0.000 0.228 632 S C 0.834 175.407 174.600 -0.045 0.000 0.995 632 S CA 1.768 59.956 58.200 -0.020 0.000 0.934 632 S CB 0.637 63.826 63.200 -0.018 0.000 0.771 632 S HN 0.170 8.785 8.310 -0.008 -0.310 0.522 633 R N 0.719 121.185 120.500 -0.057 0.000 2.561 633 R HA 0.276 4.548 4.340 -0.114 0.000 0.297 633 R C -2.420 173.808 176.300 -0.120 0.000 0.969 633 R CA -0.741 55.299 56.100 -0.101 0.000 0.879 633 R CB 3.611 33.844 30.300 -0.111 0.000 1.178 633 R HN -0.800 7.403 8.270 -0.041 0.043 0.445 634 V N 2.865 122.690 119.914 -0.149 0.000 2.482 634 V HA 0.623 4.822 4.120 -0.185 -0.189 0.295 634 V C -0.697 175.338 176.094 -0.098 0.000 1.026 634 V CA -1.008 61.195 62.300 -0.161 0.000 0.856 634 V CB 3.053 34.738 31.823 -0.230 0.000 1.001 634 V HN 0.437 8.536 8.190 -0.152 0.000 0.424 635 G N 5.962 114.653 108.800 -0.181 0.000 2.410 635 G HA2 0.833 4.848 3.960 -0.169 0.000 0.330 635 G HA3 0.833 4.631 3.960 -0.269 0.000 0.330 635 G C -2.516 172.249 174.900 -0.225 0.000 1.142 635 G CA -1.677 43.298 45.100 -0.207 0.000 0.902 635 G HN 0.841 9.001 8.290 -0.216 0.000 0.491 636 V N -3.223 116.568 119.914 -0.205 0.000 2.588 636 V HA 0.775 4.869 4.120 -0.318 -0.164 0.304 636 V C -1.430 174.548 176.094 -0.194 0.000 1.042 636 V CA -3.028 59.107 62.300 -0.276 0.000 0.877 636 V CB 2.512 34.065 31.823 -0.449 0.000 0.996 636 V HN 0.556 8.663 8.190 -0.139 0.000 0.425 637 N N 6.670 125.253 118.700 -0.195 0.000 2.402 637 N HA 0.257 5.192 4.740 -0.014 -0.203 0.252 637 N C -1.370 174.258 175.510 0.197 0.000 1.118 637 N CA 0.677 53.693 53.050 -0.056 0.000 0.945 637 N CB 0.646 38.938 38.487 -0.324 0.000 1.147 637 N HN 0.584 8.688 8.380 -0.280 0.108 0.495 638 F N 6.793 126.778 119.950 0.058 0.000 2.404 638 F HA 0.351 5.030 4.527 -0.076 -0.198 0.359 638 F C -1.249 174.699 175.800 0.247 0.000 1.134 638 F CA -1.662 56.362 58.000 0.039 0.000 1.160 638 F CB 1.272 40.255 39.000 -0.029 0.000 1.186 638 F HN 0.604 9.068 8.300 0.273 0.000 0.526 639 W N 5.152 126.106 121.300 -0.576 0.000 2.506 639 W HA 0.421 4.930 4.660 -0.252 0.000 0.394 639 W C -1.833 174.338 176.519 -0.581 0.000 0.920 639 W CA -2.509 54.621 57.345 -0.358 0.000 2.221 639 W CB 0.293 29.750 29.460 -0.005 0.000 1.197 639 W HN 0.127 8.405 8.180 -0.412 -0.345 0.627 640 D N 0.966 120.663 120.400 -1.171 0.000 2.313 640 D HA 0.106 4.066 4.640 -1.133 0.000 0.247 640 D C -0.191 175.800 176.300 -0.515 0.000 1.094 640 D CA 0.580 53.979 54.000 -1.003 0.000 0.925 640 D CB 1.522 41.815 40.800 -0.844 0.000 1.188 640 D HN -0.316 6.890 8.370 -1.940 0.000 0.430 641 T N -3.863 110.399 114.554 -0.487 0.000 2.899 641 T HA 0.090 4.457 4.350 -0.239 -0.161 0.284 641 T C 1.034 175.670 174.700 -0.106 0.000 1.004 641 T CA -1.080 60.820 62.100 -0.332 0.000 1.043 641 T CB 1.739 70.219 68.868 -0.646 0.000 1.013 641 T HN -0.092 7.687 8.240 -0.768 0.000 0.518 642 L N 1.765 122.984 121.223 -0.005 0.000 2.044 642 L HA -0.200 4.326 4.340 0.310 0.000 0.205 642 L C 2.303 179.235 176.870 0.104 0.000 1.075 642 L CA 3.178 58.148 54.840 0.216 0.000 0.747 642 L CB -0.210 42.127 42.059 0.463 0.000 0.903 642 L HN 0.228 8.966 8.230 0.023 -0.493 0.435 643 Y N -5.510 114.679 120.300 -0.186 0.000 2.421 643 Y HA -0.230 4.011 4.550 -0.516 0.000 0.292 643 Y C 0.676 176.588 175.900 0.021 0.000 1.136 643 Y CA 0.729 58.571 58.100 -0.430 0.000 1.255 643 Y CB -0.937 37.061 38.460 -0.770 0.000 0.991 643 Y HN -0.695 7.445 8.280 -0.469 -0.141 0.552 644 W N 0.246 121.224 121.300 -0.537 0.000 3.047 644 W HA -0.109 4.481 4.660 -0.117 0.000 0.250 644 W C 0.139 176.517 176.519 -0.236 0.000 1.314 644 W CA -0.011 57.156 57.345 -0.298 0.000 1.540 644 W CB 1.542 30.753 29.460 -0.416 0.000 1.127 644 W HN -0.636 7.165 8.180 -0.576 0.033 0.679 645 G N -4.709 103.841 108.800 -0.416 0.000 2.273 645 G HA2 -0.282 2.790 3.960 -1.480 0.000 0.162 645 G HA3 -0.282 2.948 3.960 -1.216 0.000 0.162 645 G C 0.709 175.154 174.900 -0.758 0.000 1.006 645 G CA -0.345 44.126 45.100 -1.048 0.000 0.704 645 G HN -0.165 7.866 8.290 -0.119 0.188 0.487 646 G N 1.533 110.324 108.800 -0.015 0.000 2.450 646 G HA2 -0.271 4.048 3.960 0.598 0.000 0.220 646 G HA3 -0.271 4.042 3.960 0.422 -0.100 0.220 646 G C 0.300 175.279 174.900 0.132 0.000 1.130 646 G CA 1.997 47.294 45.100 0.328 0.000 0.760 646 G HN 0.156 8.567 8.290 0.201 0.000 0.557 647 F N -3.470 116.600 119.950 0.201 0.000 2.408 647 F HA -0.166 4.374 4.527 0.021 0.000 0.300 647 F C -0.073 175.732 175.800 0.008 0.000 1.090 647 F CA -0.017 58.031 58.000 0.079 0.000 1.427 647 F CB -0.863 38.211 39.000 0.124 0.000 1.070 647 F HN -0.838 7.298 8.300 -0.233 0.025 0.549 648 D N -1.798 118.465 120.400 -0.229 0.000 2.431 648 D HA 0.199 4.888 4.640 0.082 0.000 0.227 648 D C 1.865 178.140 176.300 -0.041 0.000 1.030 648 D CA 0.878 54.851 54.000 -0.044 0.000 0.897 648 D CB 2.077 42.841 40.800 -0.060 0.000 1.058 648 D HN -0.426 7.348 8.370 -0.729 0.158 0.500 649 S N 0.431 116.124 115.700 -0.012 0.000 2.461 649 S HA -0.163 4.370 4.470 0.104 0.000 0.228 649 S C 1.580 176.296 174.600 0.193 0.000 1.005 649 S CA 2.541 60.842 58.200 0.169 0.000 0.942 649 S CB 0.482 63.912 63.200 0.383 0.000 0.776 649 S HN -0.490 7.768 8.310 -0.086 0.000 0.514 650 V N 2.416 122.256 119.914 -0.122 0.000 2.490 650 V HA -0.419 3.246 4.120 -0.759 0.000 0.250 650 V C 0.254 176.327 176.094 -0.036 0.000 1.061 650 V CA 2.971 64.951 62.300 -0.534 0.000 1.064 650 V CB 0.040 31.253 31.823 -1.017 0.000 0.670 650 V HN -0.389 7.716 8.190 -0.107 0.021 0.461 651 N N -0.865 117.827 118.700 -0.014 0.000 2.104 651 N HA -0.354 4.660 4.740 0.457 0.000 0.190 651 N C 1.770 177.391 175.510 0.184 0.000 1.024 651 N CA 3.711 56.878 53.050 0.194 0.000 0.853 651 N CB -0.867 37.687 38.487 0.111 0.000 1.008 651 N HN -0.515 7.779 8.380 -0.109 0.020 0.424 652 D N 0.114 120.559 120.400 0.076 0.000 2.158 652 D HA -0.285 4.345 4.640 -0.017 0.000 0.197 652 D C 2.044 178.297 176.300 -0.078 0.000 0.995 652 D CA 3.256 57.229 54.000 -0.044 0.000 0.846 652 D CB -0.570 40.134 40.800 -0.160 0.000 0.941 652 D HN -0.474 7.925 8.370 0.061 0.007 0.456 653 W N -0.891 120.497 121.300 0.147 0.000 2.379 653 W HA -0.315 4.529 4.660 0.307 0.000 0.307 653 W C 1.569 178.239 176.519 0.251 0.000 1.200 653 W CA 3.248 60.725 57.345 0.219 0.000 1.297 653 W CB -0.442 29.085 29.460 0.112 0.000 1.140 653 W HN -0.733 7.586 8.180 0.231 0.000 0.507 654 A N -1.041 121.996 122.820 0.363 0.000 1.933 654 A HA -0.177 4.421 4.320 0.159 -0.182 0.218 654 A C 2.719 180.355 177.584 0.087 0.000 1.175 654 A CA 2.319 54.458 52.037 0.170 0.000 0.628 654 A CB -0.555 18.452 19.000 0.011 0.000 0.814 654 A HN -0.457 7.939 8.150 0.411 0.000 0.444 655 N N -2.990 115.769 118.700 0.097 0.000 2.494 655 N HA -0.101 4.645 4.740 0.010 0.000 0.182 655 N C 0.912 176.435 175.510 0.021 0.000 1.076 655 N CA 1.764 54.838 53.050 0.040 0.000 0.908 655 N CB 0.011 38.526 38.487 0.046 0.000 0.967 655 N HN -0.011 8.446 8.380 0.144 0.010 0.449 656 K N -1.615 118.816 120.400 0.051 0.000 2.387 656 K HA 0.165 4.470 4.320 -0.025 0.000 0.198 656 K C -0.613 175.897 176.600 -0.150 0.000 1.022 656 K CA -0.011 56.276 56.287 0.000 0.000 1.128 656 K CB 0.482 33.041 32.500 0.098 0.000 0.853 656 K HN -0.526 7.637 8.250 0.128 0.163 0.523 657 G N -2.427 106.311 108.800 -0.102 0.000 2.175 657 G HA2 -0.370 3.522 3.960 -0.113 0.000 0.244 657 G HA3 -0.370 3.448 3.960 -0.237 0.000 0.244 657 G C 0.129 174.905 174.900 -0.206 0.000 0.982 657 G CA 0.158 45.151 45.100 -0.178 0.000 0.641 657 G HN -0.446 7.652 8.290 -0.010 0.186 0.527 658 Y N 0.919 121.252 120.300 0.055 0.000 2.336 658 Y HA -0.045 4.626 4.550 -0.024 -0.135 0.331 658 Y C -0.012 175.865 175.900 -0.038 0.000 1.211 658 Y CA 0.473 58.592 58.100 0.032 0.000 1.346 658 Y CB 0.533 39.102 38.460 0.182 0.000 1.271 658 Y HN -0.736 7.565 8.280 0.118 0.050 0.538 659 E N 1.752 121.957 120.200 0.010 0.000 2.105 659 E HA 0.082 4.388 4.350 -0.072 0.000 0.285 659 E C -1.206 175.369 176.600 -0.043 0.000 1.055 659 E CA -0.407 55.900 56.400 -0.155 0.000 0.843 659 E CB 0.649 29.978 29.700 -0.619 0.000 1.067 659 E HN 0.384 8.741 8.360 -0.006 0.000 0.398 660 V N 7.333 127.277 119.914 0.050 0.000 2.427 660 V HA -0.045 4.224 4.120 0.032 -0.129 0.268 660 V C -0.879 175.217 176.094 0.004 0.000 1.046 660 V CA 0.396 62.733 62.300 0.060 0.000 0.970 660 V CB 0.529 32.439 31.823 0.144 0.000 1.001 660 V HN 0.549 8.772 8.190 0.055 0.000 0.476 661 V N 9.658 129.532 119.914 -0.068 0.000 2.304 661 V HA 0.047 4.190 4.120 -0.217 -0.153 0.269 661 V C -0.830 175.273 176.094 0.015 0.000 1.036 661 V CA -1.784 60.414 62.300 -0.171 0.000 0.840 661 V CB -0.451 31.116 31.823 -0.428 0.000 1.036 661 V HN 0.821 8.969 8.190 -0.069 0.000 0.466 662 V N 9.794 129.737 119.914 0.048 0.000 2.458 662 V HA -0.278 4.045 4.120 0.339 0.000 0.287 662 V C -1.063 175.200 176.094 0.283 0.000 1.009 662 V CA 2.053 64.491 62.300 0.230 0.000 1.091 662 V CB -1.087 30.850 31.823 0.190 0.000 0.960 662 V HN 0.402 8.542 8.190 -0.083 0.000 0.476 663 S N 5.511 121.421 115.700 0.350 0.000 3.021 663 S HA 0.237 5.072 4.470 0.309 -0.180 0.252 663 S C -1.602 173.203 174.600 0.340 0.000 0.996 663 S CA -0.810 57.598 58.200 0.346 0.000 1.084 663 S CB 1.211 64.644 63.200 0.388 0.000 1.021 663 S HN 0.054 8.615 8.310 0.419 0.000 0.566 664 N N 3.071 121.926 118.700 0.258 0.000 2.365 664 N HA -0.062 4.705 4.740 0.045 0.000 0.265 664 N C -0.576 174.856 175.510 -0.130 0.000 1.288 664 N CA 0.329 53.431 53.050 0.087 0.000 0.869 664 N CB 0.137 38.731 38.487 0.179 0.000 1.071 664 N HN -0.264 8.330 8.380 0.356 0.000 0.480 665 P HA -0.178 3.369 4.420 -1.455 0.000 0.218 665 P C -0.273 176.747 177.300 -0.467 0.000 1.149 665 P CA 2.024 64.519 63.100 -1.010 0.000 0.817 665 P CB 0.153 31.088 31.700 -1.275 0.000 0.785 666 D N -5.355 114.847 120.400 -0.331 0.000 2.371 666 D HA -0.206 4.234 4.640 -0.334 0.000 0.221 666 D C -0.480 175.348 176.300 -0.787 0.000 0.986 666 D CA 1.753 55.507 54.000 -0.411 0.000 0.899 666 D CB -1.254 39.360 40.800 -0.308 0.000 0.902 666 D HN 0.584 8.764 8.370 -0.275 0.025 0.530 667 Y N -4.900 115.185 120.300 -0.359 0.000 2.640 667 Y HA 0.143 4.485 4.550 -0.346 0.000 0.274 667 Y C 0.150 175.867 175.900 -0.306 0.000 1.164 667 Y CA 0.840 58.673 58.100 -0.445 0.000 1.189 667 Y CB 3.899 41.727 38.460 -1.053 0.000 1.333 667 Y HN -0.569 7.401 8.280 -0.259 0.154 0.494 668 V N -8.556 111.306 119.914 -0.087 0.000 3.070 668 V HA 0.313 4.425 4.120 -0.013 0.000 0.345 668 V C -1.800 174.328 176.094 0.058 0.000 1.403 668 V CA -1.350 60.957 62.300 0.012 0.000 1.155 668 V CB 0.142 32.027 31.823 0.103 0.000 1.140 668 V HN -0.148 7.981 8.190 -0.102 0.000 0.505 669 Y N 1.691 121.778 120.300 -0.355 0.000 2.383 669 Y HA 0.247 4.580 4.550 -0.361 0.000 0.344 669 Y C 0.529 176.138 175.900 -0.484 0.000 0.986 669 Y CA -0.715 57.058 58.100 -0.545 0.000 1.175 669 Y CB -0.600 37.178 38.460 -1.137 0.000 1.152 669 Y HN -0.843 7.382 8.280 -0.092 0.000 0.511 670 M N 4.368 123.822 119.600 -0.243 0.000 2.561 670 M HA -0.057 4.311 4.480 -0.185 0.000 0.238 670 M C -0.218 176.015 176.300 -0.112 0.000 1.131 670 M CA 1.628 56.817 55.300 -0.185 0.000 1.046 670 M CB -0.024 32.474 32.600 -0.171 0.000 1.532 670 M HN 0.683 8.705 8.290 -0.272 0.106 0.497 671 D N -1.655 118.669 120.400 -0.127 0.000 2.339 671 D HA -0.043 4.625 4.640 0.047 0.000 0.217 671 D C -1.260 175.187 176.300 0.246 0.000 1.050 671 D CA -0.595 53.424 54.000 0.031 0.000 0.856 671 D CB -0.346 40.486 40.800 0.053 0.000 0.922 671 D HN -0.311 7.838 8.370 -0.265 0.062 0.518 672 F N 0.721 120.671 119.950 -0.000 0.000 2.378 672 F HA 0.896 5.682 4.527 -0.015 -0.268 0.325 672 F C -1.495 174.287 175.800 -0.031 0.000 1.097 672 F CA -4.192 53.785 58.000 -0.039 0.000 1.079 672 F CB -0.447 38.483 39.000 -0.118 0.000 1.240 672 F HN -0.904 7.306 8.300 -0.023 0.076 0.519 673 P HA 0.257 4.961 4.420 0.232 -0.145 0.274 673 P C 0.214 177.668 177.300 0.256 0.000 1.231 673 P CA -0.810 62.394 63.100 0.172 0.000 0.790 673 P CB 0.891 32.593 31.700 0.004 0.000 0.951 674 Y N -1.318 119.106 120.300 0.207 0.000 2.314 674 Y HA -0.142 4.705 4.550 0.204 -0.175 0.293 674 Y C 0.003 176.051 175.900 0.247 0.000 1.129 674 Y CA 2.418 60.639 58.100 0.202 0.000 1.201 674 Y CB 0.905 39.441 38.460 0.126 0.000 0.999 674 Y HN 0.666 9.299 8.280 0.589 0.000 0.541 675 E N -6.802 113.616 120.200 0.364 0.000 2.423 675 E HA 0.061 4.414 4.350 0.005 0.000 0.280 675 E C -1.703 174.998 176.600 0.169 0.000 1.030 675 E CA -2.027 54.452 56.400 0.131 0.000 0.812 675 E CB 3.271 32.977 29.700 0.011 0.000 1.313 675 E HN -0.946 7.627 8.360 0.393 0.023 0.456 676 V N 0.746 120.620 119.914 -0.068 0.000 2.326 676 V HA -0.105 4.117 4.120 0.169 0.000 0.249 676 V C -1.457 174.512 176.094 -0.209 0.000 1.114 676 V CA 0.002 62.264 62.300 -0.063 0.000 1.028 676 V CB -2.183 29.524 31.823 -0.193 0.000 1.170 676 V HN 0.462 8.454 8.190 -0.329 0.000 0.494 677 N N 7.587 126.212 118.700 -0.125 0.000 2.537 677 N HA 0.259 4.828 4.740 -0.286 0.000 0.281 677 N C -2.272 173.115 175.510 -0.206 0.000 1.097 677 N CA -1.630 51.317 53.050 -0.171 0.000 0.964 677 N CB 3.707 42.163 38.487 -0.053 0.000 1.588 677 N HN -0.545 7.882 8.380 0.078 0.000 0.511 678 P HA -0.000 3.954 4.420 -0.776 0.000 0.228 678 P C -0.775 176.406 177.300 -0.199 0.000 1.151 678 P CA 1.463 64.285 63.100 -0.463 0.000 0.770 678 P CB 0.367 31.754 31.700 -0.521 0.000 0.786 679 D N -4.524 115.843 120.400 -0.054 0.000 2.339 679 D HA 0.165 4.794 4.640 -0.017 0.000 0.217 679 D C -0.406 175.967 176.300 0.122 0.000 1.050 679 D CA -0.075 53.934 54.000 0.016 0.000 0.856 679 D CB 0.116 40.916 40.800 0.000 0.000 0.922 679 D HN -0.176 8.425 8.370 -0.061 -0.267 0.518 680 E N -0.909 119.442 120.200 0.253 0.000 2.349 680 E HA 0.057 4.536 4.350 0.215 0.000 0.265 680 E C -0.855 175.900 176.600 0.258 0.000 1.064 680 E CA -0.595 55.983 56.400 0.297 0.000 0.886 680 E CB 0.974 30.905 29.700 0.385 0.000 1.036 680 E HN -0.309 8.060 8.360 0.296 0.169 0.413 681 R N 1.645 122.257 120.500 0.186 0.000 2.410 681 R HA -0.086 4.325 4.340 0.118 0.000 0.288 681 R C -1.012 175.356 176.300 0.114 0.000 1.051 681 R CA 0.294 56.470 56.100 0.127 0.000 1.021 681 R CB 0.804 31.132 30.300 0.048 0.000 1.032 681 R HN 0.405 8.817 8.270 0.236 0.000 0.481 682 G N 1.385 110.246 108.800 0.102 0.000 2.334 682 G HA2 -0.175 3.941 3.960 0.186 0.000 0.566 682 G HA3 -0.175 3.891 3.960 0.131 -0.027 0.566 682 G C -1.596 173.477 174.900 0.287 0.000 1.413 682 G CA -0.749 44.445 45.100 0.157 0.000 0.993 682 G HN -0.310 8.063 8.290 0.138 0.000 0.642 683 Y N -0.848 119.546 120.300 0.156 0.000 2.289 683 Y HA 0.085 4.636 4.550 0.002 0.000 0.332 683 Y C -0.562 175.242 175.900 -0.159 0.000 1.324 683 Y CA -2.270 55.867 58.100 0.063 0.000 1.478 683 Y CB 2.191 40.763 38.460 0.187 0.000 1.378 683 Y HN -0.064 8.477 8.280 0.434 0.000 0.558 684 Y N -7.792 112.285 120.300 -0.371 0.000 2.979 684 Y HA 0.291 4.111 4.550 -1.338 -0.073 0.251 684 Y C -0.958 174.532 175.900 -0.683 0.000 1.092 684 Y CA -1.666 55.968 58.100 -0.776 0.000 1.206 684 Y CB -0.632 37.643 38.460 -0.308 0.000 1.254 684 Y HN 0.094 7.901 8.280 -0.788 0.000 0.625 685 W N -0.425 120.431 121.300 -0.741 0.000 2.436 685 W HA -0.203 4.307 4.660 -0.249 0.000 0.284 685 W C -0.298 176.060 176.519 -0.268 0.000 1.225 685 W CA 1.193 58.314 57.345 -0.374 0.000 1.271 685 W CB -0.959 28.340 29.460 -0.268 0.000 1.114 685 W HN -0.234 7.377 8.180 -0.947 0.000 0.559 686 G N -4.148 104.028 108.800 -1.039 0.000 2.539 686 G HA2 -0.161 3.703 3.960 -0.161 0.000 0.215 686 G HA3 -0.161 3.333 3.960 -0.777 0.000 0.215 686 G C -1.147 173.599 174.900 -0.257 0.000 1.141 686 G CA -0.003 44.754 45.100 -0.573 0.000 0.806 686 G HN 0.195 7.133 8.290 -2.217 0.022 0.533 687 T N -3.944 110.332 114.554 -0.463 0.000 2.827 687 T HA -0.015 4.203 4.350 -0.220 0.000 0.328 687 T C -1.589 172.961 174.700 -0.250 0.000 1.598 687 T CA -0.880 61.048 62.100 -0.287 0.000 1.043 687 T CB 2.120 70.815 68.868 -0.288 0.000 1.447 687 T HN -1.014 6.668 8.240 -0.930 0.000 0.491 688 R N 2.166 122.622 120.500 -0.073 0.000 2.161 688 R HA -0.077 4.344 4.340 0.134 0.000 0.213 688 R C -1.053 175.412 176.300 0.274 0.000 1.055 688 R CA 0.798 56.980 56.100 0.136 0.000 0.996 688 R CB 0.886 31.314 30.300 0.214 0.000 0.901 688 R HN 0.576 8.788 8.270 -0.097 0.000 0.456 689 F N -9.247 110.701 119.950 -0.004 0.000 2.703 689 F HA 0.451 5.164 4.527 0.042 -0.161 0.308 689 F C -2.514 173.268 175.800 -0.030 0.000 1.126 689 F CA -2.133 55.879 58.000 0.021 0.000 0.959 689 F CB 1.753 40.787 39.000 0.057 0.000 1.297 689 F HN -0.912 7.301 8.300 -0.145 0.000 0.441 690 S N 1.160 116.773 115.700 -0.146 0.000 2.673 690 S HA 0.310 nan 4.470 nan 0.000 0.256 690 S C -2.304 172.254 174.600 -0.069 0.000 1.141 690 S CA -0.498 57.553 58.200 -0.247 0.000 1.109 690 S CB 1.391 64.447 63.200 -0.241 0.000 1.101 690 S HN 0.605 8.973 8.310 0.098 0.000 0.471 691 D N 6.389 126.854 120.400 0.109 0.000 2.506 691 D HA 0.136 4.823 4.640 0.079 0.000 0.272 691 D C 1.270 177.598 176.300 0.046 0.000 1.214 691 D CA -1.087 52.999 54.000 0.145 0.000 1.067 691 D CB 0.998 41.977 40.800 0.298 0.000 1.117 691 D HN 0.019 8.496 8.370 0.178 0.000 0.578 692 E N -0.424 119.859 120.200 0.139 0.000 2.085 692 E HA -0.377 4.091 4.350 0.198 0.000 0.194 692 E C 2.614 179.104 176.600 -0.185 0.000 0.994 692 E CA 4.344 60.845 56.400 0.167 0.000 0.801 692 E CB -0.214 29.756 29.700 0.450 0.000 0.743 692 E HN 0.309 8.830 8.360 0.268 0.000 0.453 693 R N -0.763 119.399 120.500 -0.564 0.000 2.066 693 R HA -0.332 2.576 4.340 -2.386 0.000 0.232 693 R C 1.774 177.778 176.300 -0.494 0.000 1.131 693 R CA 3.202 58.566 56.100 -1.225 0.000 0.955 693 R CB -0.332 29.337 30.300 -1.053 0.000 0.851 693 R HN 0.112 8.232 8.270 -0.229 0.012 0.432 694 K N -0.685 119.603 120.400 -0.186 0.000 2.026 694 K HA -0.287 4.017 4.320 -0.026 0.000 0.208 694 K C 2.469 179.122 176.600 0.087 0.000 1.048 694 K CA 3.036 59.298 56.287 -0.042 0.000 0.929 694 K CB -0.247 32.186 32.500 -0.111 0.000 0.713 694 K HN -0.318 8.158 8.250 -0.128 -0.303 0.439 695 V N -1.300 118.654 119.914 0.068 0.000 2.332 695 V HA -0.437 3.818 4.120 0.226 0.000 0.248 695 V C 2.322 178.571 176.094 0.258 0.000 1.055 695 V CA 4.354 66.751 62.300 0.162 0.000 1.038 695 V CB -0.223 31.668 31.823 0.113 0.000 0.651 695 V HN -0.342 7.846 8.190 -0.003 0.000 0.450 696 F N 0.748 120.715 119.950 0.028 0.000 2.171 696 F HA -0.286 4.307 4.527 0.109 0.000 0.300 696 F C 1.000 176.908 175.800 0.181 0.000 1.090 696 F CA 3.099 61.143 58.000 0.073 0.000 1.293 696 F CB 0.281 39.289 39.000 0.014 0.000 1.013 696 F HN -0.172 8.240 8.300 0.188 0.000 0.486 697 S N -1.367 114.513 115.700 0.300 0.000 2.561 697 S HA -0.198 nan 4.470 nan 0.000 0.225 697 S C 0.220 175.005 174.600 0.307 0.000 0.977 697 S CA 0.695 59.004 58.200 0.182 0.000 0.926 697 S CB -0.700 62.521 63.200 0.035 0.000 0.769 697 S HN -0.359 7.965 8.310 0.214 0.115 0.533 698 F N 5.120 125.139 119.950 0.116 0.000 2.543 698 F HA -0.011 4.633 4.527 -0.120 -0.189 0.375 698 F C -1.739 174.075 175.800 0.023 0.000 1.075 698 F CA -1.573 56.399 58.000 -0.046 0.000 1.225 698 F CB 0.888 39.836 39.000 -0.087 0.000 1.099 698 F HN -0.938 7.444 8.300 0.414 0.167 0.561 699 A N 7.351 129.974 122.820 -0.328 0.000 2.540 699 A HA 0.573 4.644 4.320 -0.414 0.000 0.340 699 A C -2.228 174.919 177.584 -0.728 0.000 1.424 699 A CA -4.092 47.710 52.037 -0.392 0.000 0.940 699 A CB 0.535 19.453 19.000 -0.135 0.000 1.149 699 A HN 0.083 8.434 8.150 -0.192 -0.317 0.505 700 P HA -0.029 3.703 4.420 -1.147 0.000 0.231 700 P C -0.980 176.233 177.300 -0.144 0.000 1.168 700 P CA 1.109 63.799 63.100 -0.684 0.000 0.779 700 P CB 0.320 31.779 31.700 -0.401 0.000 0.844 701 D N -2.189 118.208 120.400 -0.005 0.000 2.369 701 D HA 0.093 5.012 4.640 0.465 0.000 0.211 701 D C -1.418 175.008 176.300 0.211 0.000 1.077 701 D CA 0.039 54.191 54.000 0.254 0.000 0.842 701 D CB 1.022 41.972 40.800 0.250 0.000 0.947 701 D HN 0.141 8.400 8.370 -0.113 0.043 0.509 702 N N -0.984 117.710 118.700 -0.009 0.000 2.726 702 N HA 0.166 4.950 4.740 0.074 0.000 0.253 702 N C 0.583 176.025 175.510 -0.113 0.000 1.530 702 N CA -0.647 52.406 53.050 0.005 0.000 0.772 702 N CB -0.264 38.249 38.487 0.044 0.000 1.220 702 N HN -0.875 7.390 8.380 -0.108 0.050 0.508 703 M N 1.443 120.952 119.600 -0.151 0.000 2.144 703 M HA -0.119 4.318 4.480 -0.071 0.000 0.260 703 M C -0.267 176.031 176.300 -0.004 0.000 1.067 703 M CA 5.495 60.757 55.300 -0.063 0.000 1.095 703 M CB -2.436 30.145 32.600 -0.032 0.000 1.365 703 M HN 0.493 8.617 8.290 -0.277 0.000 0.406 704 P HA -0.226 4.110 4.420 -0.140 0.000 0.218 704 P C 1.230 178.202 177.300 -0.547 0.000 1.148 704 P CA 2.728 65.724 63.100 -0.172 0.000 0.822 704 P CB -0.857 30.826 31.700 -0.027 0.000 0.784 705 Q N -2.946 116.340 119.800 -0.857 0.000 2.291 705 Q HA -0.373 2.645 4.340 -2.204 0.000 0.205 705 Q C 1.440 177.168 176.000 -0.453 0.000 0.970 705 Q CA 2.919 58.022 55.803 -1.167 0.000 0.876 705 Q CB -0.933 27.323 28.738 -0.804 0.000 0.935 705 Q HN -0.140 7.768 8.270 -0.559 0.026 0.455 706 N N 0.758 119.343 118.700 -0.193 0.000 2.519 706 N HA -0.219 4.559 4.740 0.063 0.000 0.186 706 N C 1.625 177.124 175.510 -0.018 0.000 1.062 706 N CA 2.810 55.877 53.050 0.028 0.000 0.910 706 N CB -0.239 38.353 38.487 0.175 0.000 0.958 706 N HN -0.438 7.797 8.380 -0.180 0.037 0.445 707 A N 0.150 122.812 122.820 -0.263 0.000 2.015 707 A HA -0.221 3.221 4.320 -1.464 0.000 0.219 707 A C 0.270 177.606 177.584 -0.413 0.000 1.163 707 A CA 2.496 54.094 52.037 -0.732 0.000 0.646 707 A CB -0.323 18.340 19.000 -0.561 0.000 0.806 707 A HN -0.325 7.623 8.150 -0.245 0.054 0.448 708 E N -6.907 113.185 120.200 -0.181 0.000 2.385 708 E HA -0.076 4.196 4.350 -0.129 0.000 0.194 708 E C 0.709 177.291 176.600 -0.029 0.000 1.013 708 E CA 0.917 57.266 56.400 -0.086 0.000 0.866 708 E CB 0.785 30.505 29.700 0.034 0.000 0.832 708 E HN -0.385 7.734 8.360 -0.177 0.134 0.500 709 T N -4.780 109.774 114.554 -0.000 0.000 3.084 709 T HA 0.163 4.539 4.350 0.043 0.000 0.270 709 T C -0.585 174.182 174.700 0.112 0.000 1.008 709 T CA -0.775 61.354 62.100 0.050 0.000 0.900 709 T CB 1.610 70.498 68.868 0.033 0.000 1.084 709 T HN -0.477 7.577 8.240 -0.026 0.171 0.538 710 S N -0.401 115.387 115.700 0.148 0.000 2.625 710 S HA 0.386 4.956 4.470 0.166 0.000 0.271 710 S C -2.159 172.588 174.600 0.244 0.000 1.161 710 S CA -0.887 57.445 58.200 0.221 0.000 0.820 710 S CB 2.350 65.786 63.200 0.394 0.000 1.137 710 S HN -0.717 7.640 8.310 0.077 0.000 0.470 711 V N -3.937 116.104 119.914 0.212 0.000 3.046 711 V HA 0.621 4.997 4.120 0.305 -0.074 0.316 711 V C -1.549 174.625 176.094 0.133 0.000 1.104 711 V CA -2.777 59.639 62.300 0.193 0.000 1.006 711 V CB 3.218 35.042 31.823 0.002 0.000 1.058 711 V HN -0.114 8.151 8.190 0.125 0.000 0.440 712 D N 0.513 120.922 120.400 0.014 0.000 2.356 712 D HA 0.040 4.269 4.640 -0.684 0.000 0.258 712 D C 1.866 177.880 176.300 -0.476 0.000 1.279 712 D CA -0.794 52.906 54.000 -0.501 0.000 1.016 712 D CB 1.285 41.625 40.800 -0.768 0.000 1.107 712 D HN 0.205 8.653 8.370 0.130 0.000 0.544 713 R N -3.704 116.352 120.500 -0.740 0.000 2.237 713 R HA -0.230 3.947 4.340 -0.271 0.000 0.219 713 R C -0.069 176.106 176.300 -0.208 0.000 1.080 713 R CA 2.169 58.049 56.100 -0.366 0.000 0.995 713 R CB -0.220 29.913 30.300 -0.279 0.000 0.875 713 R HN 0.314 7.735 8.270 -1.415 0.000 0.462 714 D N -2.636 117.632 120.400 -0.220 0.000 2.424 714 D HA 0.240 4.824 4.640 -0.094 0.000 0.220 714 D C -0.311 175.943 176.300 -0.076 0.000 1.150 714 D CA -0.470 53.450 54.000 -0.133 0.000 0.831 714 D CB 0.827 41.537 40.800 -0.150 0.000 0.981 714 D HN -0.462 7.930 8.370 -0.312 -0.210 0.500 715 G N -1.294 107.465 108.800 -0.069 0.000 2.148 715 G HA2 -0.522 3.435 3.960 -0.007 0.000 0.254 715 G HA3 -0.522 3.438 3.960 -0.002 0.000 0.254 715 G C -0.781 174.065 174.900 -0.091 0.000 0.981 715 G CA 0.722 45.801 45.100 -0.034 0.000 0.670 715 G HN -0.019 8.041 8.290 -0.110 0.164 0.528 716 N N -0.345 118.302 118.700 -0.089 0.000 2.515 716 N HA 0.129 4.810 4.740 -0.098 0.000 0.279 716 N C -0.470 175.028 175.510 -0.020 0.000 1.164 716 N CA -0.424 52.583 53.050 -0.071 0.000 0.982 716 N CB 1.419 39.896 38.487 -0.015 0.000 1.170 716 N HN -0.191 8.418 8.380 -0.102 -0.290 0.474 717 H N 0.142 119.271 119.070 0.098 0.000 2.690 717 H HA -0.037 4.584 4.556 0.107 0.000 0.365 717 H C -0.191 175.254 175.328 0.195 0.000 1.142 717 H CA 1.399 57.498 56.048 0.086 0.000 1.417 717 H CB 0.772 30.537 29.762 0.005 0.000 1.446 717 H HN 0.202 8.442 8.280 -0.067 0.000 0.599 718 F N -2.321 117.755 119.950 0.209 0.000 2.675 718 F HA 0.336 4.943 4.527 0.132 0.000 0.324 718 F C -2.767 173.090 175.800 0.094 0.000 1.106 718 F CA -2.271 55.818 58.000 0.149 0.000 0.970 718 F CB 1.752 40.867 39.000 0.193 0.000 1.385 718 F HN 0.165 8.393 8.300 -0.121 0.000 0.489 719 N N 0.034 118.846 118.700 0.187 0.000 2.335 719 N HA 0.499 5.284 4.740 -0.090 -0.099 0.304 719 N C -1.238 174.227 175.510 -0.075 0.000 1.135 719 N CA -0.811 52.245 53.050 0.011 0.000 0.817 719 N CB 3.291 41.792 38.487 0.024 0.000 1.294 719 N HN -0.052 8.548 8.380 0.367 0.000 0.497 720 A N 0.415 123.063 122.820 -0.287 0.000 2.517 720 A HA 0.266 3.689 4.320 -1.495 0.000 0.297 720 A C -2.928 174.405 177.584 -0.418 0.000 1.050 720 A CA -0.352 51.167 52.037 -0.864 0.000 0.694 720 A CB 3.335 21.747 19.000 -0.980 0.000 1.277 720 A HN 1.033 9.090 8.150 -0.155 0.000 0.400 721 K N 2.237 122.410 120.400 -0.379 0.000 2.562 721 K HA 0.465 4.887 4.320 -0.034 -0.122 0.267 721 K C -1.981 174.733 176.600 0.190 0.000 0.938 721 K CA -0.582 55.684 56.287 -0.035 0.000 0.840 721 K CB 3.291 35.785 32.500 -0.010 0.000 1.390 721 K HN 0.186 8.036 8.250 -0.667 0.000 0.428 722 S N 1.785 117.586 115.700 0.168 0.000 2.540 722 S HA 0.312 4.916 4.470 0.224 0.000 0.275 722 S C -0.978 173.716 174.600 0.157 0.000 1.123 722 S CA -1.170 57.173 58.200 0.238 0.000 0.907 722 S CB 2.158 65.562 63.200 0.341 0.000 1.081 722 S HN 0.268 8.615 8.310 0.062 0.000 0.476 723 D N 5.990 126.480 120.400 0.149 0.000 2.369 723 D HA 0.182 4.941 4.640 0.072 -0.076 0.211 723 D C -0.337 176.057 176.300 0.157 0.000 1.077 723 D CA 0.399 54.466 54.000 0.112 0.000 0.842 723 D CB 1.041 41.886 40.800 0.076 0.000 0.947 723 D HN 0.471 8.932 8.370 0.152 0.000 0.509 724 K N 0.727 121.253 120.400 0.210 0.000 2.118 724 K HA 0.301 4.715 4.320 0.156 0.000 0.264 724 K C -2.305 174.460 176.600 0.275 0.000 1.000 724 K CA -2.204 54.199 56.287 0.194 0.000 0.929 724 K CB -0.032 32.558 32.500 0.150 0.000 1.021 724 K HN -0.674 7.649 8.250 0.228 0.064 0.463 725 P HA -0.135 4.440 4.420 0.257 0.000 0.268 725 P C -1.871 175.535 177.300 0.177 0.000 1.205 725 P CA -0.326 62.890 63.100 0.195 0.000 0.771 725 P CB 0.581 32.349 31.700 0.112 0.000 0.858 726 W N 3.117 124.298 121.300 -0.199 0.000 2.631 726 W HA 0.322 4.801 4.660 -0.302 0.000 0.321 726 W C -1.443 174.956 176.519 -0.200 0.000 1.004 726 W CA -3.273 53.842 57.345 -0.384 0.000 1.291 726 W CB 2.023 30.843 29.460 -1.067 0.000 1.300 726 W HN -0.138 8.151 8.180 0.181 0.000 0.422 727 P HA 0.031 4.260 4.420 -0.318 0.000 0.231 727 P C -1.499 175.350 177.300 -0.752 0.000 1.168 727 P CA 0.327 63.122 63.100 -0.508 0.000 0.779 727 P CB 0.972 32.467 31.700 -0.342 0.000 0.844 728 G N -2.672 105.189 108.800 -1.564 0.000 2.459 728 G HA2 -0.246 3.031 3.960 -1.352 0.000 0.685 728 G HA3 -0.246 3.343 3.960 -0.618 0.000 0.685 728 G C -2.251 172.093 174.900 -0.928 0.000 1.303 728 G CA -0.900 43.474 45.100 -1.210 0.000 0.907 728 G HN -0.640 6.103 8.290 -2.510 0.042 0.632 729 A N -0.188 122.483 122.820 -0.248 0.000 2.322 729 A HA 0.025 4.305 4.320 -0.066 0.000 0.269 729 A C -1.556 175.996 177.584 -0.052 0.000 1.094 729 A CA -0.396 51.612 52.037 -0.049 0.000 0.807 729 A CB 1.462 20.476 19.000 0.024 0.000 1.047 729 A HN 0.282 8.836 8.150 0.036 -0.383 0.487 730 Y N 2.806 122.976 120.300 -0.218 0.000 2.397 730 Y HA -0.155 4.368 4.550 -0.045 0.000 0.292 730 Y C -1.421 174.308 175.900 -0.285 0.000 1.115 730 Y CA 2.156 60.160 58.100 -0.160 0.000 1.208 730 Y CB 2.653 41.033 38.460 -0.134 0.000 1.046 730 Y HN -0.118 8.170 8.280 0.012 0.000 0.552 731 G N -5.930 102.445 108.800 -0.709 0.000 2.548 731 G HA2 0.303 3.639 3.960 -1.094 0.000 0.301 731 G HA3 0.303 4.075 3.960 -0.397 -0.051 0.301 731 G C -3.536 170.959 174.900 -0.675 0.000 1.349 731 G CA 0.104 44.729 45.100 -0.792 0.000 0.792 731 G HN -0.747 7.248 8.290 -0.492 0.000 0.481 732 L N -1.388 119.688 121.223 -0.244 0.000 2.431 732 L HA 0.784 5.277 4.340 -0.007 -0.157 0.266 732 L C -2.789 174.204 176.870 0.204 0.000 0.978 732 L CA -0.844 54.001 54.840 0.008 0.000 0.822 732 L CB 4.553 46.679 42.059 0.112 0.000 1.310 732 L HN 0.131 8.343 8.230 -0.031 0.000 0.409 733 S N 4.191 120.018 115.700 0.213 0.000 2.547 733 S HA 0.614 5.446 4.470 0.268 -0.201 0.281 733 S C -2.305 172.401 174.600 0.177 0.000 1.118 733 S CA -1.758 56.587 58.200 0.241 0.000 0.947 733 S CB 2.132 65.497 63.200 0.276 0.000 1.053 733 S HN 0.449 8.876 8.310 0.195 0.000 0.482 734 A N 4.864 127.759 122.820 0.126 0.000 2.318 734 A HA 0.825 5.356 4.320 0.042 -0.186 0.324 734 A C -1.734 175.822 177.584 -0.046 0.000 1.170 734 A CA -2.150 49.913 52.037 0.044 0.000 0.810 734 A CB 2.784 21.801 19.000 0.029 0.000 1.198 734 A HN 0.543 8.779 8.150 0.142 0.000 0.484 735 Q N 2.633 122.313 119.800 -0.200 0.000 2.293 735 Q HA 0.327 4.556 4.340 -0.185 0.000 0.261 735 Q C -1.557 174.223 176.000 -0.368 0.000 0.960 735 Q CA -1.808 53.754 55.803 -0.402 0.000 0.882 735 Q CB 2.670 30.774 28.738 -1.057 0.000 1.275 735 Q HN 0.586 8.749 8.270 -0.179 0.000 0.445 736 L N 3.276 124.364 121.223 -0.225 0.000 2.313 736 L HA 0.461 4.678 4.340 -0.205 0.000 0.273 736 L C -2.230 174.495 176.870 -0.242 0.000 1.028 736 L CA -1.021 53.689 54.840 -0.217 0.000 0.871 736 L CB 1.285 43.240 42.059 -0.173 0.000 1.242 736 L HN 0.540 8.628 8.230 -0.044 0.115 0.434 737 W N 4.502 125.705 121.300 -0.161 0.000 2.251 737 W HA -0.089 4.526 4.660 -0.075 0.000 0.329 737 W C -0.757 175.666 176.519 -0.159 0.000 1.234 737 W CA 0.151 57.399 57.345 -0.161 0.000 1.228 737 W CB 0.783 30.080 29.460 -0.271 0.000 1.135 737 W HN -0.213 7.903 8.180 -0.108 0.000 0.576 738 S N -0.637 115.119 115.700 0.094 0.000 2.602 738 S HA 0.115 4.590 4.470 0.009 0.000 0.240 738 S C 1.612 176.103 174.600 -0.182 0.000 0.992 738 S CA -0.502 57.706 58.200 0.014 0.000 0.971 738 S CB 0.082 63.375 63.200 0.155 0.000 0.855 738 S HN 0.508 9.307 8.310 0.167 -0.389 0.481 739 E N 1.695 121.679 120.200 -0.359 0.000 2.065 739 E HA -0.363 3.341 4.350 -1.077 0.000 0.201 739 E C 0.665 176.999 176.600 -0.443 0.000 1.016 739 E CA 3.878 59.867 56.400 -0.686 0.000 0.818 739 E CB -0.222 29.084 29.700 -0.657 0.000 0.749 739 E HN 0.409 8.613 8.360 -0.261 0.000 0.453 740 T N -9.044 105.365 114.554 -0.242 0.000 3.092 740 T HA -0.009 4.349 4.350 0.013 0.000 0.258 740 T C -0.588 174.115 174.700 0.006 0.000 1.031 740 T CA -0.515 61.564 62.100 -0.035 0.000 0.925 740 T CB -0.345 68.565 68.868 0.071 0.000 1.036 740 T HN -0.059 8.000 8.240 -0.303 0.000 0.544 741 Q N 2.600 122.399 119.800 -0.000 0.000 2.810 741 Q HA 0.275 4.662 4.340 0.078 0.000 0.236 741 Q C -0.614 175.483 176.000 0.163 0.000 1.278 741 Q CA -0.972 54.884 55.803 0.088 0.000 1.065 741 Q CB -1.571 27.218 28.738 0.085 0.000 1.364 741 Q HN -0.605 7.443 8.270 -0.060 0.186 0.570 742 R N 0.452 121.014 120.500 0.103 0.000 2.193 742 R HA -0.176 4.180 4.340 0.027 0.000 0.213 742 R C -0.148 176.234 176.300 0.136 0.000 1.055 742 R CA 1.866 58.009 56.100 0.072 0.000 0.995 742 R CB 0.857 31.176 30.300 0.032 0.000 0.893 742 R HN 0.209 8.719 8.270 0.081 -0.191 0.459 743 T N -5.417 109.247 114.554 0.183 0.000 2.930 743 T HA 0.285 4.752 4.350 0.194 0.000 0.290 743 T C -0.592 174.260 174.700 0.253 0.000 1.052 743 T CA -2.570 59.645 62.100 0.192 0.000 1.017 743 T CB 3.117 72.058 68.868 0.123 0.000 1.137 743 T HN -0.699 7.797 8.240 0.165 -0.156 0.511 744 D N 0.964 121.498 120.400 0.223 0.000 2.117 744 D HA 0.039 4.770 4.640 0.152 0.000 0.198 744 D C 0.166 176.516 176.300 0.084 0.000 0.982 744 D CA 4.534 58.632 54.000 0.163 0.000 0.828 744 D CB -2.302 38.579 40.800 0.136 0.000 0.967 744 D HN 0.447 8.930 8.370 0.188 0.000 0.464 745 P HA -0.108 4.361 4.420 0.083 0.000 0.218 745 P C 1.451 178.813 177.300 0.103 0.000 1.149 745 P CA 2.392 65.540 63.100 0.080 0.000 0.817 745 P CB -0.049 31.685 31.700 0.056 0.000 0.785 746 Q N -3.296 116.552 119.800 0.081 0.000 2.119 746 Q HA -0.347 4.015 4.340 0.036 0.000 0.201 746 Q C 2.256 178.322 176.000 0.111 0.000 0.972 746 Q CA 3.384 59.228 55.803 0.069 0.000 0.847 746 Q CB -0.278 28.488 28.738 0.046 0.000 0.903 746 Q HN -0.519 7.701 8.270 0.085 0.101 0.433 747 M N 1.384 121.002 119.600 0.030 0.000 2.086 747 M HA -0.488 3.954 4.480 -0.064 0.000 0.261 747 M C 1.640 177.970 176.300 0.050 0.000 1.067 747 M CA 4.161 59.414 55.300 -0.079 0.000 1.116 747 M CB -0.024 32.313 32.600 -0.438 0.000 1.348 747 M HN -0.415 7.892 8.290 0.029 0.000 0.407 748 E N -1.018 119.259 120.200 0.129 0.000 2.077 748 E HA -0.431 4.126 4.350 0.346 0.000 0.193 748 E C 2.146 178.958 176.600 0.353 0.000 0.989 748 E CA 2.973 59.544 56.400 0.285 0.000 0.800 748 E CB -0.190 29.651 29.700 0.235 0.000 0.746 748 E HN -0.150 8.264 8.360 0.089 0.000 0.452 749 Y N 1.267 121.658 120.300 0.152 0.000 2.165 749 Y HA -0.365 4.430 4.550 0.139 -0.161 0.286 749 Y C 1.861 177.907 175.900 0.244 0.000 1.155 749 Y CA 3.490 61.678 58.100 0.148 0.000 1.164 749 Y CB 0.192 38.698 38.460 0.077 0.000 0.978 749 Y HN 0.097 8.584 8.280 0.345 0.000 0.513 750 M N -3.362 116.504 119.600 0.444 0.000 2.288 750 M HA -0.288 4.533 4.480 0.569 0.000 0.266 750 M C 2.407 178.790 176.300 0.138 0.000 1.072 750 M CA 1.652 57.173 55.300 0.367 0.000 1.132 750 M CB -0.498 32.245 32.600 0.238 0.000 1.386 750 M HN -0.662 7.745 8.290 0.381 0.111 0.432 751 I N -1.352 119.222 120.570 0.007 0.000 2.400 751 I HA -0.215 3.794 4.170 -0.270 0.000 0.248 751 I C -0.498 175.395 176.117 -0.373 0.000 1.109 751 I CA 3.377 64.502 61.300 -0.291 0.000 1.425 751 I CB 0.941 38.603 38.000 -0.564 0.000 1.094 751 I HN -0.428 7.824 8.210 0.070 0.000 0.425 752 F N -3.671 116.374 119.950 0.158 0.000 2.469 752 F HA 0.401 5.051 4.527 0.124 -0.049 0.332 752 F C -2.447 173.479 175.800 0.209 0.000 1.103 752 F CA -2.201 55.892 58.000 0.155 0.000 0.979 752 F CB 1.214 40.301 39.000 0.145 0.000 1.137 752 F HN -0.283 8.138 8.300 0.201 0.000 0.463 753 P HA 0.288 4.922 4.420 0.357 0.000 0.268 753 P C -0.026 177.413 177.300 0.232 0.000 1.329 753 P CA 0.005 63.269 63.100 0.274 0.000 0.899 753 P CB -0.358 31.395 31.700 0.088 0.000 1.378 754 R N -0.212 120.421 120.500 0.222 0.000 2.237 754 R HA -0.211 4.258 4.340 0.215 0.000 0.219 754 R C 1.148 177.488 176.300 0.067 0.000 1.080 754 R CA 2.769 58.950 56.100 0.134 0.000 0.995 754 R CB -1.479 28.815 30.300 -0.011 0.000 0.875 754 R HN -0.657 7.735 8.270 0.298 0.056 0.462 755 A N -0.139 122.662 122.820 -0.032 0.000 2.121 755 A HA -0.138 4.181 4.320 -0.001 0.000 0.218 755 A C 1.745 179.368 177.584 0.066 0.000 1.154 755 A CA 2.483 54.488 52.037 -0.054 0.000 0.679 755 A CB -0.780 18.056 19.000 -0.275 0.000 0.795 755 A HN 0.284 8.348 8.150 -0.098 0.028 0.458 756 L N -2.509 118.768 121.223 0.090 0.000 2.141 756 L HA -0.329 3.962 4.340 -0.082 0.000 0.209 756 L C 1.962 179.038 176.870 0.343 0.000 1.094 756 L CA 3.181 58.057 54.840 0.061 0.000 0.763 756 L CB -0.486 41.495 42.059 -0.131 0.000 0.908 756 L HN 0.099 8.252 8.230 0.113 0.145 0.437 757 S N 0.348 116.283 115.700 0.391 0.000 2.383 757 S HA -0.327 4.347 4.470 0.341 0.000 0.227 757 S C 2.010 176.739 174.600 0.214 0.000 1.026 757 S CA 3.428 61.844 58.200 0.360 0.000 0.981 757 S CB -0.338 63.102 63.200 0.399 0.000 0.818 757 S HN -0.665 7.762 8.310 0.339 0.087 0.472 758 V N 2.459 122.487 119.914 0.189 0.000 2.295 758 V HA -0.473 3.762 4.120 0.192 0.000 0.246 758 V C 1.228 177.438 176.094 0.193 0.000 1.049 758 V CA 4.430 66.836 62.300 0.178 0.000 1.024 758 V CB -0.335 31.573 31.823 0.140 0.000 0.648 758 V HN -0.769 7.445 8.190 0.174 0.081 0.447 759 A N -0.928 122.011 122.820 0.199 0.000 1.908 759 A HA -0.287 4.179 4.320 0.243 0.000 0.218 759 A C 2.130 179.862 177.584 0.247 0.000 1.181 759 A CA 2.932 55.107 52.037 0.231 0.000 0.627 759 A CB -0.703 18.445 19.000 0.247 0.000 0.818 759 A HN -0.151 8.107 8.150 0.181 0.000 0.445 760 E N -1.123 119.205 120.200 0.214 0.000 2.031 760 E HA -0.324 4.162 4.350 0.227 0.000 0.193 760 E C 2.118 178.789 176.600 0.118 0.000 0.994 760 E CA 2.740 59.233 56.400 0.155 0.000 0.800 760 E CB -0.080 29.564 29.700 -0.093 0.000 0.752 760 E HN -0.472 8.015 8.360 0.223 0.006 0.447 761 R N -0.888 119.638 120.500 0.042 0.000 2.148 761 R HA -0.167 4.113 4.340 -0.099 0.000 0.227 761 R C 2.244 178.606 176.300 0.104 0.000 1.103 761 R CA 1.714 57.816 56.100 0.003 0.000 0.983 761 R CB -0.275 30.034 30.300 0.015 0.000 0.874 761 R HN -0.291 8.011 8.270 0.055 0.000 0.451 762 S N -1.617 114.213 115.700 0.217 0.000 2.461 762 S HA -0.154 4.555 4.470 0.397 0.000 0.228 762 S C 1.524 176.269 174.600 0.243 0.000 1.005 762 S CA 2.460 60.853 58.200 0.322 0.000 0.942 762 S CB 0.264 63.661 63.200 0.330 0.000 0.776 762 S HN 0.202 8.625 8.310 0.217 0.018 0.514 763 W N 2.658 123.982 121.300 0.040 0.000 2.644 763 W HA -0.034 4.608 4.660 -0.029 0.000 0.279 763 W C -1.109 175.382 176.519 -0.047 0.000 1.164 763 W CA 1.290 58.632 57.345 -0.006 0.000 1.457 763 W CB 2.408 31.884 29.460 0.026 0.000 1.087 763 W HN -0.835 7.424 8.180 0.352 0.132 0.573 764 H N -0.492 118.631 119.070 0.088 0.000 2.481 764 H HA 0.296 4.798 4.556 -0.090 0.000 0.333 764 H C -1.794 173.399 175.328 -0.224 0.000 1.066 764 H CA -1.210 54.816 56.048 -0.036 0.000 1.209 764 H CB 2.571 32.398 29.762 0.110 0.000 1.445 764 H HN 0.376 8.745 8.280 0.325 0.106 0.488 765 R N 8.933 128.995 120.500 -0.729 0.000 2.210 765 R HA -0.023 4.063 4.340 -0.673 -0.150 0.338 765 R C -1.053 174.601 176.300 -1.076 0.000 1.062 765 R CA -0.613 55.022 56.100 -0.775 0.000 0.902 765 R CB 0.043 30.002 30.300 -0.569 0.000 1.050 765 R HN 0.378 8.293 8.270 -0.592 0.000 0.461 766 A N 7.388 129.601 122.820 -1.011 0.000 2.313 766 A HA 0.264 4.164 4.320 -0.700 0.000 0.261 766 A C 1.050 178.197 177.584 -0.728 0.000 1.090 766 A CA -1.005 50.488 52.037 -0.907 0.000 0.807 766 A CB 1.775 20.014 19.000 -1.269 0.000 1.055 766 A HN 0.521 8.486 8.150 -0.969 -0.397 0.492 767 G N -0.013 108.548 108.800 -0.398 0.000 2.448 767 G HA2 -0.197 3.659 3.960 -0.173 0.000 0.219 767 G HA3 -0.197 3.741 3.960 -0.037 0.000 0.219 767 G C 0.210 175.036 174.900 -0.123 0.000 1.127 767 G CA 1.401 46.395 45.100 -0.177 0.000 0.766 767 G HN 0.567 8.719 8.290 -0.230 0.000 0.552 768 W N -4.479 116.833 121.300 0.021 0.000 3.256 768 W HA 0.160 4.848 4.660 0.048 0.000 0.269 768 W C -0.705 175.815 176.519 0.002 0.000 1.310 768 W CA -2.648 54.718 57.345 0.035 0.000 1.673 768 W CB -0.700 28.804 29.460 0.072 0.000 1.115 768 W HN -0.563 7.158 8.180 -0.729 0.022 0.686 769 E N 2.233 122.140 120.200 -0.489 0.000 1.996 769 E HA 0.023 4.274 4.350 -0.166 0.000 0.280 769 E C -0.642 175.863 176.600 -0.158 0.000 1.092 769 E CA -0.587 55.592 56.400 -0.367 0.000 0.862 769 E CB -0.173 29.166 29.700 -0.601 0.000 1.066 769 E HN -0.559 7.127 8.360 -0.815 0.186 0.396 770 Q N 5.272 125.059 119.800 -0.021 0.000 2.368 770 Q HA -0.033 4.311 4.340 0.007 0.000 0.237 770 Q C -0.929 175.084 176.000 0.021 0.000 0.987 770 Q CA 0.083 55.898 55.803 0.021 0.000 0.896 770 Q CB 1.075 29.871 28.738 0.096 0.000 1.241 770 Q HN 0.083 8.677 8.270 0.029 -0.306 0.485 771 D N -0.099 120.321 120.400 0.033 0.000 2.414 771 D HA -0.066 4.640 4.640 0.109 0.000 0.242 771 D C 0.018 176.390 176.300 0.119 0.000 1.129 771 D CA 0.195 54.241 54.000 0.076 0.000 0.885 771 D CB 0.642 41.477 40.800 0.058 0.000 1.198 771 D HN 0.007 8.391 8.370 0.022 0.000 0.437 772 Y N 2.735 123.085 120.300 0.083 0.000 2.610 772 Y HA -0.299 4.475 4.550 0.070 -0.181 0.332 772 Y C -0.343 175.601 175.900 0.074 0.000 1.201 772 Y CA 1.809 59.970 58.100 0.101 0.000 1.465 772 Y CB 0.661 39.257 38.460 0.227 0.000 1.283 772 Y HN -0.007 8.479 8.280 0.343 0.000 0.563 773 R N 8.157 128.278 120.500 -0.631 0.000 2.500 773 R HA 0.205 4.383 4.340 -0.270 0.000 0.299 773 R C -1.553 174.343 176.300 -0.674 0.000 1.038 773 R CA -1.114 54.706 56.100 -0.465 0.000 0.903 773 R CB 2.931 33.055 30.300 -0.294 0.000 1.177 773 R HN 0.481 8.244 8.270 -0.846 0.000 0.455 774 A N 4.144 126.719 122.820 -0.408 0.000 2.546 774 A HA -0.155 4.217 4.320 -0.220 -0.184 0.243 774 A C 1.132 178.625 177.584 -0.151 0.000 1.063 774 A CA 0.844 52.772 52.037 -0.183 0.000 0.757 774 A CB -0.081 18.968 19.000 0.082 0.000 0.991 774 A HN 0.558 8.603 8.150 -0.175 0.000 0.503 775 G N 3.854 112.583 108.800 -0.118 0.000 2.199 775 G HA2 -0.492 3.614 3.960 -0.053 0.000 0.254 775 G HA3 -0.492 3.422 3.960 -0.078 0.000 0.254 775 G C -0.984 173.819 174.900 -0.162 0.000 0.982 775 G CA -0.276 44.767 45.100 -0.096 0.000 0.632 775 G HN 0.836 8.950 8.290 -0.088 0.123 0.529 776 R N 2.239 122.575 120.500 -0.274 0.000 2.389 776 R HA -0.064 4.068 4.340 -0.348 0.000 0.295 776 R C -1.767 174.320 176.300 -0.354 0.000 1.075 776 R CA 0.233 56.077 56.100 -0.427 0.000 1.005 776 R CB 1.027 30.905 30.300 -0.704 0.000 0.987 776 R HN -0.416 7.590 8.270 -0.311 0.078 0.452 777 E N 6.125 126.127 120.200 -0.331 0.000 2.129 777 E HA 0.383 4.810 4.350 -0.126 -0.152 0.268 777 E C -1.096 175.411 176.600 -0.156 0.000 0.900 777 E CA -1.416 54.886 56.400 -0.164 0.000 0.755 777 E CB 2.211 31.871 29.700 -0.066 0.000 1.117 777 E HN 0.280 8.446 8.360 -0.323 0.000 0.410 778 Y N 6.175 126.415 120.300 -0.100 0.000 2.326 778 Y HA 0.137 4.746 4.550 0.098 0.000 0.337 778 Y C -0.601 175.230 175.900 -0.114 0.000 1.023 778 Y CA -0.843 57.237 58.100 -0.032 0.000 1.143 778 Y CB 1.458 39.862 38.460 -0.093 0.000 1.183 778 Y HN 0.616 9.005 8.280 0.181 0.000 0.485 779 K N 3.914 124.327 120.400 0.022 0.000 2.483 779 K HA 0.416 4.766 4.320 -0.089 -0.083 0.256 779 K C -0.339 176.144 176.600 -0.196 0.000 0.961 779 K CA -1.156 55.078 56.287 -0.088 0.000 0.873 779 K CB 2.290 34.745 32.500 -0.076 0.000 1.107 779 K HN 0.832 9.113 8.250 0.052 0.000 0.432 780 G N 3.107 111.751 108.800 -0.259 0.000 2.305 780 G HA2 -0.145 3.635 3.960 -0.373 0.000 0.243 780 G HA3 -0.145 3.656 3.960 -0.320 -0.034 0.243 780 G C -0.147 174.314 174.900 -0.730 0.000 1.288 780 G CA 0.905 45.755 45.100 -0.417 0.000 0.901 780 G HN 0.410 8.453 8.290 -0.238 0.105 0.516 781 G N 2.580 110.861 108.800 -0.865 0.000 2.212 781 G HA2 -0.325 3.327 3.960 -0.513 0.000 0.266 781 G HA3 -0.325 3.177 3.960 -0.763 0.000 0.266 781 G C -0.252 174.437 174.900 -0.351 0.000 0.978 781 G CA 1.314 46.022 45.100 -0.654 0.000 0.632 781 G HN 0.322 8.207 8.290 -0.675 0.000 0.537 782 E N -1.151 118.828 120.200 -0.368 0.000 2.629 782 E HA 0.080 4.325 4.350 -0.176 0.000 0.197 782 E C -0.631 175.730 176.600 -0.399 0.000 0.955 782 E CA -0.364 55.876 56.400 -0.267 0.000 1.191 782 E CB 1.667 31.269 29.700 -0.164 0.000 1.175 782 E HN -0.280 7.820 8.360 -0.433 0.000 0.501 783 T N 0.036 114.344 114.554 -0.409 0.000 2.849 783 T HA -0.011 4.094 4.350 -0.409 0.000 0.284 783 T C -0.179 174.091 174.700 -0.717 0.000 1.004 783 T CA 0.152 61.979 62.100 -0.455 0.000 1.021 783 T CB 1.361 70.081 68.868 -0.246 0.000 1.013 783 T HN -0.173 7.884 8.240 -0.305 0.000 0.527 784 H N -0.962 117.917 119.070 -0.319 0.000 2.779 784 H HA 0.261 4.889 4.556 -0.063 -0.109 0.230 784 H C -1.016 174.220 175.328 -0.153 0.000 1.365 784 H CA -1.121 54.826 56.048 -0.168 0.000 1.086 784 H CB -0.585 29.093 29.762 -0.140 0.000 2.038 784 H HN 0.139 8.068 8.280 -0.585 0.000 0.558 785 F N -0.962 119.027 119.950 0.064 0.000 2.113 785 F HA -0.224 4.323 4.527 0.034 0.000 0.297 785 F C 0.595 176.489 175.800 0.156 0.000 1.103 785 F CA 2.763 60.807 58.000 0.073 0.000 1.248 785 F CB 0.535 39.532 39.000 -0.006 0.000 0.999 785 F HN -0.190 8.490 8.300 0.013 -0.373 0.475 786 V N -1.689 118.464 119.914 0.398 0.000 2.637 786 V HA -0.152 4.163 4.120 0.324 0.000 0.296 786 V C 0.130 176.356 176.094 0.220 0.000 1.046 786 V CA 0.065 62.545 62.300 0.299 0.000 1.066 786 V CB 0.094 32.063 31.823 0.244 0.000 0.968 786 V HN -0.514 8.264 8.190 0.420 -0.336 0.483 787 D N 5.361 125.895 120.400 0.223 0.000 2.508 787 D HA 0.019 4.748 4.640 0.148 0.000 0.224 787 D C 0.504 176.887 176.300 0.137 0.000 1.171 787 D CA -0.904 53.205 54.000 0.181 0.000 1.006 787 D CB -0.545 40.379 40.800 0.207 0.000 1.073 787 D HN 0.360 8.890 8.370 0.266 0.000 0.513 788 T N 3.282 117.888 114.554 0.086 0.000 3.035 788 T HA -0.246 4.074 4.350 -0.050 0.000 0.268 788 T C 1.961 176.664 174.700 0.005 0.000 1.109 788 T CA 2.325 64.433 62.100 0.013 0.000 1.119 788 T CB 0.175 69.063 68.868 0.033 0.000 0.900 788 T HN -0.103 8.176 8.240 0.105 0.024 0.503 789 Q N 1.145 120.971 119.800 0.044 0.000 2.123 789 Q HA -0.191 4.171 4.340 0.037 0.000 0.199 789 Q C 1.841 177.880 176.000 0.065 0.000 0.966 789 Q CA 2.795 58.626 55.803 0.047 0.000 0.845 789 Q CB -0.573 28.196 28.738 0.051 0.000 0.907 789 Q HN -0.283 8.102 8.270 0.062 -0.077 0.439 790 A N -0.002 122.879 122.820 0.102 0.000 1.898 790 A HA -0.229 4.197 4.320 0.175 0.000 0.216 790 A C 2.033 179.693 177.584 0.126 0.000 1.181 790 A CA 2.855 55.000 52.037 0.179 0.000 0.620 790 A CB -0.809 18.365 19.000 0.289 0.000 0.819 790 A HN -0.475 8.001 8.150 0.109 -0.261 0.442 791 L N -0.783 120.344 121.223 -0.161 0.000 2.017 791 L HA -0.362 3.269 4.340 -1.182 0.000 0.208 791 L C 1.196 177.970 176.870 -0.161 0.000 1.073 791 L CA 3.112 57.547 54.840 -0.674 0.000 0.745 791 L CB -0.608 40.901 42.059 -0.918 0.000 0.894 791 L HN -0.455 7.653 8.230 -0.085 0.070 0.432 792 E N -0.978 119.191 120.200 -0.051 0.000 2.085 792 E HA -0.523 3.889 4.350 0.104 0.000 0.194 792 E C 2.085 178.745 176.600 0.101 0.000 0.994 792 E CA 3.494 59.927 56.400 0.056 0.000 0.801 792 E CB -0.130 29.593 29.700 0.039 0.000 0.743 792 E HN 0.108 8.317 8.360 -0.073 0.107 0.453 793 K N -1.159 119.298 120.400 0.096 0.000 2.097 793 K HA -0.292 4.068 4.320 0.068 0.000 0.205 793 K C 2.062 178.744 176.600 0.136 0.000 1.050 793 K CA 2.563 58.910 56.287 0.100 0.000 0.938 793 K CB -0.546 32.019 32.500 0.107 0.000 0.718 793 K HN -0.404 7.897 8.250 0.085 0.000 0.442 794 D N 0.155 120.701 120.400 0.245 0.000 2.097 794 D HA -0.243 4.605 4.640 0.348 0.000 0.195 794 D C 1.633 178.084 176.300 0.250 0.000 0.989 794 D CA 3.089 57.328 54.000 0.398 0.000 0.827 794 D CB 0.046 41.283 40.800 0.729 0.000 0.966 794 D HN -0.357 8.158 8.370 0.242 0.000 0.456 795 W N 0.394 121.640 121.300 -0.091 0.000 2.358 795 W HA -0.356 3.695 4.660 -1.016 0.000 0.303 795 W C 1.641 178.036 176.519 -0.207 0.000 1.208 795 W CA 2.666 59.706 57.345 -0.507 0.000 1.274 795 W CB 0.406 29.595 29.460 -0.451 0.000 1.138 795 W HN 0.035 8.397 8.180 0.302 0.000 0.515 796 L N 0.104 121.158 121.223 -0.281 0.000 2.042 796 L HA -0.451 3.648 4.340 -0.402 0.000 0.210 796 L C 1.633 178.312 176.870 -0.319 0.000 1.076 796 L CA 3.520 58.172 54.840 -0.314 0.000 0.749 796 L CB -0.389 41.611 42.059 -0.097 0.000 0.893 796 L HN 0.104 8.316 8.230 -0.030 0.000 0.432 797 R N -1.425 118.971 120.500 -0.174 0.000 2.066 797 R HA -0.378 3.889 4.340 -0.122 0.000 0.232 797 R C 2.217 178.413 176.300 -0.173 0.000 1.131 797 R CA 3.433 59.466 56.100 -0.113 0.000 0.955 797 R CB -0.211 30.097 30.300 0.013 0.000 0.851 797 R HN -0.628 7.589 8.270 -0.089 0.000 0.432 798 F N 0.229 119.961 119.950 -0.365 0.000 2.102 798 F HA -0.405 4.009 4.527 -0.189 0.000 0.298 798 F C 1.094 176.535 175.800 -0.598 0.000 1.105 798 F CA 3.444 61.214 58.000 -0.383 0.000 1.239 798 F CB -0.009 38.793 39.000 -0.330 0.000 0.991 798 F HN -0.184 8.071 8.300 -0.076 0.000 0.474 799 A N -1.792 120.465 122.820 -0.939 0.000 1.940 799 A HA -0.522 3.333 4.320 -0.775 0.000 0.219 799 A C 1.712 179.006 177.584 -0.485 0.000 1.176 799 A CA 3.626 55.133 52.037 -0.883 0.000 0.631 799 A CB -0.819 17.506 19.000 -1.126 0.000 0.814 799 A HN 0.763 8.187 8.150 -1.209 0.000 0.446 800 N N -1.156 117.308 118.700 -0.393 0.000 2.142 800 N HA -0.214 4.582 4.740 -0.212 -0.184 0.186 800 N C 2.422 177.782 175.510 -0.251 0.000 1.023 800 N CA 3.640 56.536 53.050 -0.257 0.000 0.852 800 N CB 0.317 38.690 38.487 -0.191 0.000 0.998 800 N HN -0.668 7.374 8.380 -0.431 0.079 0.424 801 I N 0.693 121.078 120.570 -0.309 0.000 2.226 801 I HA -0.434 3.603 4.170 -0.221 0.000 0.245 801 I C 1.513 177.429 176.117 -0.335 0.000 1.100 801 I CA 4.385 65.504 61.300 -0.301 0.000 1.374 801 I CB -0.105 37.694 38.000 -0.335 0.000 1.057 801 I HN 0.079 8.006 8.210 -0.341 0.078 0.413 802 L N -0.231 120.730 121.223 -0.436 0.000 1.994 802 L HA -0.365 3.762 4.340 -0.355 0.000 0.208 802 L C 2.181 178.905 176.870 -0.242 0.000 1.071 802 L CA 3.773 58.399 54.840 -0.357 0.000 0.745 802 L CB -0.932 40.913 42.059 -0.357 0.000 0.892 802 L HN 0.065 7.962 8.230 -0.554 0.000 0.431 803 G N -3.689 104.988 108.800 -0.205 0.000 2.408 803 G HA2 -0.287 3.603 3.960 -0.117 0.000 0.217 803 G HA3 -0.287 3.917 3.960 -0.117 -0.314 0.217 803 G C 1.429 176.262 174.900 -0.111 0.000 1.150 803 G CA 1.778 46.798 45.100 -0.133 0.000 0.776 803 G HN -0.086 8.059 8.290 -0.241 0.000 0.542 804 Q N -2.156 117.569 119.800 -0.125 0.000 2.376 804 Q HA -0.077 4.218 4.340 -0.075 0.000 0.206 804 Q C 0.720 176.659 176.000 -0.101 0.000 0.921 804 Q CA 1.803 57.548 55.803 -0.098 0.000 0.911 804 Q CB 0.698 29.380 28.738 -0.092 0.000 1.032 804 Q HN -0.028 8.042 8.270 -0.156 0.106 0.510 805 R N -2.505 117.919 120.500 -0.127 0.000 2.756 805 R HA 0.118 4.400 4.340 -0.097 0.000 0.170 805 R C 1.599 177.826 176.300 -0.121 0.000 0.800 805 R CA 1.557 57.588 56.100 -0.115 0.000 1.052 805 R CB 1.801 32.031 30.300 -0.116 0.000 1.437 805 R HN -0.170 8.005 8.270 -0.157 0.000 0.607 806 E N 1.569 121.679 120.200 -0.150 0.000 2.112 806 E HA -0.155 4.148 4.350 -0.079 0.000 0.190 806 E C 2.402 178.896 176.600 -0.175 0.000 0.979 806 E CA 2.353 58.675 56.400 -0.129 0.000 0.814 806 E CB -0.066 29.558 29.700 -0.127 0.000 0.762 806 E HN -0.241 8.009 8.360 -0.184 0.000 0.460 807 L N -1.089 119.986 121.223 -0.246 0.000 2.131 807 L HA -0.326 3.696 4.340 -0.530 0.000 0.210 807 L C 1.801 178.549 176.870 -0.204 0.000 1.092 807 L CA 3.140 57.754 54.840 -0.378 0.000 0.759 807 L CB -0.990 40.817 42.059 -0.419 0.000 0.903 807 L HN 0.161 8.254 8.230 -0.228 0.000 0.435 808 A N -3.304 119.449 122.820 -0.112 0.000 2.019 808 A HA -0.272 4.201 4.320 -0.021 -0.166 0.219 808 A C 1.624 179.172 177.584 -0.059 0.000 1.164 808 A CA 2.720 54.724 52.037 -0.056 0.000 0.644 808 A CB -0.885 18.082 19.000 -0.054 0.000 0.805 808 A HN 0.470 8.542 8.150 -0.119 0.006 0.449 809 K N -1.934 118.416 120.400 -0.084 0.000 2.155 809 K HA -0.244 4.031 4.320 -0.075 0.000 0.203 809 K C 2.142 178.694 176.600 -0.080 0.000 1.052 809 K CA 2.796 59.034 56.287 -0.082 0.000 0.948 809 K CB -0.179 32.268 32.500 -0.087 0.000 0.728 809 K HN -0.576 7.486 8.250 -0.100 0.128 0.448 810 L N -0.342 120.817 121.223 -0.106 0.000 2.083 810 L HA -0.427 3.830 4.340 -0.139 0.000 0.209 810 L C 1.825 178.710 176.870 0.024 0.000 1.083 810 L CA 3.031 57.806 54.840 -0.109 0.000 0.752 810 L CB -0.725 41.178 42.059 -0.260 0.000 0.899 810 L HN -0.457 7.597 8.230 -0.148 0.087 0.433 811 D N -0.458 120.000 120.400 0.097 0.000 2.104 811 D HA -0.213 4.500 4.640 0.123 0.000 0.194 811 D C 3.215 179.518 176.300 0.005 0.000 0.994 811 D CA 3.152 57.206 54.000 0.091 0.000 0.830 811 D CB -0.715 40.125 40.800 0.067 0.000 0.959 811 D HN -0.230 8.177 8.370 0.062 0.000 0.452 812 K N -0.924 119.465 120.400 -0.020 0.000 2.211 812 K HA -0.186 4.115 4.320 -0.031 0.000 0.203 812 K C 1.983 178.556 176.600 -0.044 0.000 1.050 812 K CA 2.120 58.385 56.287 -0.036 0.000 0.945 812 K CB -0.142 32.329 32.500 -0.049 0.000 0.732 812 K HN -0.621 7.540 8.250 -0.022 0.075 0.451 813 G N -3.981 104.786 108.800 -0.056 0.000 2.985 813 G HA2 0.187 4.112 3.960 -0.057 0.000 0.209 813 G HA3 0.187 4.093 3.960 -0.089 0.000 0.209 813 G C -0.264 174.600 174.900 -0.060 0.000 1.165 813 G CA -0.870 44.190 45.100 -0.067 0.000 0.776 813 G HN -0.450 7.679 8.290 -0.058 0.126 0.541 814 G N -0.073 108.701 108.800 -0.044 0.000 2.198 814 G HA2 -0.316 3.625 3.960 -0.032 0.000 0.257 814 G HA3 -0.316 3.623 3.960 -0.035 0.000 0.257 814 G C -0.281 174.595 174.900 -0.041 0.000 1.042 814 G CA 0.031 45.109 45.100 -0.037 0.000 0.791 814 G HN -0.642 7.437 8.290 -0.034 0.191 0.502 815 V N 0.288 120.174 119.914 -0.047 0.000 2.407 815 V HA -0.046 4.203 4.120 -0.035 -0.149 0.278 815 V C -0.257 175.845 176.094 0.014 0.000 1.037 815 V CA -1.033 61.238 62.300 -0.049 0.000 0.900 815 V CB 0.097 31.767 31.823 -0.254 0.000 0.983 815 V HN -0.486 7.681 8.190 -0.039 0.000 0.459 816 A N 10.138 132.965 122.820 0.012 0.000 3.118 816 A HA 0.201 4.414 4.320 -0.178 0.000 0.256 816 A C -1.141 176.446 177.584 0.005 0.000 1.667 816 A CA -1.390 50.615 52.037 -0.054 0.000 1.338 816 A CB -1.521 17.479 19.000 -0.001 0.000 1.127 816 A HN 0.567 9.127 8.150 0.043 -0.384 0.634 817 Y N -1.448 118.884 120.300 0.054 0.000 2.457 817 Y HA -0.201 4.681 4.550 0.148 -0.243 0.341 817 Y C -0.422 175.440 175.900 -0.062 0.000 1.240 817 Y CA -1.699 56.440 58.100 0.065 0.000 1.437 817 Y CB 0.442 38.939 38.460 0.062 0.000 1.328 817 Y HN -0.580 7.585 8.280 -0.072 0.072 0.588 818 R N 1.913 122.327 120.500 -0.143 0.000 2.449 818 R HA -0.084 4.001 4.340 -0.426 0.000 0.296 818 R C -1.020 175.170 176.300 -0.182 0.000 1.047 818 R CA -0.028 55.740 56.100 -0.552 0.000 1.018 818 R CB 0.470 29.931 30.300 -1.398 0.000 0.962 818 R HN 0.178 8.416 8.270 -0.053 0.000 0.428 819 L N 7.739 128.869 121.223 -0.155 0.000 2.264 819 L HA 0.324 4.696 4.340 0.053 0.000 0.289 819 L C -1.760 175.069 176.870 -0.070 0.000 1.044 819 L CA -3.277 51.540 54.840 -0.039 0.000 0.807 819 L CB 1.050 43.080 42.059 -0.049 0.000 1.192 819 L HN 0.188 8.320 8.230 -0.164 0.000 0.425 820 P HA 0.020 4.396 4.420 -0.074 0.000 0.271 820 P C -1.319 175.980 177.300 -0.001 0.000 1.218 820 P CA -1.080 62.001 63.100 -0.032 0.000 0.780 820 P CB 0.519 32.227 31.700 0.014 0.000 0.901 821 V N 1.821 121.739 119.914 0.006 0.000 2.583 821 V HA -0.076 4.057 4.120 0.022 0.000 0.287 821 V C -0.733 175.376 176.094 0.025 0.000 1.051 821 V CA -2.409 59.904 62.300 0.020 0.000 1.010 821 V CB -0.331 31.506 31.823 0.024 0.000 0.988 821 V HN 0.089 8.279 8.190 0.000 0.000 0.478 822 P HA 0.022 4.546 4.420 0.023 -0.090 0.269 822 P C -0.928 176.395 177.300 0.038 0.000 1.215 822 P CA 0.054 63.170 63.100 0.028 0.000 0.780 822 P CB 0.741 32.452 31.700 0.018 0.000 0.898 823 G N -1.183 107.647 108.800 0.051 0.000 2.420 823 G HA2 0.392 4.534 3.960 0.103 0.000 0.284 823 G HA3 0.392 4.604 3.960 0.120 -0.179 0.284 823 G C -2.401 172.620 174.900 0.202 0.000 1.177 823 G CA -1.605 43.568 45.100 0.121 0.000 0.841 823 G HN 0.094 8.299 8.290 0.029 0.103 0.527 824 A N 2.822 125.764 122.820 0.203 0.000 2.604 824 A HA 1.062 5.635 4.320 0.114 -0.184 0.295 824 A C -2.610 174.875 177.584 -0.165 0.000 1.067 824 A CA -0.449 51.614 52.037 0.043 0.000 0.683 824 A CB 3.662 22.641 19.000 -0.034 0.000 1.281 824 A HN 0.408 8.537 8.150 0.181 0.130 0.407 825 R N -1.866 118.392 120.500 -0.404 0.000 2.739 825 R HA 0.540 4.715 4.340 -0.275 0.000 0.271 825 R C -2.516 173.604 176.300 -0.299 0.000 1.010 825 R CA -1.268 54.577 56.100 -0.425 0.000 0.897 825 R CB 3.568 33.456 30.300 -0.687 0.000 1.236 825 R HN 0.751 8.786 8.270 -0.392 0.000 0.466 826 V N 2.273 122.060 119.914 -0.212 0.000 2.384 826 V HA 0.523 4.680 4.120 -0.144 -0.123 0.287 826 V C -0.514 175.498 176.094 -0.136 0.000 1.020 826 V CA -0.494 61.718 62.300 -0.147 0.000 0.850 826 V CB 0.599 32.361 31.823 -0.101 0.000 0.987 826 V HN 0.351 8.424 8.190 -0.196 0.000 0.436 827 A N 7.990 130.739 122.820 -0.118 0.000 2.427 827 A HA 0.335 4.605 4.320 -0.083 0.000 0.298 827 A C -0.306 177.243 177.584 -0.059 0.000 1.036 827 A CA -0.349 51.633 52.037 -0.091 0.000 0.701 827 A CB 1.864 20.801 19.000 -0.106 0.000 1.250 827 A HN 0.491 8.573 8.150 -0.112 0.000 0.412 828 G N 1.720 110.494 108.800 -0.044 0.000 2.341 828 G HA2 -0.350 3.593 3.960 -0.027 0.000 0.292 828 G HA3 -0.350 3.594 3.960 -0.026 0.000 0.292 828 G C 0.324 175.205 174.900 -0.032 0.000 1.021 828 G CA 0.446 45.528 45.100 -0.031 0.000 0.905 828 G HN 0.552 8.815 8.290 -0.045 0.000 0.508 829 G N -3.819 104.959 108.800 -0.037 0.000 2.189 829 G HA2 -0.421 3.517 3.960 -0.038 0.000 0.267 829 G HA3 -0.421 3.521 3.960 -0.030 0.000 0.267 829 G C -1.027 173.848 174.900 -0.042 0.000 0.975 829 G CA -0.116 44.962 45.100 -0.036 0.000 0.644 829 G HN 0.150 8.400 8.290 -0.042 0.014 0.537 830 K N -1.765 118.606 120.400 -0.048 0.000 2.400 830 K HA 0.736 5.140 4.320 -0.059 -0.120 0.246 830 K C -2.161 174.400 176.600 -0.066 0.000 0.995 830 K CA -1.954 54.301 56.287 -0.053 0.000 0.840 830 K CB 4.313 36.791 32.500 -0.036 0.000 1.293 830 K HN -0.388 7.665 8.250 -0.049 0.167 0.445 831 L N 1.925 123.102 121.223 -0.076 0.000 2.319 831 L HA 0.319 4.747 4.340 -0.106 -0.152 0.280 831 L C -1.080 175.808 176.870 0.030 0.000 1.099 831 L CA -0.450 54.338 54.840 -0.086 0.000 0.828 831 L CB 1.388 43.340 42.059 -0.180 0.000 1.150 831 L HN 0.439 8.613 8.230 -0.094 0.000 0.442 832 E N 7.475 127.649 120.200 -0.043 0.000 2.165 832 E HA 0.362 4.826 4.350 0.191 0.000 0.266 832 E C -2.220 174.361 176.600 -0.031 0.000 0.889 832 E CA -1.807 54.627 56.400 0.055 0.000 0.756 832 E CB 3.446 33.174 29.700 0.047 0.000 1.131 832 E HN 0.426 8.701 8.360 -0.141 0.000 0.411 833 A N 6.097 128.826 122.820 -0.152 0.000 2.413 833 A HA 0.619 5.089 4.320 0.090 -0.096 0.307 833 A C -1.799 175.779 177.584 -0.011 0.000 1.087 833 A CA -1.801 50.107 52.037 -0.215 0.000 0.750 833 A CB 3.159 21.723 19.000 -0.726 0.000 1.296 833 A HN 0.174 8.273 8.150 -0.085 0.000 0.423 834 N N 0.687 119.406 118.700 0.032 0.000 2.972 834 N HA 0.160 4.904 4.740 0.006 0.000 0.262 834 N C -2.121 173.377 175.510 -0.020 0.000 1.478 834 N CA -1.098 51.941 53.050 -0.019 0.000 0.841 834 N CB 2.715 41.109 38.487 -0.153 0.000 1.512 834 N HN 0.503 8.814 8.380 0.074 0.114 0.548 835 I N -3.316 117.241 120.570 -0.021 0.000 2.918 835 I HA 0.140 4.315 4.170 0.008 0.000 0.301 835 I C -1.169 174.958 176.117 0.017 0.000 1.312 835 I CA -0.729 60.574 61.300 0.006 0.000 1.007 835 I CB 3.365 41.378 38.000 0.022 0.000 1.281 835 I HN 0.095 8.283 8.210 -0.036 0.000 0.440 836 A N 5.796 128.648 122.820 0.053 0.000 2.015 836 A HA -0.136 4.364 4.320 0.129 -0.103 0.219 836 A C -1.267 176.389 177.584 0.120 0.000 1.163 836 A CA 1.940 54.050 52.037 0.121 0.000 0.646 836 A CB 0.337 19.433 19.000 0.162 0.000 0.806 836 A HN 0.417 8.597 8.150 0.050 0.000 0.448 837 L N -2.320 118.930 121.223 0.045 0.000 2.433 837 L HA 0.375 4.659 4.340 -0.094 0.000 0.256 837 L C -2.747 174.088 176.870 -0.058 0.000 1.063 837 L CA -3.631 51.189 54.840 -0.033 0.000 0.922 837 L CB 0.305 42.353 42.059 -0.018 0.000 1.238 837 L HN -0.510 7.711 8.230 0.042 0.035 0.466 838 P HA -0.117 4.286 4.420 -0.029 0.000 0.264 838 P C 0.161 177.422 177.300 -0.066 0.000 1.193 838 P CA 0.720 63.782 63.100 -0.062 0.000 0.763 838 P CB 0.145 31.799 31.700 -0.077 0.000 0.810 839 G N 0.802 109.585 108.800 -0.029 0.000 2.352 839 G HA2 -0.327 3.623 3.960 -0.018 0.000 0.204 839 G HA3 -0.327 3.602 3.960 -0.052 0.000 0.204 839 G C -0.791 174.106 174.900 -0.005 0.000 1.004 839 G CA -0.378 44.705 45.100 -0.027 0.000 0.648 839 G HN 0.159 8.447 8.290 -0.003 0.000 0.491 840 L N 2.456 123.680 121.223 0.002 0.000 2.426 840 L HA -0.136 4.214 4.340 0.016 0.000 0.271 840 L C 0.837 177.741 176.870 0.057 0.000 1.169 840 L CA 0.367 55.221 54.840 0.024 0.000 0.836 840 L CB 0.439 42.516 42.059 0.029 0.000 1.112 840 L HN -0.695 7.458 8.230 -0.009 0.071 0.465 841 G N 1.870 110.709 108.800 0.065 0.000 2.491 841 G HA2 0.029 4.060 3.960 0.117 0.000 0.242 841 G HA3 0.029 4.046 3.960 0.094 0.000 0.242 841 G C -1.907 173.070 174.900 0.127 0.000 1.266 841 G CA -0.425 44.736 45.100 0.102 0.000 0.844 841 G HN 0.084 8.403 8.290 0.048 0.000 0.571 842 I N 2.809 123.493 120.570 0.189 0.000 2.509 842 I HA 0.337 4.596 4.170 0.148 0.000 0.293 842 I C -1.666 174.620 176.117 0.283 0.000 1.020 842 I CA -0.706 60.715 61.300 0.202 0.000 1.088 842 I CB 2.781 40.883 38.000 0.170 0.000 1.267 842 I HN 0.380 8.725 8.210 0.224 0.000 0.430 843 E N 4.702 125.061 120.200 0.265 0.000 2.299 843 E HA 1.148 5.968 4.350 0.386 -0.238 0.265 843 E C -0.954 175.958 176.600 0.520 0.000 0.911 843 E CA -2.868 53.743 56.400 0.352 0.000 0.789 843 E CB 4.341 34.195 29.700 0.257 0.000 1.246 843 E HN 0.819 9.296 8.360 0.195 0.000 0.427 844 Y N -1.724 118.825 120.300 0.415 0.000 2.581 844 Y HA 0.926 5.837 4.550 0.369 -0.140 0.345 844 Y C -2.455 173.410 175.900 -0.059 0.000 1.036 844 Y CA -2.839 55.413 58.100 0.252 0.000 1.042 844 Y CB 3.778 42.311 38.460 0.123 0.000 1.289 844 Y HN 0.925 9.262 8.280 0.094 0.000 0.471 845 S N -0.422 115.005 115.700 -0.455 0.000 2.575 845 S HA 0.634 4.770 4.470 -0.755 -0.119 0.278 845 S C 0.078 174.473 174.600 -0.342 0.000 1.139 845 S CA -2.473 55.260 58.200 -0.778 0.000 0.954 845 S CB 1.762 63.947 63.200 -1.691 0.000 1.054 845 S HN 0.219 8.436 8.310 -0.155 0.000 0.483 846 T N 4.543 118.961 114.554 -0.227 0.000 3.092 846 T HA 0.543 4.992 4.350 -0.074 -0.143 0.258 846 T C -0.284 174.336 174.700 -0.134 0.000 1.031 846 T CA -1.123 60.918 62.100 -0.098 0.000 0.925 846 T CB 0.438 69.309 68.868 0.004 0.000 1.036 846 T HN 0.798 8.872 8.240 -0.278 0.000 0.544 847 D N -0.363 119.912 120.400 -0.209 0.000 2.670 847 D HA 0.070 4.639 4.640 -0.118 0.000 0.255 847 D C 0.545 176.747 176.300 -0.164 0.000 1.286 847 D CA -1.339 52.563 54.000 -0.164 0.000 0.830 847 D CB -0.464 40.241 40.800 -0.158 0.000 1.065 847 D HN -0.766 7.356 8.370 -0.314 0.060 0.486 848 G N -1.062 107.638 108.800 -0.168 0.000 2.136 848 G HA2 -0.377 3.525 3.960 -0.096 0.000 0.242 848 G HA3 -0.377 3.530 3.960 -0.088 0.000 0.242 848 G C 0.125 174.941 174.900 -0.140 0.000 0.989 848 G CA 0.023 45.050 45.100 -0.122 0.000 0.682 848 G HN 0.043 8.227 8.290 -0.177 0.000 0.522 849 G N -1.543 107.066 108.800 -0.319 0.000 2.149 849 G HA2 -0.389 2.993 3.960 -0.964 0.000 0.235 849 G HA3 -0.389 3.558 3.960 -0.023 0.000 0.235 849 G C 0.557 175.356 174.900 -0.168 0.000 1.018 849 G CA 0.065 44.951 45.100 -0.356 0.000 0.728 849 G HN -0.479 7.579 8.290 -0.430 -0.026 0.508 850 K N -1.646 118.603 120.400 -0.251 0.000 2.214 850 K HA -0.009 4.308 4.320 -0.005 0.000 0.201 850 K C 0.134 176.660 176.600 -0.124 0.000 1.049 850 K CA 0.836 57.061 56.287 -0.102 0.000 0.978 850 K CB 0.810 33.261 32.500 -0.081 0.000 0.842 850 K HN 0.110 8.455 8.250 -0.326 -0.291 0.474 851 Q N -0.138 119.495 119.800 -0.278 0.000 2.316 851 Q HA 0.215 4.504 4.340 -0.084 0.000 0.264 851 Q C -2.166 173.547 176.000 -0.478 0.000 0.987 851 Q CA -1.213 54.456 55.803 -0.224 0.000 0.852 851 Q CB 1.852 30.491 28.738 -0.166 0.000 1.287 851 Q HN -0.135 8.499 8.270 -0.342 -0.570 0.448 852 W N 2.991 124.187 121.300 -0.173 0.000 2.573 852 W HA 0.320 4.963 4.660 -0.262 -0.140 0.326 852 W C -0.137 176.231 176.519 -0.252 0.000 1.049 852 W CA -1.037 56.169 57.345 -0.232 0.000 1.220 852 W CB 2.160 31.487 29.460 -0.221 0.000 1.373 852 W HN 0.332 8.571 8.180 0.098 0.000 0.507 853 Q N 0.132 119.798 119.800 -0.223 0.000 2.387 853 Q HA 0.452 4.742 4.340 -0.084 0.000 0.273 853 Q C -0.535 175.419 176.000 -0.078 0.000 1.089 853 Q CA -1.394 54.267 55.803 -0.235 0.000 0.824 853 Q CB 4.595 33.062 28.738 -0.452 0.000 1.367 853 Q HN 0.999 9.019 8.270 -0.417 0.000 0.443 854 R N 2.178 122.733 120.500 0.090 0.000 2.491 854 R HA 0.044 4.663 4.340 0.243 -0.133 0.283 854 R C -0.145 176.383 176.300 0.380 0.000 1.072 854 R CA 0.586 56.814 56.100 0.213 0.000 1.048 854 R CB 0.782 31.173 30.300 0.151 0.000 0.983 854 R HN 0.396 8.705 8.270 0.064 0.000 0.450 855 Y N 6.659 127.145 120.300 0.310 0.000 2.336 855 Y HA -0.087 4.673 4.550 0.351 0.000 0.335 855 Y C -1.571 174.418 175.900 0.148 0.000 1.046 855 Y CA 0.762 59.031 58.100 0.281 0.000 1.198 855 Y CB 1.069 39.679 38.460 0.250 0.000 1.182 855 Y HN 0.330 8.903 8.280 0.488 0.000 0.502 856 D N 7.285 127.404 120.400 -0.469 0.000 2.414 856 D HA 0.104 4.586 4.640 -0.264 0.000 0.232 856 D C -0.259 175.600 176.300 -0.736 0.000 1.070 856 D CA -1.928 51.817 54.000 -0.424 0.000 0.839 856 D CB 1.583 42.269 40.800 -0.190 0.000 1.079 856 D HN 0.191 8.306 8.370 -0.425 0.000 0.521 857 A N 6.325 128.805 122.820 -0.567 0.000 2.019 857 A HA -0.200 3.803 4.320 -0.529 0.000 0.219 857 A C 0.966 178.446 177.584 -0.172 0.000 1.164 857 A CA 2.539 54.371 52.037 -0.341 0.000 0.644 857 A CB -0.005 18.991 19.000 -0.006 0.000 0.805 857 A HN 0.677 8.630 8.150 -0.329 0.000 0.449 858 K N -2.964 117.349 120.400 -0.144 0.000 2.417 858 K HA 0.030 4.316 4.320 -0.058 0.000 0.196 858 K C -0.880 175.669 176.600 -0.085 0.000 1.023 858 K CA 0.295 56.534 56.287 -0.080 0.000 1.122 858 K CB 0.422 32.891 32.500 -0.052 0.000 0.850 858 K HN -0.419 7.947 8.250 -0.162 -0.213 0.521 859 A N -1.082 121.659 122.820 -0.132 0.000 3.474 859 A HA 0.237 4.507 4.320 -0.084 0.000 0.251 859 A C -1.462 176.035 177.584 -0.145 0.000 1.062 859 A CA -0.371 51.604 52.037 -0.104 0.000 0.945 859 A CB 0.486 19.442 19.000 -0.074 0.000 1.296 859 A HN -0.558 7.277 8.150 -0.206 0.192 0.592 860 K N 2.036 122.348 120.400 -0.147 0.000 2.469 860 K HA 0.059 4.308 4.320 -0.268 -0.090 0.274 860 K C -1.774 174.766 176.600 -0.099 0.000 0.983 860 K CA -1.154 55.047 56.287 -0.143 0.000 0.974 860 K CB -0.530 31.953 32.500 -0.027 0.000 0.913 860 K HN -0.039 8.145 8.250 -0.109 0.000 0.493 861 P HA 0.100 4.483 4.420 -0.060 0.000 0.285 861 P C -1.385 175.856 177.300 -0.099 0.000 1.259 861 P CA -0.680 62.345 63.100 -0.124 0.000 0.794 861 P CB 0.939 32.442 31.700 -0.329 0.000 0.940 862 A N 3.553 126.345 122.820 -0.047 0.000 2.450 862 A HA 0.157 4.608 4.320 -0.044 -0.157 0.255 862 A C -0.403 177.161 177.584 -0.033 0.000 1.096 862 A CA -0.134 51.881 52.037 -0.036 0.000 0.778 862 A CB 0.545 19.534 19.000 -0.019 0.000 1.031 862 A HN 0.230 8.365 8.150 -0.026 0.000 0.494 863 V N 4.898 124.786 119.914 -0.042 0.000 2.709 863 V HA 0.239 4.350 4.120 -0.015 0.000 0.308 863 V C -1.843 174.234 176.094 -0.029 0.000 1.062 863 V CA -0.389 61.889 62.300 -0.036 0.000 0.901 863 V CB 3.817 35.598 31.823 -0.070 0.000 1.003 863 V HN 0.181 8.344 8.190 -0.045 0.000 0.425 864 S N 6.147 121.836 115.700 -0.018 0.000 2.547 864 S HA 0.393 4.848 4.470 -0.024 0.000 0.281 864 S C -0.237 174.351 174.600 -0.020 0.000 1.118 864 S CA -0.889 57.299 58.200 -0.020 0.000 0.947 864 S CB 2.285 65.475 63.200 -0.016 0.000 1.053 864 S HN 0.136 8.441 8.310 -0.009 0.000 0.482 865 G N 3.621 112.407 108.800 -0.023 0.000 2.593 865 G HA2 -0.227 3.719 3.960 -0.023 0.000 0.237 865 G HA3 -0.227 3.719 3.960 -0.024 0.000 0.237 865 G C -0.941 173.943 174.900 -0.026 0.000 1.312 865 G CA -0.405 44.681 45.100 -0.024 0.000 0.896 865 G HN 0.116 8.392 8.290 -0.025 0.000 0.574 866 E N 2.674 122.857 120.200 -0.028 0.000 2.417 866 E HA -0.088 4.246 4.350 -0.025 0.000 0.261 866 E C -1.467 175.114 176.600 -0.032 0.000 1.000 866 E CA 0.448 56.831 56.400 -0.029 0.000 0.919 866 E CB 0.499 30.180 29.700 -0.032 0.000 0.955 866 E HN 0.012 8.355 8.360 -0.028 0.000 0.455 867 V N 5.842 125.742 119.914 -0.022 0.000 2.656 867 V HA 0.538 4.797 4.120 -0.024 -0.154 0.307 867 V C -1.153 174.943 176.094 0.004 0.000 1.051 867 V CA -1.847 60.448 62.300 -0.008 0.000 0.893 867 V CB 2.411 34.239 31.823 0.009 0.000 0.999 867 V HN 0.403 8.581 8.190 -0.020 0.000 0.426 868 Q N 4.264 124.062 119.800 -0.002 0.000 2.348 868 Q HA 0.908 5.449 4.340 0.104 -0.139 0.271 868 Q C -1.277 174.867 176.000 0.241 0.000 1.067 868 Q CA -1.526 54.330 55.803 0.088 0.000 0.839 868 Q CB 3.941 32.728 28.738 0.083 0.000 1.354 868 Q HN 0.276 8.507 8.270 -0.066 0.000 0.447 869 V N -4.263 115.841 119.914 0.316 0.000 2.962 869 V HA 0.921 5.493 4.120 0.553 -0.120 0.313 869 V C -2.077 174.179 176.094 0.270 0.000 1.099 869 V CA -2.663 59.850 62.300 0.356 0.000 0.971 869 V CB 3.808 35.728 31.823 0.163 0.000 1.028 869 V HN 0.827 9.161 8.190 0.240 0.000 0.430 870 R N -0.806 119.788 120.500 0.157 0.000 2.710 870 R HA 0.642 4.989 4.340 0.012 0.000 0.270 870 R C -1.880 174.430 176.300 0.016 0.000 1.021 870 R CA -1.235 54.845 56.100 -0.033 0.000 0.889 870 R CB 3.893 33.974 30.300 -0.365 0.000 1.243 870 R HN 0.684 9.096 8.270 0.238 0.000 0.464 871 S N -0.550 115.167 115.700 0.028 0.000 2.722 871 S HA 0.651 5.251 4.470 0.079 -0.082 0.292 871 S C -1.350 173.303 174.600 0.089 0.000 1.135 871 S CA -1.431 56.805 58.200 0.061 0.000 1.003 871 S CB 2.594 65.821 63.200 0.046 0.000 1.067 871 S HN 0.619 8.937 8.310 0.014 0.000 0.546 872 V N 0.155 120.111 119.914 0.071 0.000 2.789 872 V HA 0.660 4.883 4.120 -0.101 -0.164 0.311 872 V C -1.769 174.292 176.094 -0.056 0.000 1.073 872 V CA -2.923 59.369 62.300 -0.013 0.000 0.921 872 V CB 4.396 36.272 31.823 0.089 0.000 1.009 872 V HN -0.177 8.055 8.190 0.071 0.000 0.426 873 S N 7.196 122.804 115.700 -0.153 0.000 2.576 873 S HA 0.371 4.865 4.470 0.039 0.000 0.272 873 S C -0.075 174.506 174.600 -0.032 0.000 1.352 873 S CA -0.899 57.266 58.200 -0.057 0.000 1.021 873 S CB -0.712 62.414 63.200 -0.124 0.000 0.887 873 S HN 0.563 8.576 8.310 -0.312 0.110 0.542 874 P HA -0.155 4.264 4.420 -0.002 0.000 0.218 874 P C -0.276 177.013 177.300 -0.018 0.000 1.148 874 P CA 2.110 65.209 63.100 -0.002 0.000 0.822 874 P CB -0.011 31.688 31.700 -0.002 0.000 0.784 875 D N -5.940 114.443 120.400 -0.029 0.000 2.349 875 D HA -0.065 4.558 4.640 -0.029 0.000 0.224 875 D C 0.946 177.209 176.300 -0.060 0.000 1.029 875 D CA -0.575 53.401 54.000 -0.040 0.000 0.879 875 D CB -1.044 39.732 40.800 -0.040 0.000 0.906 875 D HN -0.455 8.058 8.370 -0.022 -0.156 0.528 876 G N -1.106 107.640 108.800 -0.089 0.000 2.184 876 G HA2 -0.396 3.555 3.960 -0.117 0.000 0.264 876 G HA3 -0.396 3.531 3.960 -0.054 0.000 0.264 876 G C 0.656 175.433 174.900 -0.205 0.000 0.975 876 G CA 1.222 46.255 45.100 -0.112 0.000 0.642 876 G HN -0.030 8.010 8.290 -0.089 0.197 0.536 877 K N -2.383 117.872 120.400 -0.241 0.000 2.323 877 K HA -0.084 4.126 4.320 -0.183 0.000 0.197 877 K C 0.216 176.551 176.600 -0.442 0.000 1.043 877 K CA 0.950 57.085 56.287 -0.253 0.000 0.997 877 K CB 0.802 33.212 32.500 -0.151 0.000 0.807 877 K HN -0.151 8.250 8.250 -0.198 -0.269 0.497 878 R N -0.819 119.318 120.500 -0.605 0.000 2.807 878 R HA 0.320 4.329 4.340 -0.552 0.000 0.276 878 R C -2.077 173.651 176.300 -0.953 0.000 0.979 878 R CA -1.130 54.587 56.100 -0.639 0.000 0.928 878 R CB 3.548 33.620 30.300 -0.379 0.000 1.191 878 R HN -0.274 7.689 8.270 -0.510 0.000 0.471 879 Y N -1.357 118.859 120.300 -0.140 0.000 2.545 879 Y HA 0.751 5.415 4.550 -0.153 -0.207 0.348 879 Y C 0.558 176.377 175.900 -0.135 0.000 1.002 879 Y CA -1.778 56.225 58.100 -0.163 0.000 1.039 879 Y CB 3.587 41.899 38.460 -0.246 0.000 1.271 879 Y HN 0.174 8.279 8.280 -0.291 0.000 0.467 880 S N 2.602 118.326 115.700 0.039 0.000 2.626 880 S HA 0.058 4.540 4.470 0.019 0.000 0.257 880 S C 0.137 174.744 174.600 0.011 0.000 1.288 880 S CA -0.122 58.087 58.200 0.016 0.000 0.980 880 S CB 1.980 65.185 63.200 0.008 0.000 0.975 880 S HN 0.527 8.760 8.310 0.052 0.108 0.577 881 R N -2.398 118.116 120.500 0.024 0.000 2.694 881 R HA -0.113 4.227 4.340 0.001 0.000 0.268 881 R C -1.388 174.915 176.300 0.004 0.000 1.061 881 R CA 0.379 56.489 56.100 0.017 0.000 1.133 881 R CB 0.658 30.981 30.300 0.039 0.000 1.020 881 R HN 0.321 8.618 8.270 0.045 0.000 0.475 882 A N 1.974 124.803 122.820 0.015 0.000 2.301 882 A HA 0.526 5.082 4.320 0.072 -0.192 0.312 882 A C -0.534 177.118 177.584 0.113 0.000 1.182 882 A CA -1.105 50.983 52.037 0.085 0.000 0.826 882 A CB 1.629 20.743 19.000 0.190 0.000 1.134 882 A HN 0.204 8.364 8.150 0.017 0.000 0.501 883 E N 2.564 122.840 120.200 0.127 0.000 2.343 883 E HA 0.289 4.684 4.350 0.076 0.000 0.270 883 E C -1.123 175.532 176.600 0.092 0.000 0.895 883 E CA -1.510 54.942 56.400 0.086 0.000 0.767 883 E CB 4.382 34.113 29.700 0.051 0.000 1.248 883 E HN 0.092 8.545 8.360 0.154 0.000 0.440 884 K N 1.796 122.231 120.400 0.057 0.000 2.174 884 K HA 0.249 4.753 4.320 0.046 -0.157 0.275 884 K C 0.181 176.793 176.600 0.019 0.000 1.015 884 K CA -0.025 56.285 56.287 0.037 0.000 0.933 884 K CB 0.944 33.456 32.500 0.020 0.000 1.025 884 K HN 0.295 8.573 8.250 0.046 0.000 0.463 885 V N 0.000 119.919 119.914 0.008 0.000 2.409 885 V HA 0.000 4.114 4.120 -0.010 0.000 0.244 885 V CA 0.000 62.292 62.300 -0.013 0.000 1.235 885 V CB 0.000 31.805 31.823 -0.030 0.000 1.184 885 V HN 0.000 8.197 8.190 0.011 0.000 0.556