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 1gx4_1_A DATA FIRST_RESID 82 DATA SEQUENCE KLKLSDWFNP FKRPEVVTMT KWKAPVVWEG TYNRAVLDNY YAKQKITVGL DATA SEQUENCE TVFAVGRYIE HYLEEFLTSA NKHFMVGHPV IFYIMVDDVS RMPLIELGPL DATA SEQUENCE RSFKVFKIKP EKRWQDISMM RMKTIGEHIV AHIQHEVDFL FCMDVDQVFQ DATA SEQUENCE DKFGVETLGE SVAQLQAWWY KADPNDFTYE RRKESAAYIP FGEGDFYYHA DATA SEQUENCE AIFGGTPTQV LNITQECFKG ILKDKKNDIE AQWHDESHLN KYFLLNKPTK DATA SEQUENCE ILSPEYCWDY HIGLPADIKL VKMSWQTKEY NVVRNNV 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 82 K HA 0.000 4.320 4.320 -0.000 0.000 0.191 82 K C 0.000 176.630 176.600 0.050 0.000 0.988 82 K CA 0.000 56.370 56.287 0.138 0.000 0.838 82 K CB 0.000 32.606 32.500 0.177 0.000 1.064 83 L N 2.851 124.031 121.223 -0.072 0.000 2.490 83 L HA 0.486 4.822 4.340 -0.007 0.000 0.274 83 L C -0.211 176.641 176.870 -0.030 0.000 1.201 83 L CA 0.273 54.959 54.840 -0.258 0.000 0.869 83 L CB 0.833 42.538 42.059 -0.590 0.000 1.123 83 L HN 0.332 8.562 8.230 -0.000 0.000 0.484 84 K N 3.950 124.365 120.400 0.024 0.000 2.259 84 K HA 0.317 4.633 4.320 -0.007 0.000 0.249 84 K C 0.456 177.128 176.600 0.120 0.000 0.942 84 K CA -0.726 55.604 56.287 0.071 0.000 0.816 84 K CB 1.531 34.057 32.500 0.044 0.000 1.155 84 K HN 0.423 8.673 8.250 -0.000 0.000 0.428 85 L N 1.909 123.178 121.223 0.077 0.000 2.013 85 L HA -0.252 4.084 4.340 -0.007 0.000 0.212 85 L C 1.766 178.477 176.870 -0.266 0.000 1.073 85 L CA 2.361 57.154 54.840 -0.078 0.000 0.753 85 L CB -0.680 41.331 42.059 -0.079 0.000 0.890 85 L HN 0.876 9.106 8.230 -0.000 0.000 0.432 86 S N -1.992 113.648 115.700 -0.101 0.000 2.474 86 S HA -0.139 4.327 4.470 -0.007 0.000 0.235 86 S C 1.585 176.156 174.600 -0.049 0.000 0.997 86 S CA 0.838 58.987 58.200 -0.086 0.000 0.949 86 S CB -0.775 62.412 63.200 -0.022 0.000 0.766 86 S HN 0.516 8.826 8.310 -0.000 0.000 0.517 87 D N 1.350 121.759 120.400 0.015 0.000 2.178 87 D HA -0.077 4.559 4.640 -0.007 0.000 0.201 87 D C 1.577 177.978 176.300 0.169 0.000 0.980 87 D CA 1.364 55.418 54.000 0.090 0.000 0.842 87 D CB -0.179 40.687 40.800 0.111 0.000 0.948 87 D HN 0.901 9.271 8.370 -0.000 0.000 0.472 88 W N -1.509 119.825 121.300 0.056 0.000 2.413 88 W HA 0.290 4.947 4.660 -0.006 0.000 0.288 88 W C -0.525 176.113 176.519 0.199 0.000 0.958 88 W CA -0.513 56.892 57.345 0.100 0.000 1.333 88 W CB -0.069 29.436 29.460 0.076 0.000 1.002 88 W HN -0.252 7.928 8.180 -0.000 0.000 0.562 89 F N 4.307 123.783 119.950 -0.790 0.000 2.449 89 F HA 0.501 5.024 4.527 -0.007 0.000 0.342 89 F C -0.857 174.711 175.800 -0.386 0.000 1.127 89 F CA -1.355 56.158 58.000 -0.811 0.000 0.975 89 F CB 1.114 39.231 39.000 -1.473 0.000 1.146 89 F HN -0.222 8.078 8.300 -0.000 0.000 0.444 90 N N 8.305 126.557 118.700 -0.747 0.000 2.623 90 N HA 0.372 5.108 4.740 -0.007 0.000 0.256 90 N C -2.238 172.829 175.510 -0.739 0.000 1.045 90 N CA -2.509 50.224 53.050 -0.528 0.000 0.863 90 N CB 1.777 40.132 38.487 -0.220 0.000 1.182 90 N HN 0.264 8.644 8.380 -0.000 0.000 0.523 91 P HA -0.044 4.376 4.420 -0.000 0.000 0.223 91 P C 0.977 177.962 177.300 -0.525 0.000 1.151 91 P CA 0.836 63.464 63.100 -0.786 0.000 0.787 91 P CB 0.005 31.307 31.700 -0.664 0.000 0.788 92 F N 0.575 120.382 119.950 -0.239 0.000 2.546 92 F HA -0.010 4.514 4.527 -0.007 0.000 0.298 92 F C 2.164 177.866 175.800 -0.164 0.000 1.120 92 F CA 0.594 58.495 58.000 -0.166 0.000 1.456 92 F CB -0.520 38.400 39.000 -0.133 0.000 1.088 92 F HN -0.188 8.112 8.300 -0.000 0.000 0.572 93 K N 0.266 120.631 120.400 -0.059 0.000 2.362 93 K HA 0.005 4.321 4.320 -0.007 0.000 0.200 93 K C 0.481 177.015 176.600 -0.110 0.000 1.046 93 K CA 0.764 56.999 56.287 -0.085 0.000 0.952 93 K CB -0.007 32.419 32.500 -0.123 0.000 0.753 93 K HN 0.119 8.369 8.250 -0.000 0.000 0.466 94 R N 0.616 121.023 120.500 -0.155 0.000 2.653 94 R HA 0.157 4.493 4.340 -0.007 0.000 0.269 94 R C -2.139 174.027 176.300 -0.223 0.000 1.603 94 R CA -1.386 54.590 56.100 -0.207 0.000 1.671 94 R CB 0.814 30.956 30.300 -0.262 0.000 1.300 94 R HN -0.030 8.240 8.270 -0.000 0.000 0.668 95 P HA -0.046 4.374 4.420 -0.000 0.000 0.226 95 P C 0.152 177.378 177.300 -0.125 0.000 1.153 95 P CA 0.884 63.923 63.100 -0.102 0.000 0.777 95 P CB 0.561 32.241 31.700 -0.033 0.000 0.794 96 E N 0.040 120.137 120.200 -0.172 0.000 2.451 96 E HA 0.166 4.512 4.350 -0.007 0.000 0.194 96 E C 0.500 176.977 176.600 -0.204 0.000 1.027 96 E CA -0.125 56.185 56.400 -0.150 0.000 0.914 96 E CB 0.683 30.307 29.700 -0.128 0.000 1.054 96 E HN 0.183 8.543 8.360 -0.000 0.000 0.461 97 V N -2.426 117.298 119.914 -0.318 0.000 3.141 97 V HA 0.486 4.602 4.120 -0.007 0.000 0.312 97 V C 0.217 176.205 176.094 -0.177 0.000 1.157 97 V CA -1.361 60.712 62.300 -0.377 0.000 1.041 97 V CB 1.524 32.657 31.823 -1.149 0.000 1.071 97 V HN -0.088 8.102 8.190 -0.000 0.000 0.441 98 V N 0.345 120.310 119.914 0.083 0.000 2.470 98 V HA 0.492 4.608 4.120 -0.007 0.000 0.276 98 V C 1.023 177.295 176.094 0.296 0.000 1.040 98 V CA 0.862 63.289 62.300 0.212 0.000 1.008 98 V CB -0.167 31.875 31.823 0.364 0.000 0.990 98 V HN 1.221 9.411 8.190 -0.000 0.000 0.477 99 T N 0.718 115.381 114.554 0.181 0.000 2.975 99 T HA 0.477 4.823 4.350 -0.007 0.000 0.257 99 T C 0.124 174.958 174.700 0.223 0.000 1.003 99 T CA 0.061 62.329 62.100 0.282 0.000 0.932 99 T CB 0.281 69.228 68.868 0.133 0.000 1.087 99 T HN 0.696 8.936 8.240 -0.000 0.000 0.512 100 M N 2.948 122.602 119.600 0.091 0.000 2.371 100 M HA 0.545 5.021 4.480 -0.007 0.000 0.287 100 M C -0.532 175.720 176.300 -0.081 0.000 1.149 100 M CA -0.420 54.870 55.300 -0.017 0.000 0.929 100 M CB 2.083 34.672 32.600 -0.018 0.000 1.683 100 M HN 0.213 8.503 8.290 -0.000 0.000 0.470 101 T N 0.583 114.975 114.554 -0.271 0.000 2.847 101 T HA 0.425 4.771 4.350 -0.007 0.000 0.279 101 T C 0.799 175.283 174.700 -0.360 0.000 0.984 101 T CA -0.095 61.728 62.100 -0.461 0.000 0.988 101 T CB 0.784 68.847 68.868 -1.340 0.000 1.040 101 T HN 0.913 9.153 8.240 -0.000 0.000 0.528 102 K N -0.404 119.863 120.400 -0.223 0.000 2.283 102 K HA -0.052 4.264 4.320 -0.007 0.000 0.202 102 K C 1.209 177.894 176.600 0.140 0.000 1.048 102 K CA 0.898 57.206 56.287 0.034 0.000 0.948 102 K CB -0.379 32.222 32.500 0.168 0.000 0.742 102 K HN 0.893 9.143 8.250 -0.000 0.000 0.458 103 W N 0.849 122.206 121.300 0.095 0.000 3.325 103 W HA 0.447 5.103 4.660 -0.007 0.000 0.370 103 W C -0.605 175.951 176.519 0.062 0.000 1.169 103 W CA -0.920 56.469 57.345 0.074 0.000 1.874 103 W CB 0.585 30.091 29.460 0.077 0.000 1.076 103 W HN -0.147 8.033 8.180 -0.000 0.000 0.684 104 K N -0.494 119.828 120.400 -0.131 0.000 3.291 104 K HA -0.191 4.125 4.320 -0.007 0.000 0.290 104 K C 0.019 176.537 176.600 -0.136 0.000 1.235 104 K CA 1.027 57.257 56.287 -0.095 0.000 0.848 104 K CB -2.281 30.228 32.500 0.014 0.000 1.295 104 K HN 0.472 8.722 8.250 -0.000 0.000 0.497 105 A N 1.277 123.911 122.820 -0.310 0.000 2.331 105 A HA 0.593 4.909 4.320 -0.007 0.000 0.283 105 A C -2.028 175.389 177.584 -0.279 0.000 1.142 105 A CA -1.193 50.713 52.037 -0.219 0.000 0.812 105 A CB 0.399 19.318 19.000 -0.134 0.000 1.074 105 A HN -0.002 8.148 8.150 -0.000 0.000 0.497 106 P HA 0.247 4.667 4.420 -0.000 0.000 0.275 106 P C -0.714 176.396 177.300 -0.316 0.000 1.228 106 P CA -0.068 62.703 63.100 -0.549 0.000 0.786 106 P CB 1.038 32.028 31.700 -1.183 0.000 0.927 107 V N 3.947 123.792 119.914 -0.116 0.000 2.328 107 V HA 0.118 4.234 4.120 -0.007 0.000 0.278 107 V C 0.498 176.691 176.094 0.166 0.000 1.021 107 V CA -0.718 61.575 62.300 -0.011 0.000 0.838 107 V CB 1.415 33.300 31.823 0.104 0.000 0.999 107 V HN 0.253 8.443 8.190 -0.000 0.000 0.447 108 V N 5.174 125.098 119.914 0.017 0.000 2.389 108 V HA 0.285 4.401 4.120 -0.007 0.000 0.264 108 V C -0.403 175.799 176.094 0.181 0.000 1.049 108 V CA -0.319 62.120 62.300 0.232 0.000 0.932 108 V CB 0.162 32.028 31.823 0.071 0.000 1.011 108 V HN 0.842 9.032 8.190 -0.000 0.000 0.475 109 W N 2.111 123.617 121.300 0.344 0.000 2.639 109 W HA 0.554 5.211 4.660 -0.006 0.000 0.347 109 W C 0.334 177.026 176.519 0.287 0.000 1.067 109 W CA -0.899 56.593 57.345 0.245 0.000 1.218 109 W CB 1.030 30.557 29.460 0.111 0.000 1.393 109 W HN 0.478 8.658 8.180 -0.000 0.000 0.557 110 E N 0.936 121.398 120.200 0.437 0.000 2.480 110 E HA 0.312 4.658 4.350 -0.007 0.000 0.258 110 E C 1.057 177.710 176.600 0.089 0.000 0.984 110 E CA 2.087 58.644 56.400 0.262 0.000 0.930 110 E CB 0.246 30.017 29.700 0.119 0.000 0.936 110 E HN 0.652 9.012 8.360 -0.000 0.000 0.466 111 G N 2.896 111.615 108.800 -0.135 0.000 2.284 111 G HA2 -0.340 3.616 3.960 -0.007 0.000 0.216 111 G HA3 -0.340 3.616 3.960 -0.007 0.000 0.216 111 G C 1.070 175.868 174.900 -0.169 0.000 1.009 111 G CA 0.710 45.716 45.100 -0.158 0.000 0.625 111 G HN 0.851 9.141 8.290 -0.000 0.000 0.501 112 T N -1.111 113.409 114.554 -0.057 0.000 3.067 112 T HA 0.426 4.772 4.350 -0.007 0.000 0.257 112 T C 0.955 175.664 174.700 0.016 0.000 1.105 112 T CA 1.176 63.206 62.100 -0.117 0.000 1.104 112 T CB -0.195 68.588 68.868 -0.142 0.000 0.925 112 T HN 1.294 9.534 8.240 -0.000 0.000 0.498 113 Y N 0.095 120.517 120.300 0.203 0.000 2.420 113 Y HA 0.739 5.285 4.550 -0.006 0.000 0.334 113 Y C -0.300 175.757 175.900 0.261 0.000 1.094 113 Y CA -2.330 55.994 58.100 0.374 0.000 1.126 113 Y CB 0.765 39.523 38.460 0.497 0.000 1.217 113 Y HN -0.166 8.114 8.280 -0.000 0.000 0.462 114 N N 3.191 122.171 118.700 0.467 0.000 2.699 114 N HA 0.168 4.904 4.740 -0.007 0.000 0.232 114 N C 0.601 176.324 175.510 0.355 0.000 1.027 114 N CA -0.271 52.962 53.050 0.304 0.000 0.920 114 N CB 0.493 39.123 38.487 0.237 0.000 1.148 114 N HN 0.963 9.343 8.380 -0.000 0.000 0.509 115 R N 2.374 123.105 120.500 0.385 0.000 2.115 115 R HA -0.024 4.312 4.340 -0.007 0.000 0.230 115 R C 1.595 178.020 176.300 0.209 0.000 1.111 115 R CA 1.451 57.739 56.100 0.314 0.000 0.976 115 R CB 0.105 30.607 30.300 0.337 0.000 0.870 115 R HN 0.541 8.811 8.270 -0.000 0.000 0.445 116 A N 0.215 123.140 122.820 0.176 0.000 1.902 116 A HA -0.119 4.197 4.320 -0.007 0.000 0.217 116 A C 2.215 179.879 177.584 0.134 0.000 1.181 116 A CA 1.493 53.611 52.037 0.136 0.000 0.623 116 A CB -0.641 18.423 19.000 0.105 0.000 0.818 116 A HN 0.210 8.360 8.150 -0.000 0.000 0.443 117 V N 0.069 120.067 119.914 0.139 0.000 2.287 117 V HA -0.278 3.838 4.120 -0.007 0.000 0.248 117 V C 2.579 178.739 176.094 0.111 0.000 1.053 117 V CA 2.172 64.547 62.300 0.125 0.000 1.027 117 V CB -0.623 31.286 31.823 0.143 0.000 0.646 117 V HN 0.585 8.775 8.190 -0.000 0.000 0.447 118 L N -0.725 120.563 121.223 0.109 0.000 2.109 118 L HA -0.116 4.220 4.340 -0.007 0.000 0.207 118 L C 2.314 179.296 176.870 0.186 0.000 1.086 118 L CA 1.245 56.115 54.840 0.050 0.000 0.760 118 L CB -0.668 41.391 42.059 0.001 0.000 0.910 118 L HN 0.315 8.545 8.230 -0.000 0.000 0.437 119 D N 0.008 120.544 120.400 0.225 0.000 2.144 119 D HA -0.195 4.441 4.640 -0.007 0.000 0.199 119 D C 1.882 178.342 176.300 0.267 0.000 0.984 119 D CA 1.251 55.445 54.000 0.323 0.000 0.834 119 D CB -0.136 40.816 40.800 0.254 0.000 0.955 119 D HN 0.281 8.651 8.370 -0.000 0.000 0.465 120 N N -0.441 118.364 118.700 0.175 0.000 2.142 120 N HA -0.210 4.526 4.740 -0.007 0.000 0.186 120 N C 1.847 177.436 175.510 0.130 0.000 1.023 120 N CA 0.869 53.998 53.050 0.132 0.000 0.852 120 N CB -0.306 38.243 38.487 0.105 0.000 0.998 120 N HN 0.158 8.538 8.380 -0.000 0.000 0.424 121 Y N -0.193 120.089 120.300 -0.031 0.000 2.145 121 Y HA -0.200 4.347 4.550 -0.006 0.000 0.286 121 Y C 1.530 177.358 175.900 -0.120 0.000 1.145 121 Y CA 1.779 59.798 58.100 -0.134 0.000 1.148 121 Y CB -0.552 37.724 38.460 -0.307 0.000 0.981 121 Y HN 0.200 8.480 8.280 -0.000 0.000 0.507 122 Y N -0.620 119.734 120.300 0.091 0.000 2.314 122 Y HA -0.073 4.473 4.550 -0.007 0.000 0.293 122 Y C 2.604 178.537 175.900 0.055 0.000 1.129 122 Y CA 0.506 58.596 58.100 -0.015 0.000 1.201 122 Y CB -0.452 37.974 38.460 -0.057 0.000 0.999 122 Y HN 0.244 8.524 8.280 -0.000 0.000 0.541 123 A N 0.482 123.486 122.820 0.305 0.000 1.933 123 A HA -0.221 4.095 4.320 -0.007 0.000 0.218 123 A C 2.010 179.641 177.584 0.077 0.000 1.175 123 A CA 1.751 53.910 52.037 0.203 0.000 0.628 123 A CB -0.444 18.633 19.000 0.128 0.000 0.814 123 A HN 0.367 8.517 8.150 -0.000 0.000 0.444 124 K N -0.346 120.061 120.400 0.011 0.000 2.283 124 K HA -0.085 4.231 4.320 -0.007 0.000 0.202 124 K C 1.951 178.517 176.600 -0.056 0.000 1.048 124 K CA 1.283 57.551 56.287 -0.032 0.000 0.948 124 K CB -0.063 32.401 32.500 -0.060 0.000 0.742 124 K HN 0.630 8.880 8.250 -0.000 0.000 0.458 125 Q N 0.457 120.206 119.800 -0.085 0.000 2.451 125 Q HA 0.048 4.384 4.340 -0.007 0.000 0.206 125 Q C -0.483 175.530 176.000 0.020 0.000 0.947 125 Q CA 0.174 55.943 55.803 -0.057 0.000 0.937 125 Q CB 0.235 28.920 28.738 -0.088 0.000 1.025 125 Q HN 0.083 8.353 8.270 -0.000 0.000 0.511 126 K N 1.486 121.919 120.400 0.055 0.000 3.619 126 K HA -0.170 4.146 4.320 -0.007 0.000 0.275 126 K C -0.246 176.406 176.600 0.086 0.000 0.993 126 K CA 0.102 56.432 56.287 0.073 0.000 0.787 126 K CB -1.802 30.722 32.500 0.040 0.000 1.431 126 K HN 0.433 8.683 8.250 -0.000 0.000 0.451 127 I N -2.566 118.079 120.570 0.125 0.000 2.886 127 I HA 0.376 4.542 4.170 -0.007 0.000 0.299 127 I C 0.315 176.483 176.117 0.086 0.000 1.044 127 I CA -0.327 61.032 61.300 0.099 0.000 1.310 127 I CB 1.517 39.580 38.000 0.105 0.000 1.441 127 I HN -0.043 8.167 8.210 -0.000 0.000 0.578 128 T N 3.729 118.325 114.554 0.069 0.000 2.863 128 T HA 0.588 4.934 4.350 -0.007 0.000 0.285 128 T C -0.502 174.252 174.700 0.089 0.000 1.009 128 T CA -0.476 61.664 62.100 0.067 0.000 0.989 128 T CB 1.943 70.847 68.868 0.059 0.000 1.004 128 T HN 0.452 8.692 8.240 -0.000 0.000 0.455 129 V N 1.990 121.960 119.914 0.092 0.000 2.495 129 V HA 0.791 4.907 4.120 -0.007 0.000 0.298 129 V C 0.662 176.901 176.094 0.241 0.000 1.031 129 V CA -0.771 61.632 62.300 0.172 0.000 0.871 129 V CB 1.821 33.705 31.823 0.101 0.000 0.988 129 V HN 1.041 9.231 8.190 -0.000 0.000 0.432 130 G N 2.796 111.782 108.800 0.310 0.000 2.434 130 G HA2 0.687 4.643 3.960 -0.007 0.000 0.330 130 G HA3 0.687 4.643 3.960 -0.007 0.000 0.330 130 G C -1.530 173.617 174.900 0.413 0.000 1.155 130 G CA -0.517 44.792 45.100 0.348 0.000 0.917 130 G HN 0.609 8.899 8.290 -0.000 0.000 0.493 131 L N 1.179 122.610 121.223 0.346 0.000 2.482 131 L HA 0.541 4.877 4.340 -0.007 0.000 0.269 131 L C 0.324 177.390 176.870 0.326 0.000 0.967 131 L CA -0.483 54.521 54.840 0.273 0.000 0.851 131 L CB 1.800 43.886 42.059 0.046 0.000 1.242 131 L HN 0.728 8.958 8.230 -0.000 0.000 0.404 132 T N 1.793 116.496 114.554 0.249 0.000 2.882 132 T HA 0.742 5.088 4.350 -0.007 0.000 0.287 132 T C -0.516 174.227 174.700 0.071 0.000 0.992 132 T CA -0.679 61.526 62.100 0.176 0.000 1.076 132 T CB 1.669 70.597 68.868 0.100 0.000 0.961 132 T HN 0.620 8.860 8.240 -0.000 0.000 0.490 133 V N 3.537 123.436 119.914 -0.024 0.000 2.851 133 V HA 0.656 4.772 4.120 -0.007 0.000 0.307 133 V C -1.889 174.118 176.094 -0.146 0.000 1.129 133 V CA -1.113 61.113 62.300 -0.124 0.000 0.932 133 V CB 1.659 33.243 31.823 -0.399 0.000 1.024 133 V HN 0.907 9.097 8.190 -0.000 0.000 0.426 134 F N 4.656 124.505 119.950 -0.169 0.000 2.443 134 F HA 0.868 5.392 4.527 -0.006 0.000 0.335 134 F C 0.524 176.255 175.800 -0.115 0.000 1.104 134 F CA -0.247 57.683 58.000 -0.117 0.000 1.013 134 F CB 2.161 41.089 39.000 -0.120 0.000 1.136 134 F HN 0.675 8.975 8.300 -0.000 0.000 0.470 135 A N 3.088 125.958 122.820 0.084 0.000 2.446 135 A HA 0.732 5.048 4.320 -0.007 0.000 0.282 135 A C -1.735 175.905 177.584 0.093 0.000 1.102 135 A CA -0.569 51.525 52.037 0.094 0.000 0.737 135 A CB 0.811 19.875 19.000 0.107 0.000 1.212 135 A HN 0.500 8.650 8.150 -0.000 0.000 0.434 136 V N 2.573 122.527 119.914 0.066 0.000 2.540 136 V HA 0.812 4.928 4.120 -0.007 0.000 0.302 136 V C 0.985 177.150 176.094 0.118 0.000 1.035 136 V CA 0.761 63.102 62.300 0.069 0.000 0.873 136 V CB 0.848 32.692 31.823 0.035 0.000 0.992 136 V HN 2.272 10.462 8.190 -0.000 0.000 0.428 137 G N 5.477 114.351 108.800 0.123 0.000 2.539 137 G HA2 -0.222 3.734 3.960 -0.007 0.000 0.256 137 G HA3 -0.222 3.734 3.960 -0.007 0.000 0.256 137 G C 0.574 175.572 174.900 0.164 0.000 1.233 137 G CA 0.292 45.478 45.100 0.143 0.000 0.936 137 G HN 0.674 8.964 8.290 -0.000 0.000 0.571 138 R N -0.215 120.372 120.500 0.145 0.000 2.316 138 R HA 0.033 4.369 4.340 -0.007 0.000 0.202 138 R C 2.086 178.400 176.300 0.023 0.000 1.029 138 R CA 1.420 57.552 56.100 0.053 0.000 1.018 138 R CB -0.302 29.960 30.300 -0.065 0.000 0.888 138 R HN 0.653 8.923 8.270 -0.000 0.000 0.471 139 Y N 1.131 121.436 120.300 0.008 0.000 2.333 139 Y HA -0.143 4.403 4.550 -0.007 0.000 0.290 139 Y C 2.289 178.238 175.900 0.082 0.000 1.144 139 Y CA 0.735 58.894 58.100 0.098 0.000 1.228 139 Y CB -0.294 38.285 38.460 0.199 0.000 0.985 139 Y HN -0.043 8.237 8.280 -0.000 0.000 0.542 140 I N -0.000 120.692 120.570 0.204 0.000 2.113 140 I HA -0.294 3.872 4.170 -0.007 0.000 0.238 140 I C 2.006 178.165 176.117 0.070 0.000 1.070 140 I CA 1.606 62.980 61.300 0.124 0.000 1.332 140 I CB -0.366 37.689 38.000 0.090 0.000 1.044 140 I HN 0.126 8.336 8.210 -0.000 0.000 0.402 141 E N -0.188 120.040 120.200 0.048 0.000 2.153 141 E HA -0.200 4.146 4.350 -0.007 0.000 0.194 141 E C 2.135 178.692 176.600 -0.072 0.000 0.988 141 E CA 1.041 57.445 56.400 0.005 0.000 0.811 141 E CB -0.181 29.535 29.700 0.027 0.000 0.746 141 E HN 0.523 8.883 8.360 -0.000 0.000 0.466 142 H N -2.043 116.834 119.070 -0.322 0.000 2.403 142 H HA 0.007 4.559 4.556 -0.007 0.000 0.298 142 H C 0.884 175.879 175.328 -0.556 0.000 1.059 142 H CA 1.265 56.933 56.048 -0.633 0.000 1.363 142 H CB 0.404 29.436 29.762 -1.216 0.000 1.410 142 H HN 0.307 8.587 8.280 -0.000 0.000 0.528 143 Y N -1.798 118.585 120.300 0.138 0.000 2.435 143 Y HA -0.005 4.541 4.550 -0.007 0.000 0.270 143 Y C 1.917 177.888 175.900 0.119 0.000 1.093 143 Y CA -0.342 57.831 58.100 0.122 0.000 1.226 143 Y CB 0.404 38.943 38.460 0.131 0.000 1.289 143 Y HN -0.036 8.244 8.280 -0.000 0.000 0.529 144 L N 1.331 122.678 121.223 0.207 0.000 2.072 144 L HA -0.094 4.242 4.340 -0.007 0.000 0.205 144 L C 2.173 179.118 176.870 0.126 0.000 1.079 144 L CA 1.955 56.886 54.840 0.152 0.000 0.752 144 L CB -0.443 41.666 42.059 0.083 0.000 0.906 144 L HN 0.242 8.472 8.230 -0.000 0.000 0.436 145 E N -0.477 119.767 120.200 0.073 0.000 2.058 145 E HA -0.265 4.081 4.350 -0.007 0.000 0.194 145 E C 2.007 178.640 176.600 0.056 0.000 0.997 145 E CA 1.708 58.127 56.400 0.031 0.000 0.801 145 E CB -0.090 29.614 29.700 0.006 0.000 0.746 145 E HN 0.618 8.978 8.360 -0.000 0.000 0.450 146 E N -0.370 119.893 120.200 0.104 0.000 2.110 146 E HA -0.185 4.161 4.350 -0.007 0.000 0.193 146 E C 1.843 178.522 176.600 0.130 0.000 0.988 146 E CA 0.916 57.382 56.400 0.111 0.000 0.804 146 E CB -0.214 29.575 29.700 0.149 0.000 0.745 146 E HN 0.291 8.651 8.360 -0.000 0.000 0.458 147 F N 1.467 121.446 119.950 0.049 0.000 2.046 147 F HA -0.219 4.303 4.527 -0.007 0.000 0.297 147 F C 1.946 177.715 175.800 -0.051 0.000 1.123 147 F CA 1.483 59.499 58.000 0.027 0.000 1.199 147 F CB -0.149 38.851 39.000 0.000 0.000 0.972 147 F HN -0.091 8.209 8.300 -0.000 0.000 0.474 148 L N -0.667 120.548 121.223 -0.014 0.000 2.093 148 L HA -0.213 4.123 4.340 -0.007 0.000 0.208 148 L C 2.344 179.031 176.870 -0.305 0.000 1.085 148 L CA 1.678 56.339 54.840 -0.299 0.000 0.755 148 L CB -1.168 40.752 42.059 -0.231 0.000 0.904 148 L HN 0.168 8.398 8.230 -0.000 0.000 0.435 149 T N -0.669 113.792 114.554 -0.154 0.000 2.746 149 T HA -0.176 4.170 4.350 -0.007 0.000 0.267 149 T C 2.144 176.766 174.700 -0.129 0.000 1.039 149 T CA 1.733 63.764 62.100 -0.114 0.000 1.142 149 T CB -0.186 68.650 68.868 -0.052 0.000 0.866 149 T HN 0.556 8.796 8.240 -0.000 0.000 0.444 150 S N 1.729 117.370 115.700 -0.098 0.000 2.387 150 S HA 0.091 4.557 4.470 -0.007 0.000 0.226 150 S C 2.434 176.915 174.600 -0.197 0.000 1.026 150 S CA 0.862 59.054 58.200 -0.013 0.000 0.972 150 S CB -0.551 62.751 63.200 0.170 0.000 0.814 150 S HN 0.467 8.777 8.310 -0.000 0.000 0.477 151 A N 2.719 125.254 122.820 -0.475 0.000 1.902 151 A HA -0.133 4.183 4.320 -0.007 0.000 0.217 151 A C 2.106 179.478 177.584 -0.355 0.000 1.181 151 A CA 1.896 53.404 52.037 -0.882 0.000 0.623 151 A CB -1.419 16.936 19.000 -1.075 0.000 0.818 151 A HN 0.661 8.811 8.150 -0.000 0.000 0.443 152 N N -0.164 118.414 118.700 -0.203 0.000 2.104 152 N HA -0.212 4.524 4.740 -0.007 0.000 0.190 152 N C 1.693 177.160 175.510 -0.071 0.000 1.024 152 N CA 2.160 55.226 53.050 0.027 0.000 0.853 152 N CB -0.264 38.228 38.487 0.008 0.000 1.008 152 N HN 0.567 8.947 8.380 -0.000 0.000 0.424 153 K N -1.654 118.617 120.400 -0.214 0.000 2.103 153 K HA -0.082 4.234 4.320 -0.007 0.000 0.204 153 K C 0.925 177.291 176.600 -0.390 0.000 1.052 153 K CA 1.105 57.176 56.287 -0.360 0.000 0.945 153 K CB 0.047 32.205 32.500 -0.570 0.000 0.722 153 K HN 0.398 8.648 8.250 -0.000 0.000 0.443 154 H N -2.190 116.809 119.070 -0.118 0.000 3.255 154 H HA 0.068 4.620 4.556 -0.006 0.000 0.256 154 H C -0.672 174.605 175.328 -0.085 0.000 1.049 154 H CA -0.304 55.700 56.048 -0.073 0.000 1.202 154 H CB 0.303 30.061 29.762 -0.006 0.000 1.497 154 H HN 0.031 8.311 8.280 -0.000 0.000 0.503 155 F N 3.497 123.263 119.950 -0.307 0.000 2.421 155 F HA 0.232 4.755 4.527 -0.007 0.000 0.358 155 F C 0.685 176.462 175.800 -0.039 0.000 1.115 155 F CA -0.657 57.181 58.000 -0.270 0.000 1.160 155 F CB 0.370 39.071 39.000 -0.498 0.000 1.123 155 F HN -0.022 8.278 8.300 -0.000 0.000 0.508 156 M N 5.157 124.520 119.600 -0.394 0.000 2.302 156 M HA -0.185 4.291 4.480 -0.007 0.000 0.200 156 M C -0.537 175.748 176.300 -0.025 0.000 0.366 156 M CA 0.295 55.414 55.300 -0.301 0.000 0.440 156 M CB -2.870 29.396 32.600 -0.556 0.000 1.475 156 M HN 0.183 8.473 8.290 -0.000 0.000 0.905 157 V N 0.368 120.292 119.914 0.017 0.000 2.673 157 V HA 0.366 4.482 4.120 -0.007 0.000 0.303 157 V C 1.714 177.814 176.094 0.011 0.000 1.046 157 V CA 1.660 63.973 62.300 0.021 0.000 1.126 157 V CB 0.936 32.775 31.823 0.026 0.000 0.934 157 V HN 0.994 9.184 8.190 -0.000 0.000 0.487 158 G N 3.301 112.054 108.800 -0.078 0.000 2.176 158 G HA2 -0.163 3.793 3.960 -0.007 0.000 0.232 158 G HA3 -0.163 3.793 3.960 -0.007 0.000 0.232 158 G C 0.039 174.623 174.900 -0.528 0.000 0.986 158 G CA 0.018 44.964 45.100 -0.257 0.000 0.643 158 G HN 0.783 9.073 8.290 -0.000 0.000 0.522 159 H N 0.177 119.225 119.070 -0.037 0.000 2.690 159 H HA 0.421 4.973 4.556 -0.007 0.000 0.368 159 H C -2.711 172.587 175.328 -0.051 0.000 1.150 159 H CA -1.779 54.246 56.048 -0.038 0.000 1.174 159 H CB 2.118 31.847 29.762 -0.054 0.000 1.684 159 H HN 0.031 8.311 8.280 -0.000 0.000 0.538 160 P HA 0.036 4.456 4.420 -0.000 0.000 0.267 160 P C -0.480 176.815 177.300 -0.009 0.000 1.205 160 P CA 0.013 63.118 63.100 0.008 0.000 0.765 160 P CB 0.683 32.391 31.700 0.014 0.000 0.828 161 V N 5.207 125.067 119.914 -0.089 0.000 2.735 161 V HA 0.447 4.563 4.120 -0.007 0.000 0.310 161 V C 0.070 175.966 176.094 -0.330 0.000 1.061 161 V CA -0.572 61.634 62.300 -0.156 0.000 0.913 161 V CB 2.088 33.802 31.823 -0.182 0.000 1.005 161 V HN 0.345 8.535 8.190 -0.000 0.000 0.428 162 I N 4.176 124.547 120.570 -0.331 0.000 2.389 162 I HA 0.462 4.628 4.170 -0.007 0.000 0.288 162 I C -0.913 174.860 176.117 -0.573 0.000 0.999 162 I CA -0.218 60.800 61.300 -0.470 0.000 1.129 162 I CB 1.490 39.239 38.000 -0.418 0.000 1.288 162 I HN 0.426 8.636 8.210 -0.000 0.000 0.444 163 F N 5.502 125.316 119.950 -0.226 0.000 2.411 163 F HA 0.366 4.889 4.527 -0.006 0.000 0.350 163 F C -0.370 175.323 175.800 -0.179 0.000 1.114 163 F CA -0.631 57.275 58.000 -0.157 0.000 1.135 163 F CB 0.576 39.561 39.000 -0.026 0.000 1.120 163 F HN 0.314 8.614 8.300 -0.000 0.000 0.495 164 Y N 4.322 124.804 120.300 0.302 0.000 2.369 164 Y HA 0.513 5.058 4.550 -0.007 0.000 0.337 164 Y C -0.160 175.805 175.900 0.108 0.000 0.961 164 Y CA -0.789 57.453 58.100 0.237 0.000 1.186 164 Y CB 0.785 39.373 38.460 0.214 0.000 1.139 164 Y HN 0.375 8.655 8.280 -0.000 0.000 0.494 165 I N 4.673 125.385 120.570 0.237 0.000 2.339 165 I HA 0.348 4.514 4.170 -0.007 0.000 0.290 165 I C -0.626 175.490 176.117 -0.002 0.000 0.994 165 I CA -0.637 60.700 61.300 0.062 0.000 1.191 165 I CB 1.200 39.242 38.000 0.070 0.000 1.343 165 I HN 0.495 8.705 8.210 -0.000 0.000 0.458 166 M N 7.897 127.361 119.600 -0.226 0.000 2.114 166 M HA 0.486 4.962 4.480 -0.007 0.000 0.332 166 M C -0.620 175.597 176.300 -0.138 0.000 1.014 166 M CA -0.511 54.612 55.300 -0.295 0.000 0.956 166 M CB 1.520 33.546 32.600 -0.956 0.000 1.551 166 M HN 0.407 8.697 8.290 -0.000 0.000 0.427 167 V N 0.208 120.113 119.914 -0.014 0.000 3.078 167 V HA 0.685 4.801 4.120 -0.007 0.000 0.311 167 V C 0.073 176.200 176.094 0.054 0.000 1.138 167 V CA -0.770 61.548 62.300 0.030 0.000 1.007 167 V CB 2.114 33.958 31.823 0.035 0.000 1.045 167 V HN 0.846 9.036 8.190 -0.000 0.000 0.432 168 D N 0.008 120.445 120.400 0.062 0.000 2.333 168 D HA 0.049 4.685 4.640 -0.007 0.000 0.208 168 D C 0.078 176.410 176.300 0.054 0.000 0.984 168 D CA 0.676 54.712 54.000 0.061 0.000 0.873 168 D CB 0.485 41.321 40.800 0.061 0.000 0.935 168 D HN 0.686 9.056 8.370 -0.000 0.000 0.521 169 D N 0.259 120.690 120.400 0.051 0.000 2.386 169 D HA 0.113 4.750 4.640 -0.007 0.000 0.247 169 D C 0.771 177.096 176.300 0.041 0.000 1.336 169 D CA -0.635 53.391 54.000 0.044 0.000 0.976 169 D CB 1.830 42.655 40.800 0.042 0.000 1.257 169 D HN -0.258 8.112 8.370 -0.000 0.000 0.570 170 V N 2.659 122.596 119.914 0.039 0.000 2.809 170 V HA -0.143 3.974 4.120 -0.007 0.000 0.256 170 V C 2.366 178.480 176.094 0.033 0.000 1.080 170 V CA 1.935 64.258 62.300 0.037 0.000 1.102 170 V CB -0.434 31.409 31.823 0.034 0.000 0.705 170 V HN 0.678 8.868 8.190 -0.000 0.000 0.475 171 S N 0.520 116.237 115.700 0.029 0.000 2.474 171 S HA -0.135 4.331 4.470 -0.007 0.000 0.235 171 S C 1.799 176.414 174.600 0.024 0.000 0.997 171 S CA 0.889 59.104 58.200 0.025 0.000 0.949 171 S CB -0.341 62.872 63.200 0.022 0.000 0.766 171 S HN 0.625 8.935 8.310 -0.000 0.000 0.517 172 R N 0.487 121.003 120.500 0.027 0.000 2.359 172 R HA 0.368 4.704 4.340 -0.007 0.000 0.231 172 R C 0.391 176.704 176.300 0.021 0.000 0.913 172 R CA -0.100 56.015 56.100 0.025 0.000 1.075 172 R CB 0.067 30.386 30.300 0.031 0.000 1.087 172 R HN 0.647 8.917 8.270 -0.000 0.000 0.515 173 M N 1.727 121.340 119.600 0.022 0.000 2.200 173 M HA 0.294 4.770 4.480 -0.007 0.000 0.355 173 M C -2.292 174.005 176.300 -0.007 0.000 1.283 173 M CA -1.582 53.724 55.300 0.011 0.000 1.124 173 M CB 0.627 33.240 32.600 0.022 0.000 1.625 173 M HN -0.266 8.024 8.290 -0.000 0.000 0.463 174 P HA 0.168 4.588 4.420 -0.000 0.000 0.281 174 P C -1.156 176.097 177.300 -0.079 0.000 1.286 174 P CA 0.043 63.120 63.100 -0.039 0.000 0.772 174 P CB 0.543 32.221 31.700 -0.035 0.000 0.862 175 L N 5.383 126.574 121.223 -0.053 0.000 2.512 175 L HA 0.267 4.603 4.340 -0.007 0.000 0.247 175 L C 1.161 177.991 176.870 -0.065 0.000 1.204 175 L CA -0.871 53.930 54.840 -0.065 0.000 1.153 175 L CB -0.408 41.669 42.059 0.029 0.000 1.415 175 L HN 0.386 8.616 8.230 -0.000 0.000 0.406 176 I N -2.133 118.369 120.570 -0.112 0.000 3.060 176 I HA 0.156 4.323 4.170 -0.007 0.000 0.285 176 I C 0.475 176.565 176.117 -0.044 0.000 1.190 176 I CA -0.367 60.888 61.300 -0.074 0.000 1.363 176 I CB 0.589 38.533 38.000 -0.093 0.000 1.396 176 I HN 0.387 8.597 8.210 -0.000 0.000 0.607 177 E N 3.734 123.923 120.200 -0.018 0.000 2.316 177 E HA 0.380 4.726 4.350 -0.007 0.000 0.275 177 E C -1.193 175.413 176.600 0.011 0.000 1.029 177 E CA -0.566 55.839 56.400 0.008 0.000 0.871 177 E CB 0.920 30.624 29.700 0.007 0.000 1.022 177 E HN 0.548 8.908 8.360 -0.000 0.000 0.418 178 L N 3.162 124.412 121.223 0.045 0.000 2.344 178 L HA 0.539 4.876 4.340 -0.007 0.000 0.272 178 L C 0.825 177.720 176.870 0.042 0.000 1.035 178 L CA -0.799 54.080 54.840 0.065 0.000 0.807 178 L CB 1.656 43.791 42.059 0.127 0.000 1.237 178 L HN 0.660 8.890 8.230 -0.000 0.000 0.442 179 G N 0.754 109.574 108.800 0.033 0.000 2.537 179 G HA2 0.518 4.474 3.960 -0.007 0.000 0.297 179 G HA3 0.518 4.474 3.960 -0.007 0.000 0.297 179 G C -2.654 172.249 174.900 0.004 0.000 1.310 179 G CA -1.325 43.781 45.100 0.011 0.000 1.027 179 G HN 0.338 8.628 8.290 -0.000 0.000 0.505 180 P HA 0.139 4.559 4.420 -0.000 0.000 0.262 180 P C 0.558 177.844 177.300 -0.023 0.000 1.182 180 P CA 0.335 63.426 63.100 -0.015 0.000 0.761 180 P CB 0.354 32.043 31.700 -0.019 0.000 0.795 181 L N -1.054 120.151 121.223 -0.029 0.000 4.759 181 L HA -0.277 4.059 4.340 -0.007 0.000 0.419 181 L C 0.289 177.117 176.870 -0.069 0.000 1.093 181 L CA 0.727 55.542 54.840 -0.042 0.000 1.037 181 L CB -1.135 40.900 42.059 -0.041 0.000 2.095 181 L HN 0.478 8.708 8.230 -0.000 0.000 0.739 182 R N 0.259 120.719 120.500 -0.067 0.000 2.532 182 R HA 0.792 5.128 4.340 -0.007 0.000 0.295 182 R C 0.070 176.324 176.300 -0.078 0.000 0.968 182 R CA 0.335 56.355 56.100 -0.135 0.000 0.916 182 R CB 1.981 32.250 30.300 -0.052 0.000 1.124 182 R HN 0.253 8.523 8.270 -0.000 0.000 0.463 183 S N 1.096 116.719 115.700 -0.128 0.000 2.656 183 S HA 0.805 5.271 4.470 -0.007 0.000 0.273 183 S C -1.168 173.475 174.600 0.071 0.000 1.168 183 S CA -0.974 57.230 58.200 0.006 0.000 0.817 183 S CB 1.276 64.444 63.200 -0.052 0.000 1.146 183 S HN 0.542 8.852 8.310 -0.000 0.000 0.475 184 F N -0.921 118.983 119.950 -0.076 0.000 2.715 184 F HA 0.919 5.443 4.527 -0.004 0.000 0.318 184 F C -1.559 174.197 175.800 -0.073 0.000 1.141 184 F CA -1.046 56.923 58.000 -0.051 0.000 0.950 184 F CB 1.405 40.453 39.000 0.080 0.000 1.374 184 F HN 0.989 9.289 8.300 -0.000 0.000 0.477 185 K N 0.909 121.319 120.400 0.017 0.000 2.551 185 K HA 0.786 5.102 4.320 -0.007 0.000 0.269 185 K C -2.410 174.160 176.600 -0.050 0.000 0.949 185 K CA -1.064 55.088 56.287 -0.225 0.000 0.849 185 K CB 2.492 34.809 32.500 -0.306 0.000 1.411 185 K HN 0.605 8.855 8.250 -0.000 0.000 0.432 186 V N 1.960 121.723 119.914 -0.252 0.000 2.604 186 V HA 0.566 4.682 4.120 -0.007 0.000 0.305 186 V C -1.297 174.525 176.094 -0.454 0.000 1.043 186 V CA -0.659 61.556 62.300 -0.143 0.000 0.888 186 V CB 1.050 32.913 31.823 0.067 0.000 0.995 186 V HN 0.657 8.847 8.190 -0.000 0.000 0.429 187 F N 2.339 122.307 119.950 0.030 0.000 2.520 187 F HA 0.525 5.048 4.527 -0.006 0.000 0.322 187 F C 0.166 175.969 175.800 0.005 0.000 1.103 187 F CA -0.781 57.234 58.000 0.025 0.000 0.926 187 F CB 1.929 40.953 39.000 0.040 0.000 1.154 187 F HN 0.286 8.586 8.300 -0.000 0.000 0.453 188 K N 5.138 125.659 120.400 0.202 0.000 2.276 188 K HA 0.576 4.892 4.320 -0.007 0.000 0.285 188 K C -0.783 175.894 176.600 0.129 0.000 1.062 188 K CA -0.285 56.078 56.287 0.126 0.000 0.918 188 K CB 0.533 33.087 32.500 0.090 0.000 1.055 188 K HN 0.758 9.008 8.250 -0.000 0.000 0.477 189 I N 0.196 120.825 120.570 0.098 0.000 2.910 189 I HA 0.441 4.607 4.170 -0.007 0.000 0.310 189 I C -0.537 175.625 176.117 0.074 0.000 1.043 189 I CA -1.227 60.128 61.300 0.092 0.000 1.053 189 I CB 1.634 39.697 38.000 0.104 0.000 1.242 189 I HN 0.464 8.674 8.210 -0.000 0.000 0.452 190 K N 4.073 124.511 120.400 0.063 0.000 2.368 190 K HA 0.347 4.663 4.320 -0.007 0.000 0.282 190 K C -2.364 174.266 176.600 0.050 0.000 1.035 190 K CA -1.303 55.013 56.287 0.048 0.000 0.973 190 K CB 0.597 33.118 32.500 0.035 0.000 0.957 190 K HN 0.502 8.752 8.250 -0.000 0.000 0.474 191 P HA 0.127 4.547 4.420 -0.000 0.000 0.287 191 P C -0.884 176.432 177.300 0.026 0.000 1.307 191 P CA -0.262 62.863 63.100 0.041 0.000 0.777 191 P CB 0.962 32.689 31.700 0.044 0.000 0.883 192 E N 2.899 123.108 120.200 0.015 0.000 2.392 192 E HA 0.054 4.400 4.350 -0.007 0.000 0.259 192 E C 1.160 177.760 176.600 -0.001 0.000 1.108 192 E CA -0.187 56.212 56.400 -0.002 0.000 0.916 192 E CB 1.020 30.707 29.700 -0.022 0.000 0.989 192 E HN 0.410 8.770 8.360 -0.000 0.000 0.432 193 K N 1.061 121.455 120.400 -0.011 0.000 2.103 193 K HA -0.044 4.272 4.320 -0.007 0.000 0.204 193 K C 0.611 177.203 176.600 -0.013 0.000 1.052 193 K CA 0.931 57.214 56.287 -0.006 0.000 0.945 193 K CB 0.098 32.590 32.500 -0.013 0.000 0.722 193 K HN 0.197 8.447 8.250 -0.000 0.000 0.443 194 R N 1.142 121.604 120.500 -0.063 0.000 2.407 194 R HA 0.074 4.410 4.340 -0.007 0.000 0.303 194 R C 1.104 177.322 176.300 -0.137 0.000 0.981 194 R CA -0.571 55.450 56.100 -0.132 0.000 0.905 194 R CB 0.689 30.842 30.300 -0.246 0.000 1.099 194 R HN 0.348 8.618 8.270 -0.000 0.000 0.459 195 W N 3.355 124.601 121.300 -0.090 0.000 2.331 195 W HA -0.249 4.407 4.660 -0.007 0.000 0.291 195 W C 0.383 176.788 176.519 -0.191 0.000 1.214 195 W CA 0.919 58.190 57.345 -0.124 0.000 1.228 195 W CB -0.333 29.069 29.460 -0.097 0.000 1.135 195 W HN 0.573 8.753 8.180 -0.000 0.000 0.537 196 Q N 1.092 120.229 119.800 -1.106 0.000 2.124 196 Q HA -0.159 4.177 4.340 -0.007 0.000 0.202 196 Q C 1.835 177.543 176.000 -0.487 0.000 0.977 196 Q CA 2.339 57.450 55.803 -1.154 0.000 0.850 196 Q CB -0.540 27.400 28.738 -1.329 0.000 0.901 196 Q HN 0.244 8.514 8.270 -0.000 0.000 0.429 197 D N -0.230 119.972 120.400 -0.330 0.000 2.234 197 D HA -0.030 4.606 4.640 -0.007 0.000 0.205 197 D C 1.768 177.998 176.300 -0.117 0.000 0.962 197 D CA 0.610 54.511 54.000 -0.166 0.000 0.855 197 D CB 0.087 40.814 40.800 -0.122 0.000 0.951 197 D HN 0.278 8.648 8.370 -0.000 0.000 0.500 198 I N 0.619 121.126 120.570 -0.105 0.000 2.179 198 I HA -0.265 3.901 4.170 -0.007 0.000 0.242 198 I C 2.585 178.614 176.117 -0.147 0.000 1.088 198 I CA 0.864 62.110 61.300 -0.091 0.000 1.357 198 I CB -0.240 37.727 38.000 -0.056 0.000 1.051 198 I HN -0.068 8.142 8.210 -0.000 0.000 0.409 199 S N 0.638 116.270 115.700 -0.113 0.000 2.356 199 S HA -0.165 4.301 4.470 -0.007 0.000 0.223 199 S C 2.123 176.649 174.600 -0.125 0.000 1.032 199 S CA 1.409 59.543 58.200 -0.109 0.000 1.005 199 S CB -0.124 63.090 63.200 0.023 0.000 0.867 199 S HN 0.284 8.594 8.310 -0.000 0.000 0.449 200 M N 0.120 119.670 119.600 -0.083 0.000 2.254 200 M HA 0.050 4.526 4.480 -0.007 0.000 0.265 200 M C 2.052 178.342 176.300 -0.016 0.000 1.066 200 M CA 0.914 56.203 55.300 -0.019 0.000 1.123 200 M CB -0.277 32.329 32.600 0.010 0.000 1.388 200 M HN 0.326 8.616 8.290 -0.000 0.000 0.425 201 M N -0.105 119.451 119.600 -0.072 0.000 2.460 201 M HA -0.100 4.376 4.480 -0.007 0.000 0.263 201 M C 1.858 177.968 176.300 -0.317 0.000 1.071 201 M CA 1.351 56.559 55.300 -0.153 0.000 1.096 201 M CB -0.892 31.643 32.600 -0.108 0.000 1.408 201 M HN 0.250 8.540 8.290 -0.000 0.000 0.463 202 R N -0.523 119.718 120.500 -0.431 0.000 2.117 202 R HA -0.175 4.161 4.340 -0.007 0.000 0.243 202 R C 2.084 178.188 176.300 -0.327 0.000 1.143 202 R CA 1.237 56.917 56.100 -0.700 0.000 0.968 202 R CB -0.274 29.436 30.300 -0.983 0.000 0.863 202 R HN 0.324 8.594 8.270 -0.000 0.000 0.444 203 M N 0.699 120.157 119.600 -0.237 0.000 2.117 203 M HA -0.175 4.302 4.480 -0.007 0.000 0.262 203 M C 2.192 178.314 176.300 -0.297 0.000 1.065 203 M CA 1.610 56.814 55.300 -0.160 0.000 1.114 203 M CB -0.781 31.790 32.600 -0.048 0.000 1.361 203 M HN 0.090 8.380 8.290 -0.000 0.000 0.408 204 K N -0.165 119.830 120.400 -0.675 0.000 2.002 204 K HA -0.131 4.185 4.320 -0.007 0.000 0.209 204 K C 1.880 178.277 176.600 -0.340 0.000 1.048 204 K CA 1.929 57.742 56.287 -0.788 0.000 0.930 204 K CB -0.020 31.660 32.500 -1.367 0.000 0.714 204 K HN 0.239 8.489 8.250 -0.000 0.000 0.438 205 T N 1.680 116.108 114.554 -0.211 0.000 2.746 205 T HA -0.119 4.227 4.350 -0.007 0.000 0.267 205 T C 1.883 176.641 174.700 0.096 0.000 1.039 205 T CA 1.572 63.685 62.100 0.022 0.000 1.142 205 T CB -0.182 68.808 68.868 0.203 0.000 0.866 205 T HN 0.194 8.434 8.240 -0.000 0.000 0.444 206 I N 1.204 121.819 120.570 0.075 0.000 2.163 206 I HA -0.128 4.038 4.170 -0.007 0.000 0.243 206 I C 2.895 178.987 176.117 -0.041 0.000 1.085 206 I CA 1.369 62.692 61.300 0.039 0.000 1.347 206 I CB -0.710 37.329 38.000 0.065 0.000 1.044 206 I HN 0.317 8.527 8.210 -0.000 0.000 0.408 207 G N 0.179 108.933 108.800 -0.075 0.000 2.418 207 G HA2 -0.229 3.727 3.960 -0.007 0.000 0.217 207 G HA3 -0.229 3.727 3.960 -0.007 0.000 0.217 207 G C 1.506 176.331 174.900 -0.125 0.000 1.158 207 G CA 0.632 45.670 45.100 -0.103 0.000 0.771 207 G HN 0.412 8.702 8.290 -0.000 0.000 0.545 208 E N -0.258 119.867 120.200 -0.125 0.000 2.085 208 E HA -0.145 4.201 4.350 -0.007 0.000 0.194 208 E C 2.248 178.693 176.600 -0.258 0.000 0.994 208 E CA 0.944 57.239 56.400 -0.175 0.000 0.801 208 E CB -0.218 29.372 29.700 -0.184 0.000 0.743 208 E HN 0.526 8.886 8.360 -0.000 0.000 0.453 209 H N -0.028 118.876 119.070 -0.276 0.000 2.428 209 H HA -0.026 4.526 4.556 -0.007 0.000 0.296 209 H C 2.261 177.241 175.328 -0.580 0.000 1.062 209 H CA 0.899 56.682 56.048 -0.442 0.000 1.350 209 H CB 0.121 29.578 29.762 -0.508 0.000 1.403 209 H HN 0.182 8.462 8.280 -0.000 0.000 0.533 210 I N 0.156 120.544 120.570 -0.303 0.000 2.179 210 I HA -0.234 3.932 4.170 -0.007 0.000 0.242 210 I C 2.468 178.407 176.117 -0.297 0.000 1.088 210 I CA 0.756 61.867 61.300 -0.315 0.000 1.357 210 I CB -0.124 37.750 38.000 -0.210 0.000 1.051 210 I HN -0.001 8.209 8.210 -0.000 0.000 0.409 211 V N 0.894 120.672 119.914 -0.225 0.000 2.343 211 V HA -0.269 3.847 4.120 -0.007 0.000 0.247 211 V C 2.610 178.613 176.094 -0.151 0.000 1.051 211 V CA 2.007 64.200 62.300 -0.179 0.000 1.036 211 V CB -0.958 30.789 31.823 -0.126 0.000 0.654 211 V HN 0.493 8.683 8.190 -0.000 0.000 0.451 212 A N -0.018 122.709 122.820 -0.154 0.000 1.929 212 A HA -0.130 4.186 4.320 -0.007 0.000 0.216 212 A C 1.899 179.555 177.584 0.121 0.000 1.176 212 A CA 2.237 54.257 52.037 -0.029 0.000 0.628 212 A CB -0.333 18.631 19.000 -0.060 0.000 0.816 212 A HN 0.945 9.095 8.150 -0.000 0.000 0.444 213 H N -5.047 114.000 119.070 -0.038 0.000 2.950 213 H HA 0.303 4.856 4.556 -0.006 0.000 0.202 213 H C 1.407 176.728 175.328 -0.011 0.000 0.893 213 H CA 0.196 56.287 56.048 0.072 0.000 0.931 213 H CB -0.364 29.463 29.762 0.108 0.000 1.158 213 H HN 0.157 8.437 8.280 -0.000 0.000 0.545 214 I N 2.416 122.630 120.570 -0.594 0.000 2.361 214 I HA -0.237 3.929 4.170 -0.007 0.000 0.251 214 I C 2.530 178.530 176.117 -0.195 0.000 1.133 214 I CA 1.910 62.993 61.300 -0.363 0.000 1.413 214 I CB -0.359 37.312 38.000 -0.550 0.000 1.073 214 I HN 0.500 8.710 8.210 -0.000 0.000 0.424 215 Q N 0.482 120.096 119.800 -0.310 0.000 2.297 215 Q HA -0.228 4.108 4.340 -0.007 0.000 0.208 215 Q C 1.562 177.395 176.000 -0.278 0.000 0.981 215 Q CA 1.553 57.164 55.803 -0.320 0.000 0.876 215 Q CB -0.397 28.088 28.738 -0.422 0.000 0.921 215 Q HN 0.579 8.849 8.270 -0.000 0.000 0.446 216 H N -0.059 119.007 119.070 -0.007 0.000 2.553 216 H HA 0.191 4.744 4.556 -0.005 0.000 0.265 216 H C 0.731 176.087 175.328 0.046 0.000 0.964 216 H CA 0.841 56.901 56.048 0.020 0.000 1.156 216 H CB 0.580 30.364 29.762 0.037 0.000 1.411 216 H HN 0.556 8.836 8.280 -0.000 0.000 0.558 217 E N 0.459 120.754 120.200 0.157 0.000 2.399 217 E HA 0.097 4.444 4.350 -0.007 0.000 0.205 217 E C 0.428 177.107 176.600 0.132 0.000 0.906 217 E CA 0.108 56.615 56.400 0.179 0.000 0.998 217 E CB 1.338 31.217 29.700 0.298 0.000 1.002 217 E HN 0.130 8.490 8.360 -0.000 0.000 0.501 218 V N -2.100 117.868 119.914 0.090 0.000 3.130 218 V HA 0.344 4.460 4.120 -0.007 0.000 0.310 218 V C -0.291 175.782 176.094 -0.035 0.000 1.158 218 V CA -0.833 61.507 62.300 0.066 0.000 1.029 218 V CB 2.200 34.105 31.823 0.136 0.000 1.057 218 V HN -0.124 8.066 8.190 -0.000 0.000 0.436 219 D N 0.580 120.932 120.400 -0.081 0.000 2.301 219 D HA 0.229 4.865 4.640 -0.007 0.000 0.206 219 D C -0.428 175.453 176.300 -0.698 0.000 0.979 219 D CA 1.544 55.341 54.000 -0.338 0.000 0.874 219 D CB 0.537 41.170 40.800 -0.279 0.000 0.968 219 D HN 0.514 8.884 8.370 -0.000 0.000 0.510 220 F N 0.175 120.097 119.950 -0.047 0.000 2.601 220 F HA 0.405 4.928 4.527 -0.007 0.000 0.309 220 F C -0.750 175.035 175.800 -0.025 0.000 1.089 220 F CA -1.169 56.783 58.000 -0.080 0.000 0.940 220 F CB 2.073 40.990 39.000 -0.138 0.000 1.273 220 F HN -0.332 7.968 8.300 -0.000 0.000 0.450 221 L N 2.455 123.735 121.223 0.094 0.000 2.408 221 L HA 0.709 5.045 4.340 -0.007 0.000 0.268 221 L C -1.853 174.970 176.870 -0.079 0.000 0.986 221 L CA -0.559 54.333 54.840 0.086 0.000 0.820 221 L CB 1.375 43.451 42.059 0.029 0.000 1.303 221 L HN 0.459 8.689 8.230 -0.000 0.000 0.411 222 F N 2.940 122.996 119.950 0.178 0.000 2.458 222 F HA 0.603 5.126 4.527 -0.007 0.000 0.330 222 F C -0.137 175.608 175.800 -0.091 0.000 1.082 222 F CA -0.197 57.841 58.000 0.065 0.000 0.995 222 F CB 1.724 40.828 39.000 0.173 0.000 1.170 222 F HN 0.386 8.686 8.300 -0.000 0.000 0.478 223 C N 4.473 123.673 119.300 -0.166 0.000 2.322 223 C HA 0.719 5.175 4.460 -0.007 0.000 0.324 223 C C -0.267 174.542 174.990 -0.302 0.000 1.249 223 C CA -1.062 57.741 59.018 -0.358 0.000 1.453 223 C CB -0.107 27.113 27.740 -0.866 0.000 2.145 223 C HN 0.682 8.912 8.230 -0.000 0.000 0.466 224 M N 1.871 121.396 119.600 -0.124 0.000 2.530 224 M HA 0.347 4.823 4.480 -0.007 0.000 0.307 224 M C -0.992 175.201 176.300 -0.178 0.000 1.161 224 M CA -0.432 54.798 55.300 -0.116 0.000 0.903 224 M CB 1.868 34.455 32.600 -0.022 0.000 1.711 224 M HN 0.544 8.834 8.290 -0.000 0.000 0.451 225 D N 1.071 121.358 120.400 -0.188 0.000 2.400 225 D HA 0.018 4.654 4.640 -0.007 0.000 0.238 225 D C 0.599 176.676 176.300 -0.371 0.000 1.157 225 D CA 0.085 53.954 54.000 -0.218 0.000 0.889 225 D CB 1.435 42.112 40.800 -0.203 0.000 1.199 225 D HN 0.320 8.690 8.370 -0.000 0.000 0.436 226 V N 1.382 121.095 119.914 -0.335 0.000 3.235 226 V HA -0.086 4.030 4.120 -0.007 0.000 0.259 226 V C 0.456 176.447 176.094 -0.170 0.000 1.133 226 V CA 0.773 62.825 62.300 -0.414 0.000 1.128 226 V CB -0.209 31.506 31.823 -0.179 0.000 0.757 226 V HN 0.546 8.736 8.190 -0.000 0.000 0.469 227 D N 1.725 121.972 120.400 -0.255 0.000 3.085 227 D HA 0.106 4.742 4.640 -0.007 0.000 0.243 227 D C 0.189 176.323 176.300 -0.277 0.000 1.232 227 D CA -0.135 53.518 54.000 -0.578 0.000 0.913 227 D CB -0.192 40.171 40.800 -0.728 0.000 1.108 227 D HN 0.768 9.138 8.370 -0.000 0.000 0.468 228 Q N -1.898 117.873 119.800 -0.049 0.000 2.575 228 Q HA 0.611 4.947 4.340 -0.007 0.000 0.290 228 Q C -1.806 174.271 176.000 0.129 0.000 0.963 228 Q CA -1.198 54.632 55.803 0.044 0.000 0.783 228 Q CB 1.570 30.296 28.738 -0.019 0.000 1.467 228 Q HN -0.056 8.214 8.270 -0.000 0.000 0.402 229 V N 1.287 121.246 119.914 0.075 0.000 2.686 229 V HA 0.458 4.574 4.120 -0.007 0.000 0.306 229 V C -0.959 175.148 176.094 0.022 0.000 1.065 229 V CA -0.700 61.646 62.300 0.077 0.000 0.894 229 V CB 1.445 33.357 31.823 0.148 0.000 1.004 229 V HN 0.686 8.876 8.190 -0.000 0.000 0.424 230 F N 3.152 123.089 119.950 -0.022 0.000 2.529 230 F HA 0.265 4.788 4.527 -0.006 0.000 0.365 230 F C 1.484 177.299 175.800 0.024 0.000 1.102 230 F CA 0.383 58.391 58.000 0.014 0.000 1.271 230 F CB 0.806 39.826 39.000 0.033 0.000 1.120 230 F HN 0.493 8.793 8.300 -0.000 0.000 0.579 231 Q N 0.729 120.558 119.800 0.049 0.000 2.280 231 Q HA 0.182 4.518 4.340 -0.007 0.000 0.244 231 Q C -0.228 175.524 176.000 -0.413 0.000 0.847 231 Q CA 0.376 56.136 55.803 -0.072 0.000 0.945 231 Q CB 1.154 29.932 28.738 0.066 0.000 1.115 231 Q HN 0.674 8.944 8.270 -0.000 0.000 0.513 232 D N -0.514 119.551 120.400 -0.559 0.000 2.779 232 D HA 0.143 4.779 4.640 -0.007 0.000 0.331 232 D C -0.976 175.212 176.300 -0.187 0.000 1.331 232 D CA -0.477 53.232 54.000 -0.484 0.000 0.866 232 D CB 1.291 42.003 40.800 -0.147 0.000 1.409 232 D HN -0.335 8.035 8.370 -0.000 0.000 0.486 233 K N 0.919 121.351 120.400 0.053 0.000 2.447 233 K HA 0.129 4.445 4.320 -0.007 0.000 0.281 233 K C -0.304 176.419 176.600 0.205 0.000 1.031 233 K CA 0.230 56.627 56.287 0.183 0.000 1.019 233 K CB -0.253 32.346 32.500 0.164 0.000 0.918 233 K HN 0.316 8.566 8.250 -0.000 0.000 0.476 234 F N 2.444 122.474 119.950 0.135 0.000 2.363 234 F HA 0.346 4.869 4.527 -0.006 0.000 0.366 234 F C 0.549 176.339 175.800 -0.015 0.000 1.083 234 F CA -0.429 57.684 58.000 0.188 0.000 1.176 234 F CB 0.685 39.954 39.000 0.447 0.000 1.432 234 F HN 0.575 8.875 8.300 -0.000 0.000 0.482 235 G N 1.618 110.435 108.800 0.029 0.000 2.971 235 G HA2 0.336 4.292 3.960 -0.007 0.000 0.235 235 G HA3 0.336 4.292 3.960 -0.007 0.000 0.235 235 G C 0.701 175.478 174.900 -0.205 0.000 1.351 235 G CA -0.138 44.914 45.100 -0.080 0.000 1.039 235 G HN 0.492 8.782 8.290 -0.000 0.000 0.563 236 V N -0.711 119.073 119.914 -0.216 0.000 3.078 236 V HA -0.039 4.077 4.120 -0.007 0.000 0.265 236 V C 2.209 178.099 176.094 -0.339 0.000 1.122 236 V CA 2.151 64.253 62.300 -0.330 0.000 1.141 236 V CB -0.605 31.054 31.823 -0.274 0.000 0.735 236 V HN 0.736 8.926 8.190 -0.000 0.000 0.498 237 E N 2.824 122.819 120.200 -0.341 0.000 2.333 237 E HA -0.238 4.108 4.350 -0.007 0.000 0.198 237 E C 1.831 178.141 176.600 -0.483 0.000 1.007 237 E CA 1.881 58.006 56.400 -0.458 0.000 0.845 237 E CB -0.924 28.478 29.700 -0.497 0.000 0.766 237 E HN 0.817 9.177 8.360 -0.000 0.000 0.507 238 T N -1.218 113.078 114.554 -0.429 0.000 3.081 238 T HA 0.231 4.578 4.350 -0.007 0.000 0.250 238 T C 1.148 175.765 174.700 -0.138 0.000 1.100 238 T CA -0.326 61.569 62.100 -0.341 0.000 1.038 238 T CB -0.225 68.402 68.868 -0.401 0.000 0.962 238 T HN 0.013 8.253 8.240 -0.000 0.000 0.516 239 L N 1.467 122.485 121.223 -0.342 0.000 2.417 239 L HA 0.659 4.995 4.340 -0.007 0.000 0.268 239 L C 0.937 177.540 176.870 -0.444 0.000 1.158 239 L CA -0.086 54.415 54.840 -0.565 0.000 0.819 239 L CB 0.760 42.100 42.059 -1.198 0.000 1.112 239 L HN 0.485 8.715 8.230 -0.000 0.000 0.458 240 G N 0.860 109.469 108.800 -0.319 0.000 2.356 240 G HA2 0.128 4.084 3.960 -0.007 0.000 0.294 240 G HA3 0.128 4.084 3.960 -0.007 0.000 0.294 240 G C -0.107 174.906 174.900 0.188 0.000 1.423 240 G CA -0.482 44.607 45.100 -0.018 0.000 0.806 240 G HN 0.480 8.770 8.290 -0.000 0.000 0.527 241 E N -0.481 119.836 120.200 0.195 0.000 2.058 241 E HA -0.060 4.286 4.350 -0.007 0.000 0.194 241 E C 1.160 177.841 176.600 0.135 0.000 0.997 241 E CA 1.903 58.407 56.400 0.173 0.000 0.801 241 E CB -0.111 29.671 29.700 0.136 0.000 0.746 241 E HN 0.622 8.982 8.360 -0.000 0.000 0.450 242 S N -0.218 115.555 115.700 0.122 0.000 2.619 242 S HA 0.524 4.990 4.470 -0.007 0.000 0.280 242 S C -0.597 174.045 174.600 0.070 0.000 1.150 242 S CA -0.970 57.318 58.200 0.146 0.000 0.978 242 S CB 2.126 65.473 63.200 0.244 0.000 1.041 242 S HN -0.082 8.228 8.310 -0.000 0.000 0.485 243 V N 1.961 121.914 119.914 0.066 0.000 2.487 243 V HA 0.896 5.012 4.120 -0.007 0.000 0.298 243 V C 0.202 176.309 176.094 0.021 0.000 1.028 243 V CA -0.476 61.831 62.300 0.012 0.000 0.860 243 V CB 1.270 33.129 31.823 0.059 0.000 0.991 243 V HN 1.246 9.436 8.190 -0.000 0.000 0.427 244 A N 3.635 126.331 122.820 -0.207 0.000 2.354 244 A HA 0.904 5.220 4.320 -0.007 0.000 0.321 244 A C -0.805 176.779 177.584 -0.001 0.000 1.125 244 A CA -0.716 51.150 52.037 -0.285 0.000 0.799 244 A CB 1.910 20.238 19.000 -1.120 0.000 1.293 244 A HN 0.750 8.900 8.150 -0.000 0.000 0.452 245 Q N 1.018 120.923 119.800 0.175 0.000 2.322 245 Q HA 0.599 4.935 4.340 -0.007 0.000 0.265 245 Q C -1.520 174.658 176.000 0.297 0.000 0.985 245 Q CA -0.188 55.747 55.803 0.219 0.000 0.849 245 Q CB 1.005 29.909 28.738 0.277 0.000 1.274 245 Q HN 0.635 8.905 8.270 -0.000 0.000 0.449 246 L N 3.449 124.781 121.223 0.181 0.000 2.410 246 L HA 0.224 4.560 4.340 -0.007 0.000 0.273 246 L C 0.602 177.657 176.870 0.308 0.000 1.144 246 L CA -0.316 54.643 54.840 0.199 0.000 0.863 246 L CB 0.814 42.922 42.059 0.081 0.000 1.140 246 L HN 0.573 8.803 8.230 -0.000 0.000 0.463 247 Q N 1.942 121.965 119.800 0.371 0.000 2.313 247 Q HA 0.073 4.409 4.340 -0.007 0.000 0.266 247 Q C 0.758 177.025 176.000 0.445 0.000 0.989 247 Q CA 0.244 56.300 55.803 0.421 0.000 0.890 247 Q CB 1.730 30.744 28.738 0.460 0.000 1.200 247 Q HN 0.831 9.101 8.270 -0.000 0.000 0.396 248 A N 4.133 127.175 122.820 0.371 0.000 1.940 248 A HA -0.184 4.132 4.320 -0.007 0.000 0.219 248 A C 1.241 178.857 177.584 0.053 0.000 1.176 248 A CA 1.207 53.329 52.037 0.143 0.000 0.631 248 A CB -0.508 18.236 19.000 -0.427 0.000 0.814 248 A HN 0.893 9.043 8.150 -0.000 0.000 0.446 249 W N -2.764 118.494 121.300 -0.070 0.000 2.905 249 W HA 0.163 4.819 4.660 -0.007 0.000 0.251 249 W C 1.088 177.289 176.519 -0.529 0.000 1.305 249 W CA -0.030 57.076 57.345 -0.398 0.000 1.465 249 W CB -0.167 28.912 29.460 -0.635 0.000 1.122 249 W HN 0.517 8.697 8.180 -0.000 0.000 0.659 250 W N -1.975 119.505 121.300 0.301 0.000 2.534 250 W HA 0.135 4.791 4.660 -0.007 0.000 0.339 250 W C 1.721 178.405 176.519 0.276 0.000 0.961 250 W CA -0.594 56.883 57.345 0.220 0.000 1.545 250 W CB -0.864 28.629 29.460 0.054 0.000 1.104 250 W HN -0.015 8.165 8.180 -0.000 0.000 0.538 251 Y N 0.228 120.755 120.300 0.377 0.000 2.421 251 Y HA 0.081 4.628 4.550 -0.006 0.000 0.292 251 Y C 1.551 177.693 175.900 0.403 0.000 1.136 251 Y CA 1.255 59.589 58.100 0.389 0.000 1.255 251 Y CB -0.471 38.192 38.460 0.339 0.000 0.991 251 Y HN -0.181 8.099 8.280 -0.000 0.000 0.552 252 K N 0.881 121.114 120.400 -0.279 0.000 2.374 252 K HA 0.391 4.707 4.320 -0.007 0.000 0.196 252 K C 0.680 177.316 176.600 0.060 0.000 1.023 252 K CA 0.310 56.492 56.287 -0.175 0.000 1.103 252 K CB 0.396 32.658 32.500 -0.397 0.000 0.848 252 K HN 0.320 8.570 8.250 -0.000 0.000 0.528 253 A N 2.216 125.176 122.820 0.234 0.000 2.332 253 A HA 0.084 4.400 4.320 -0.007 0.000 0.258 253 A C -0.335 177.345 177.584 0.159 0.000 1.087 253 A CA -0.405 51.796 52.037 0.273 0.000 0.802 253 A CB 0.329 19.665 19.000 0.560 0.000 1.042 253 A HN 0.225 8.375 8.150 -0.000 0.000 0.489 254 D N 0.625 121.002 120.400 -0.038 0.000 2.345 254 D HA 0.307 4.943 4.640 -0.007 0.000 0.247 254 D C -1.902 173.954 176.300 -0.739 0.000 1.108 254 D CA -1.539 52.316 54.000 -0.241 0.000 0.894 254 D CB 0.909 41.630 40.800 -0.131 0.000 1.203 254 D HN 0.075 8.445 8.370 -0.000 0.000 0.430 255 P HA -0.144 4.276 4.420 -0.000 0.000 0.217 255 P C 0.563 177.399 177.300 -0.774 0.000 1.148 255 P CA 0.978 63.232 63.100 -1.411 0.000 0.828 255 P CB 0.121 31.538 31.700 -0.471 0.000 0.783 256 N N -0.977 117.531 118.700 -0.319 0.000 2.550 256 N HA -0.085 4.651 4.740 -0.007 0.000 0.186 256 N C 0.868 176.387 175.510 0.014 0.000 1.110 256 N CA 0.892 53.942 53.050 -0.001 0.000 0.912 256 N CB -0.513 38.035 38.487 0.101 0.000 0.968 256 N HN 0.207 8.587 8.380 -0.000 0.000 0.448 257 D N -0.660 119.649 120.400 -0.152 0.000 2.350 257 D HA 0.057 4.693 4.640 -0.007 0.000 0.213 257 D C 0.246 176.466 176.300 -0.134 0.000 1.031 257 D CA -0.051 53.945 54.000 -0.007 0.000 0.861 257 D CB 0.239 41.135 40.800 0.161 0.000 0.926 257 D HN 0.206 8.576 8.370 -0.000 0.000 0.520 258 F N 1.459 121.151 119.950 -0.429 0.000 2.506 258 F HA -0.000 4.523 4.527 -0.006 0.000 0.351 258 F C 1.805 177.081 175.800 -0.873 0.000 1.136 258 F CA -0.256 57.183 58.000 -0.935 0.000 1.298 258 F CB 0.676 39.021 39.000 -1.093 0.000 1.145 258 F HN -0.208 8.092 8.300 -0.000 0.000 0.593 259 T N 0.293 114.265 114.554 -0.970 0.000 3.624 259 T HA 0.182 4.528 4.350 -0.007 0.000 0.231 259 T C -0.146 174.537 174.700 -0.029 0.000 0.865 259 T CA -0.355 61.468 62.100 -0.461 0.000 0.926 259 T CB -1.340 67.255 68.868 -0.455 0.000 1.189 259 T HN 0.349 8.589 8.240 -0.000 0.000 0.640 260 Y N 0.918 121.249 120.300 0.051 0.000 2.511 260 Y HA 0.162 4.708 4.550 -0.007 0.000 0.347 260 Y C 1.188 177.117 175.900 0.048 0.000 1.257 260 Y CA -1.208 56.961 58.100 0.115 0.000 1.469 260 Y CB 0.452 38.923 38.460 0.019 0.000 1.353 260 Y HN 0.273 8.553 8.280 -0.000 0.000 0.617 261 E N 1.806 122.125 120.200 0.198 0.000 2.415 261 E HA -0.020 4.326 4.350 -0.007 0.000 0.260 261 E C -0.089 176.579 176.600 0.112 0.000 1.016 261 E CA 0.086 56.541 56.400 0.091 0.000 0.924 261 E CB 0.474 30.175 29.700 0.001 0.000 0.961 261 E HN 0.384 8.744 8.360 -0.000 0.000 0.459 262 R N 3.879 124.452 120.500 0.121 0.000 2.472 262 R HA 0.203 4.539 4.340 -0.007 0.000 0.279 262 R C -0.133 176.307 176.300 0.233 0.000 0.953 262 R CA -0.088 56.119 56.100 0.178 0.000 1.088 262 R CB 0.162 30.506 30.300 0.073 0.000 1.197 262 R HN 0.395 8.665 8.270 -0.000 0.000 0.536 263 R N 1.768 122.324 120.500 0.093 0.000 2.221 263 R HA 0.117 4.453 4.340 -0.007 0.000 0.327 263 R C 1.278 177.368 176.300 -0.349 0.000 1.033 263 R CA -0.122 55.921 56.100 -0.096 0.000 0.887 263 R CB 1.015 31.276 30.300 -0.064 0.000 1.057 263 R HN 0.079 8.349 8.270 -0.000 0.000 0.455 264 K N 1.633 121.610 120.400 -0.704 0.000 2.442 264 K HA -0.122 4.194 4.320 -0.007 0.000 0.198 264 K C 0.255 176.618 176.600 -0.395 0.000 1.042 264 K CA 1.258 56.931 56.287 -1.024 0.000 0.958 264 K CB 0.277 32.248 32.500 -0.883 0.000 0.766 264 K HN 0.415 8.665 8.250 -0.000 0.000 0.474 265 E N 1.340 121.398 120.200 -0.236 0.000 2.418 265 E HA -0.000 4.346 4.350 -0.007 0.000 0.197 265 E C 0.278 176.829 176.600 -0.082 0.000 1.026 265 E CA 0.262 56.585 56.400 -0.129 0.000 0.862 265 E CB 0.364 30.005 29.700 -0.099 0.000 0.799 265 E HN 0.260 8.620 8.360 -0.000 0.000 0.518 266 S N -0.517 115.141 115.700 -0.070 0.000 2.554 266 S HA 0.473 4.939 4.470 -0.007 0.000 0.278 266 S C 1.212 175.817 174.600 0.010 0.000 1.242 266 S CA -0.100 58.085 58.200 -0.025 0.000 1.051 266 S CB 1.305 64.481 63.200 -0.040 0.000 0.986 266 S HN 0.183 8.493 8.310 -0.000 0.000 0.502 267 A N 4.017 126.859 122.820 0.036 0.000 2.076 267 A HA 0.066 4.382 4.320 -0.007 0.000 0.220 267 A C 1.977 179.571 177.584 0.016 0.000 1.160 267 A CA 1.780 53.852 52.037 0.058 0.000 0.653 267 A CB -0.919 18.149 19.000 0.113 0.000 0.801 267 A HN 1.205 9.355 8.150 -0.000 0.000 0.455 268 A N -1.960 120.789 122.820 -0.119 0.000 2.251 268 A HA 0.307 4.624 4.320 -0.007 0.000 0.209 268 A C 0.664 178.184 177.584 -0.107 0.000 1.187 268 A CA -0.370 51.518 52.037 -0.249 0.000 0.823 268 A CB -0.500 18.110 19.000 -0.650 0.000 0.846 268 A HN 0.519 8.669 8.150 -0.000 0.000 0.486 269 Y N 0.913 121.124 120.300 -0.149 0.000 2.717 269 Y HA 0.284 4.830 4.550 -0.007 0.000 0.330 269 Y C -0.284 175.525 175.900 -0.152 0.000 1.217 269 Y CA -0.246 57.778 58.100 -0.126 0.000 1.506 269 Y CB -0.040 38.367 38.460 -0.088 0.000 1.268 269 Y HN 0.211 8.491 8.280 -0.000 0.000 0.561 270 I N 9.653 129.847 120.570 -0.627 0.000 2.439 270 I HA 0.299 4.465 4.170 -0.007 0.000 0.285 270 I C -2.310 173.265 176.117 -0.904 0.000 1.021 270 I CA -2.307 58.547 61.300 -0.743 0.000 1.091 270 I CB 1.766 39.359 38.000 -0.678 0.000 1.242 270 I HN 0.516 8.726 8.210 -0.000 0.000 0.439 271 P HA 0.110 4.530 4.420 -0.000 0.000 0.272 271 P C -0.484 176.654 177.300 -0.271 0.000 1.223 271 P CA -0.086 62.692 63.100 -0.537 0.000 0.784 271 P CB 0.344 31.900 31.700 -0.240 0.000 0.923 272 F N 0.652 120.605 119.950 0.005 0.000 2.602 272 F HA 0.266 4.789 4.527 -0.006 0.000 0.367 272 F C 2.053 177.854 175.800 0.001 0.000 1.126 272 F CA 2.003 60.015 58.000 0.020 0.000 1.321 272 F CB -0.422 38.596 39.000 0.031 0.000 1.094 272 F HN 0.680 8.980 8.300 -0.000 0.000 0.594 273 G N 1.189 110.093 108.800 0.173 0.000 2.194 273 G HA2 -0.221 3.735 3.960 -0.007 0.000 0.236 273 G HA3 -0.221 3.735 3.960 -0.007 0.000 0.236 273 G C -0.119 174.806 174.900 0.043 0.000 0.987 273 G CA -0.124 45.028 45.100 0.087 0.000 0.635 273 G HN 0.591 8.881 8.290 -0.000 0.000 0.520 274 E N -0.618 119.599 120.200 0.027 0.000 2.320 274 E HA 0.625 4.972 4.350 -0.007 0.000 0.264 274 E C 0.228 176.888 176.600 0.100 0.000 0.923 274 E CA -0.364 56.044 56.400 0.014 0.000 0.796 274 E CB 2.178 31.839 29.700 -0.065 0.000 1.262 274 E HN 1.517 9.877 8.360 -0.000 0.000 0.428 275 G N 1.186 110.054 108.800 0.112 0.000 2.592 275 G HA2 -0.099 3.857 3.960 -0.007 0.000 0.685 275 G HA3 -0.099 3.857 3.960 -0.007 0.000 0.685 275 G C -0.618 174.424 174.900 0.237 0.000 1.278 275 G CA -0.598 44.666 45.100 0.273 0.000 0.822 275 G HN 0.535 8.825 8.290 -0.000 0.000 0.652 276 D N -0.217 120.348 120.400 0.275 0.000 2.725 276 D HA 0.294 4.931 4.640 -0.007 0.000 0.269 276 D C 0.613 176.776 176.300 -0.227 0.000 1.018 276 D CA 1.216 55.263 54.000 0.079 0.000 0.956 276 D CB 0.436 41.470 40.800 0.391 0.000 1.141 276 D HN 0.307 8.677 8.370 -0.000 0.000 0.478 277 F N -1.068 119.044 119.950 0.269 0.000 2.664 277 F HA 0.329 4.852 4.527 -0.006 0.000 0.317 277 F C -1.000 174.452 175.800 -0.579 0.000 1.108 277 F CA -1.307 56.645 58.000 -0.081 0.000 0.957 277 F CB 1.810 40.591 39.000 -0.364 0.000 1.365 277 F HN -0.290 8.010 8.300 -0.000 0.000 0.475 278 Y N 1.918 121.672 120.300 -0.909 0.000 2.385 278 Y HA 0.475 5.021 4.550 -0.006 0.000 0.341 278 Y C -1.237 174.469 175.900 -0.322 0.000 0.965 278 Y CA -0.852 56.760 58.100 -0.812 0.000 1.180 278 Y CB 0.285 38.009 38.460 -1.227 0.000 1.139 278 Y HN 0.392 8.672 8.280 -0.000 0.000 0.502 279 Y N 4.129 124.252 120.300 -0.295 0.000 2.310 279 Y HA 0.236 4.782 4.550 -0.006 0.000 0.326 279 Y C 0.192 176.044 175.900 -0.081 0.000 1.151 279 Y CA -0.628 57.443 58.100 -0.050 0.000 1.195 279 Y CB 0.730 39.262 38.460 0.119 0.000 1.210 279 Y HN 0.560 8.840 8.280 -0.000 0.000 0.483 280 H N 1.438 120.631 119.070 0.204 0.000 2.562 280 H HA 0.395 4.948 4.556 -0.006 0.000 0.314 280 H C 0.213 175.659 175.328 0.196 0.000 1.079 280 H CA -0.337 55.819 56.048 0.180 0.000 1.349 280 H CB 1.324 31.226 29.762 0.234 0.000 1.432 280 H HN 0.974 9.254 8.280 -0.000 0.000 0.479 281 A N 4.083 127.079 122.820 0.294 0.000 2.235 281 A HA 0.051 4.367 4.320 -0.007 0.000 0.208 281 A C 2.066 179.711 177.584 0.102 0.000 1.172 281 A CA 0.820 52.981 52.037 0.207 0.000 0.786 281 A CB -0.353 18.750 19.000 0.171 0.000 0.804 281 A HN 0.797 8.947 8.150 -0.000 0.000 0.479 282 A N -0.385 122.258 122.820 -0.296 0.000 2.119 282 A HA 0.329 4.645 4.320 -0.007 0.000 0.217 282 A C 0.743 178.224 177.584 -0.172 0.000 1.153 282 A CA 0.718 52.507 52.037 -0.412 0.000 0.692 282 A CB -0.206 18.205 19.000 -0.981 0.000 0.799 282 A HN 0.453 8.603 8.150 -0.000 0.000 0.458 283 I N -0.275 120.300 120.570 0.008 0.000 2.548 283 I HA 0.484 4.650 4.170 -0.007 0.000 0.287 283 I C -1.163 175.184 176.117 0.383 0.000 1.103 283 I CA -0.701 60.687 61.300 0.147 0.000 1.049 283 I CB 2.009 40.111 38.000 0.169 0.000 1.232 283 I HN 0.299 8.509 8.210 -0.000 0.000 0.429 284 F N 3.635 123.759 119.950 0.289 0.000 2.668 284 F HA 1.004 5.527 4.527 -0.006 0.000 0.309 284 F C -0.186 175.747 175.800 0.223 0.000 1.117 284 F CA -0.648 57.528 58.000 0.293 0.000 0.951 284 F CB 1.697 40.843 39.000 0.244 0.000 1.323 284 F HN 0.522 8.822 8.300 -0.000 0.000 0.451 285 G N -0.676 108.222 108.800 0.162 0.000 2.561 285 G HA2 0.779 4.735 3.960 -0.007 0.000 0.310 285 G HA3 0.779 4.735 3.960 -0.007 0.000 0.310 285 G C -0.893 173.911 174.900 -0.159 0.000 1.292 285 G CA -0.318 44.591 45.100 -0.318 0.000 0.811 285 G HN 1.970 10.260 8.290 -0.000 0.000 0.482 286 G N -1.787 106.872 108.800 -0.235 0.000 2.352 286 G HA2 0.588 4.544 3.960 -0.007 0.000 0.283 286 G HA3 0.588 4.544 3.960 -0.007 0.000 0.283 286 G C -0.044 174.890 174.900 0.057 0.000 1.308 286 G CA 0.862 45.959 45.100 -0.006 0.000 0.892 286 G HN 1.862 10.152 8.290 -0.000 0.000 0.504 287 T N -0.649 113.930 114.554 0.043 0.000 2.856 287 T HA 0.474 4.820 4.350 -0.007 0.000 0.306 287 T C -1.301 173.344 174.700 -0.093 0.000 1.062 287 T CA -0.268 61.759 62.100 -0.122 0.000 1.083 287 T CB 1.554 70.326 68.868 -0.159 0.000 0.984 287 T HN 0.201 8.441 8.240 -0.000 0.000 0.542 288 P HA -0.077 4.343 4.420 -0.000 0.000 0.216 288 P C 1.683 178.926 177.300 -0.095 0.000 1.150 288 P CA 1.124 64.157 63.100 -0.112 0.000 0.837 288 P CB -0.240 31.374 31.700 -0.144 0.000 0.786 289 T N -0.584 113.917 114.554 -0.088 0.000 2.708 289 T HA -0.171 4.175 4.350 -0.007 0.000 0.266 289 T C 1.813 176.494 174.700 -0.031 0.000 1.037 289 T CA 1.238 63.301 62.100 -0.061 0.000 1.146 289 T CB -0.597 68.241 68.868 -0.050 0.000 0.865 289 T HN 0.139 8.379 8.240 -0.000 0.000 0.435 290 Q N 0.484 120.277 119.800 -0.010 0.000 2.079 290 Q HA 0.020 4.356 4.340 -0.007 0.000 0.200 290 Q C 2.669 178.672 176.000 0.005 0.000 0.974 290 Q CA 0.869 56.690 55.803 0.030 0.000 0.840 290 Q CB -0.873 27.909 28.738 0.072 0.000 0.898 290 Q HN 0.406 8.676 8.270 -0.000 0.000 0.430 291 V N 1.371 121.284 119.914 -0.001 0.000 2.490 291 V HA -0.220 3.896 4.120 -0.007 0.000 0.250 291 V C 2.330 178.397 176.094 -0.045 0.000 1.061 291 V CA 1.215 63.521 62.300 0.010 0.000 1.064 291 V CB -0.672 31.170 31.823 0.032 0.000 0.670 291 V HN 0.212 8.402 8.190 -0.000 0.000 0.461 292 L N 0.968 122.154 121.223 -0.062 0.000 2.042 292 L HA -0.180 4.156 4.340 -0.007 0.000 0.210 292 L C 2.090 178.906 176.870 -0.090 0.000 1.076 292 L CA 2.327 57.120 54.840 -0.078 0.000 0.749 292 L CB -0.955 41.056 42.059 -0.080 0.000 0.893 292 L HN 0.371 8.601 8.230 -0.000 0.000 0.432 293 N N -0.595 118.061 118.700 -0.073 0.000 2.142 293 N HA -0.152 4.585 4.740 -0.007 0.000 0.186 293 N C 1.815 177.175 175.510 -0.249 0.000 1.023 293 N CA 1.664 54.677 53.050 -0.061 0.000 0.852 293 N CB -0.211 38.307 38.487 0.052 0.000 0.998 293 N HN 0.451 8.831 8.380 -0.000 0.000 0.424 294 I N -0.093 120.188 120.570 -0.481 0.000 2.127 294 I HA -0.334 3.832 4.170 -0.007 0.000 0.241 294 I C 2.322 178.032 176.117 -0.679 0.000 1.075 294 I CA 1.769 62.422 61.300 -1.078 0.000 1.334 294 I CB -0.812 36.688 38.000 -0.833 0.000 1.040 294 I HN 0.387 8.597 8.210 -0.000 0.000 0.405 295 T N -1.662 112.687 114.554 -0.341 0.000 2.821 295 T HA -0.194 4.152 4.350 -0.007 0.000 0.267 295 T C 1.806 176.426 174.700 -0.134 0.000 1.046 295 T CA 1.068 63.046 62.100 -0.204 0.000 1.139 295 T CB -0.470 68.350 68.868 -0.080 0.000 0.871 295 T HN 0.388 8.628 8.240 -0.000 0.000 0.454 296 Q N 0.408 120.141 119.800 -0.112 0.000 2.084 296 Q HA -0.107 4.229 4.340 -0.007 0.000 0.202 296 Q C 2.632 178.616 176.000 -0.026 0.000 0.978 296 Q CA 1.439 57.219 55.803 -0.039 0.000 0.844 296 Q CB -0.074 28.643 28.738 -0.036 0.000 0.898 296 Q HN 0.530 8.800 8.270 -0.000 0.000 0.426 297 E N 0.012 120.170 120.200 -0.071 0.000 2.072 297 E HA -0.132 4.214 4.350 -0.007 0.000 0.190 297 E C 2.149 178.721 176.600 -0.046 0.000 0.982 297 E CA 0.705 57.098 56.400 -0.011 0.000 0.803 297 E CB -0.378 29.403 29.700 0.136 0.000 0.755 297 E HN 0.364 8.724 8.360 -0.000 0.000 0.453 298 C N 0.614 119.833 119.300 -0.135 0.000 2.413 298 C HA -0.135 4.321 4.460 -0.007 0.000 0.276 298 C C 2.504 177.401 174.990 -0.156 0.000 1.248 298 C CA 0.428 59.363 59.018 -0.139 0.000 1.742 298 C CB -1.228 26.389 27.740 -0.205 0.000 2.017 298 C HN 0.322 8.552 8.230 -0.000 0.000 0.481 299 F N 1.788 121.606 119.950 -0.220 0.000 2.234 299 F HA -0.072 4.452 4.527 -0.006 0.000 0.299 299 F C 2.256 177.947 175.800 -0.182 0.000 1.087 299 F CA 1.466 59.342 58.000 -0.207 0.000 1.340 299 F CB -0.444 38.464 39.000 -0.153 0.000 1.031 299 F HN 0.178 8.478 8.300 -0.000 0.000 0.500 300 K N -0.376 119.939 120.400 -0.141 0.000 2.063 300 K HA -0.153 4.163 4.320 -0.007 0.000 0.208 300 K C 2.373 178.833 176.600 -0.234 0.000 1.048 300 K CA 1.323 57.502 56.287 -0.179 0.000 0.928 300 K CB -0.922 31.535 32.500 -0.072 0.000 0.713 300 K HN 0.419 8.669 8.250 -0.000 0.000 0.442 301 G N 1.241 109.912 108.800 -0.216 0.000 2.402 301 G HA2 -0.214 3.742 3.960 -0.007 0.000 0.216 301 G HA3 -0.214 3.742 3.960 -0.007 0.000 0.216 301 G C 1.502 176.187 174.900 -0.358 0.000 1.162 301 G CA 0.608 45.611 45.100 -0.161 0.000 0.777 301 G HN 0.136 8.425 8.290 -0.000 0.000 0.539 302 I N 0.420 120.551 120.570 -0.731 0.000 2.208 302 I HA -0.163 4.003 4.170 -0.007 0.000 0.245 302 I C 2.677 178.512 176.117 -0.471 0.000 1.097 302 I CA 0.801 61.712 61.300 -0.648 0.000 1.363 302 I CB -0.145 37.475 38.000 -0.634 0.000 1.051 302 I HN 0.128 8.338 8.210 -0.000 0.000 0.413 303 L N 0.336 121.212 121.223 -0.579 0.000 2.109 303 L HA -0.197 4.139 4.340 -0.007 0.000 0.207 303 L C 2.602 179.328 176.870 -0.240 0.000 1.086 303 L CA 1.257 55.836 54.840 -0.436 0.000 0.760 303 L CB -0.549 41.227 42.059 -0.471 0.000 0.910 303 L HN 0.222 8.452 8.230 -0.000 0.000 0.437 304 K N 0.286 120.570 120.400 -0.194 0.000 2.057 304 K HA -0.212 4.104 4.320 -0.007 0.000 0.207 304 K C 1.629 178.180 176.600 -0.081 0.000 1.049 304 K CA 1.788 58.009 56.287 -0.110 0.000 0.931 304 K CB 0.022 32.477 32.500 -0.076 0.000 0.714 304 K HN 0.154 8.404 8.250 -0.000 0.000 0.440 305 D N 0.780 121.139 120.400 -0.068 0.000 2.123 305 D HA -0.130 4.506 4.640 -0.007 0.000 0.196 305 D C 1.686 177.949 176.300 -0.061 0.000 0.992 305 D CA 1.188 55.167 54.000 -0.034 0.000 0.833 305 D CB 0.043 40.859 40.800 0.027 0.000 0.954 305 D HN 0.257 8.627 8.370 -0.000 0.000 0.455 306 K N 0.329 120.673 120.400 -0.094 0.000 2.063 306 K HA -0.115 4.201 4.320 -0.007 0.000 0.208 306 K C 1.873 178.429 176.600 -0.074 0.000 1.048 306 K CA 0.864 57.097 56.287 -0.090 0.000 0.928 306 K CB 0.088 32.519 32.500 -0.116 0.000 0.713 306 K HN -0.008 8.242 8.250 -0.000 0.000 0.442 307 K N 0.668 121.022 120.400 -0.076 0.000 2.283 307 K HA -0.029 4.287 4.320 -0.007 0.000 0.202 307 K C 1.074 177.644 176.600 -0.051 0.000 1.048 307 K CA 0.813 57.063 56.287 -0.061 0.000 0.948 307 K CB -0.087 32.375 32.500 -0.063 0.000 0.742 307 K HN 0.169 8.419 8.250 -0.000 0.000 0.458 308 N N 1.438 120.107 118.700 -0.051 0.000 2.235 308 N HA -0.060 4.676 4.740 -0.007 0.000 0.209 308 N C -0.574 174.909 175.510 -0.044 0.000 1.122 308 N CA 0.111 53.135 53.050 -0.044 0.000 0.845 308 N CB 0.310 38.771 38.487 -0.043 0.000 1.004 308 N HN 0.082 8.462 8.380 -0.000 0.000 0.499 309 D N 0.887 121.259 120.400 -0.046 0.000 2.699 309 D HA -0.205 4.431 4.640 -0.007 0.000 0.239 309 D C -0.660 175.614 176.300 -0.044 0.000 1.136 309 D CA 0.550 54.523 54.000 -0.044 0.000 0.668 309 D CB -1.251 39.525 40.800 -0.040 0.000 1.060 309 D HN 0.447 8.817 8.370 -0.000 0.000 0.429 310 I N -0.141 120.403 120.570 -0.043 0.000 2.769 310 I HA 0.470 4.636 4.170 -0.007 0.000 0.298 310 I C -1.063 175.033 176.117 -0.034 0.000 1.128 310 I CA -0.866 60.409 61.300 -0.042 0.000 1.031 310 I CB 1.896 39.871 38.000 -0.042 0.000 1.235 310 I HN 0.023 8.233 8.210 -0.000 0.000 0.423 311 E N 5.574 125.750 120.200 -0.039 0.000 2.241 311 E HA 0.641 4.987 4.350 -0.007 0.000 0.263 311 E C -0.990 175.575 176.600 -0.060 0.000 0.882 311 E CA -0.775 55.611 56.400 -0.023 0.000 0.769 311 E CB 1.845 31.530 29.700 -0.025 0.000 1.185 311 E HN 0.751 9.111 8.360 -0.000 0.000 0.415 312 A N 3.612 126.409 122.820 -0.038 0.000 2.498 312 A HA -0.039 4.277 4.320 -0.007 0.000 0.239 312 A C 1.082 178.493 177.584 -0.288 0.000 1.068 312 A CA 0.271 52.230 52.037 -0.129 0.000 0.766 312 A CB 0.690 19.591 19.000 -0.164 0.000 1.003 312 A HN 0.962 9.112 8.150 -0.000 0.000 0.497 313 Q N 0.888 120.521 119.800 -0.277 0.000 2.112 313 Q HA -0.174 4.162 4.340 -0.007 0.000 0.206 313 Q C 0.193 175.680 176.000 -0.854 0.000 0.987 313 Q CA 2.030 57.548 55.803 -0.475 0.000 0.858 313 Q CB -0.048 28.513 28.738 -0.294 0.000 0.905 313 Q HN 0.864 9.134 8.270 -0.000 0.000 0.420 314 W N -0.139 120.996 121.300 -0.274 0.000 2.570 314 W HA 0.250 4.906 4.660 -0.007 0.000 0.410 314 W C -0.169 176.281 176.519 -0.115 0.000 0.889 314 W CA -0.209 57.028 57.345 -0.179 0.000 2.386 314 W CB 0.211 29.724 29.460 0.090 0.000 1.228 314 W HN 0.370 8.550 8.180 -0.000 0.000 0.692 315 H N -0.687 118.492 119.070 0.181 0.000 1.452 315 H HA -0.364 4.188 4.556 -0.007 0.000 0.090 315 H C 1.696 177.173 175.328 0.248 0.000 0.973 315 H CA 1.799 57.942 56.048 0.159 0.000 1.901 315 H CB -1.037 28.785 29.762 0.099 0.000 2.257 315 H HN 0.192 8.472 8.280 -0.000 0.000 0.961 316 D N 0.960 121.564 120.400 0.340 0.000 2.218 316 D HA -0.162 4.474 4.640 -0.007 0.000 0.204 316 D C 1.727 178.139 176.300 0.187 0.000 0.976 316 D CA 1.678 55.810 54.000 0.220 0.000 0.853 316 D CB -0.511 40.349 40.800 0.100 0.000 0.939 316 D HN 0.690 9.060 8.370 -0.000 0.000 0.481 317 E N 0.843 121.181 120.200 0.229 0.000 2.110 317 E HA -0.137 4.209 4.350 -0.007 0.000 0.193 317 E C 1.852 178.534 176.600 0.136 0.000 0.988 317 E CA 0.951 57.459 56.400 0.179 0.000 0.804 317 E CB 0.160 30.016 29.700 0.259 0.000 0.745 317 E HN 0.105 8.465 8.360 -0.000 0.000 0.458 318 S N -0.070 115.732 115.700 0.169 0.000 2.368 318 S HA -0.152 4.314 4.470 -0.007 0.000 0.225 318 S C 1.705 176.253 174.600 -0.088 0.000 1.030 318 S CA 0.958 59.191 58.200 0.056 0.000 0.999 318 S CB -0.398 62.788 63.200 -0.023 0.000 0.844 318 S HN 0.453 8.763 8.310 -0.000 0.000 0.459 319 H N 0.378 119.453 119.070 0.008 0.000 2.357 319 H HA 0.017 4.569 4.556 -0.006 0.000 0.301 319 H C 2.242 177.516 175.328 -0.090 0.000 1.082 319 H CA 1.241 57.263 56.048 -0.043 0.000 1.342 319 H CB -0.518 29.210 29.762 -0.057 0.000 1.389 319 H HN 0.226 8.506 8.280 -0.000 0.000 0.511 320 L N 1.467 122.677 121.223 -0.022 0.000 2.083 320 L HA -0.132 4.204 4.340 -0.007 0.000 0.209 320 L C 1.911 178.743 176.870 -0.065 0.000 1.083 320 L CA 1.379 56.100 54.840 -0.197 0.000 0.752 320 L CB -0.571 41.336 42.059 -0.254 0.000 0.899 320 L HN 0.138 8.368 8.230 -0.000 0.000 0.433 321 N N -0.279 118.444 118.700 0.039 0.000 2.188 321 N HA -0.220 4.516 4.740 -0.007 0.000 0.184 321 N C 1.826 177.344 175.510 0.014 0.000 1.018 321 N CA 1.249 54.377 53.050 0.130 0.000 0.858 321 N CB -0.006 38.515 38.487 0.056 0.000 0.989 321 N HN 0.271 8.651 8.380 -0.000 0.000 0.426 322 K N 0.825 121.178 120.400 -0.079 0.000 2.057 322 K HA -0.140 4.176 4.320 -0.007 0.000 0.206 322 K C 2.019 178.581 176.600 -0.064 0.000 1.050 322 K CA 0.977 57.193 56.287 -0.118 0.000 0.935 322 K CB -0.739 31.694 32.500 -0.112 0.000 0.715 322 K HN 0.156 8.406 8.250 -0.000 0.000 0.439 323 Y N -0.089 120.111 120.300 -0.165 0.000 2.081 323 Y HA -0.208 4.339 4.550 -0.006 0.000 0.280 323 Y C 1.642 177.459 175.900 -0.139 0.000 1.163 323 Y CA 2.257 60.222 58.100 -0.225 0.000 1.135 323 Y CB -0.359 37.856 38.460 -0.409 0.000 0.970 323 Y HN 0.113 8.393 8.280 -0.000 0.000 0.498 324 F N -1.290 118.670 119.950 0.017 0.000 2.604 324 F HA -0.121 4.402 4.527 -0.007 0.000 0.298 324 F C 1.977 177.728 175.800 -0.081 0.000 1.131 324 F CA -0.001 57.953 58.000 -0.077 0.000 1.457 324 F CB 0.010 38.893 39.000 -0.195 0.000 1.095 324 F HN 0.203 8.503 8.300 -0.000 0.000 0.574 325 L N 0.183 121.461 121.223 0.091 0.000 2.072 325 L HA -0.121 4.215 4.340 -0.007 0.000 0.205 325 L C 1.832 178.610 176.870 -0.153 0.000 1.079 325 L CA 1.791 56.615 54.840 -0.026 0.000 0.752 325 L CB -0.519 41.485 42.059 -0.093 0.000 0.906 325 L HN 0.076 8.306 8.230 -0.000 0.000 0.436 326 L N -0.601 120.497 121.223 -0.209 0.000 2.131 326 L HA -0.005 4.331 4.340 -0.007 0.000 0.206 326 L C 0.323 177.004 176.870 -0.315 0.000 1.087 326 L CA 0.514 55.201 54.840 -0.255 0.000 0.767 326 L CB -0.276 41.621 42.059 -0.269 0.000 0.917 326 L HN 0.281 8.511 8.230 -0.000 0.000 0.441 327 N N 1.101 119.556 118.700 -0.407 0.000 2.746 327 N HA 0.161 4.897 4.740 -0.007 0.000 0.250 327 N C -0.909 174.487 175.510 -0.190 0.000 1.146 327 N CA -0.256 52.570 53.050 -0.373 0.000 0.828 327 N CB 1.121 39.205 38.487 -0.671 0.000 1.158 327 N HN 0.074 8.454 8.380 -0.000 0.000 0.519 328 K N 1.796 122.018 120.400 -0.297 0.000 2.436 328 K HA 0.193 4.509 4.320 -0.007 0.000 0.275 328 K C -2.120 174.411 176.600 -0.115 0.000 0.999 328 K CA -1.077 54.953 56.287 -0.427 0.000 0.980 328 K CB 0.437 32.171 32.500 -1.277 0.000 0.919 328 K HN 0.281 8.531 8.250 -0.000 0.000 0.484 329 P HA -0.001 4.419 4.420 -0.000 0.000 0.271 329 P C 0.628 178.050 177.300 0.202 0.000 1.218 329 P CA -0.052 63.022 63.100 -0.044 0.000 0.780 329 P CB 0.442 31.851 31.700 -0.484 0.000 0.901 330 T N -1.170 113.467 114.554 0.137 0.000 3.088 330 T HA 0.069 4.415 4.350 -0.007 0.000 0.259 330 T C 0.527 175.281 174.700 0.090 0.000 1.122 330 T CA 0.543 62.741 62.100 0.163 0.000 1.095 330 T CB 0.050 68.999 68.868 0.134 0.000 0.930 330 T HN 0.463 8.703 8.240 -0.000 0.000 0.508 331 K N 0.188 120.603 120.400 0.024 0.000 2.523 331 K HA 0.629 4.945 4.320 -0.007 0.000 0.257 331 K C -1.976 174.567 176.600 -0.095 0.000 0.932 331 K CA -0.987 55.274 56.287 -0.043 0.000 0.812 331 K CB 1.915 34.388 32.500 -0.044 0.000 1.326 331 K HN 0.177 8.428 8.250 -0.000 0.000 0.433 332 I N 4.515 125.005 120.570 -0.133 0.000 2.569 332 I HA 0.364 4.530 4.170 -0.007 0.000 0.296 332 I C -0.597 175.392 176.117 -0.213 0.000 1.028 332 I CA -1.116 60.087 61.300 -0.162 0.000 1.082 332 I CB 1.826 39.713 38.000 -0.188 0.000 1.264 332 I HN 0.401 8.611 8.210 -0.000 0.000 0.429 333 L N 4.221 125.311 121.223 -0.223 0.000 2.307 333 L HA 0.403 4.739 4.340 -0.007 0.000 0.282 333 L C 0.671 177.355 176.870 -0.311 0.000 1.051 333 L CA -0.529 54.103 54.840 -0.346 0.000 0.804 333 L CB 1.579 43.385 42.059 -0.422 0.000 1.197 333 L HN 0.719 8.949 8.230 -0.000 0.000 0.431 334 S N 2.452 117.868 115.700 -0.472 0.000 2.589 334 S HA 0.197 4.663 4.470 -0.007 0.000 0.265 334 S C -1.836 172.496 174.600 -0.446 0.000 1.342 334 S CA -0.926 56.744 58.200 -0.883 0.000 1.005 334 S CB 0.693 62.789 63.200 -1.840 0.000 0.909 334 S HN 0.464 8.774 8.310 -0.000 0.000 0.555 335 P HA -0.017 4.403 4.420 -0.000 0.000 0.228 335 P C 0.738 177.996 177.300 -0.069 0.000 1.151 335 P CA 0.936 63.965 63.100 -0.119 0.000 0.770 335 P CB -0.148 31.493 31.700 -0.099 0.000 0.786 336 E N -1.498 118.525 120.200 -0.296 0.000 2.209 336 E HA -0.197 4.150 4.350 -0.007 0.000 0.196 336 E C 0.993 177.440 176.600 -0.256 0.000 0.993 336 E CA 1.025 57.242 56.400 -0.305 0.000 0.819 336 E CB -0.593 28.898 29.700 -0.348 0.000 0.745 336 E HN 0.436 8.796 8.360 -0.000 0.000 0.477 337 Y N -1.243 118.983 120.300 -0.122 0.000 2.529 337 Y HA 0.106 4.652 4.550 -0.007 0.000 0.290 337 Y C 0.580 176.559 175.900 0.132 0.000 1.177 337 Y CA -0.051 58.013 58.100 -0.059 0.000 1.305 337 Y CB 0.765 39.082 38.460 -0.238 0.000 1.047 337 Y HN -0.000 8.280 8.280 -0.000 0.000 0.522 338 C N 1.269 120.743 119.300 0.290 0.000 3.280 338 C HA 0.160 4.616 4.460 -0.007 0.000 0.334 338 C C -0.915 174.371 174.990 0.493 0.000 0.977 338 C CA -1.133 58.123 59.018 0.395 0.000 1.264 338 C CB -1.145 26.848 27.740 0.421 0.000 1.688 338 C HN 0.534 8.764 8.230 -0.000 0.000 0.592 339 W N 3.929 125.256 121.300 0.045 0.000 2.496 339 W HA 0.466 5.122 4.660 -0.007 0.000 0.327 339 W C -0.857 175.330 176.519 -0.554 0.000 1.086 339 W CA -0.013 57.165 57.345 -0.278 0.000 1.222 339 W CB 1.317 30.507 29.460 -0.450 0.000 1.304 339 W HN 0.581 8.761 8.180 -0.000 0.000 0.547 340 D N 4.192 123.439 120.400 -1.922 0.000 2.412 340 D HA 0.097 4.733 4.640 -0.007 0.000 0.224 340 D C 0.339 175.820 176.300 -1.365 0.000 1.093 340 D CA -0.258 52.694 54.000 -1.746 0.000 0.850 340 D CB 0.301 39.859 40.800 -2.069 0.000 1.046 340 D HN 0.350 8.720 8.370 -0.000 0.000 0.507 341 Y N 1.590 121.574 120.300 -0.527 0.000 2.639 341 Y HA -0.144 4.402 4.550 -0.007 0.000 0.297 341 Y C 1.958 177.760 175.900 -0.164 0.000 1.151 341 Y CA 0.461 58.449 58.100 -0.186 0.000 1.335 341 Y CB -0.018 38.458 38.460 0.027 0.000 0.994 341 Y HN 0.599 8.879 8.280 -0.000 0.000 0.548 342 H N 0.196 119.158 119.070 -0.180 0.000 2.489 342 H HA -0.129 4.423 4.556 -0.007 0.000 0.293 342 H C 1.762 176.972 175.328 -0.197 0.000 1.066 342 H CA 1.499 57.495 56.048 -0.086 0.000 1.305 342 H CB -0.263 29.525 29.762 0.042 0.000 1.386 342 H HN 0.357 8.637 8.280 -0.000 0.000 0.551 343 I N -0.569 119.647 120.570 -0.590 0.000 2.676 343 I HA 0.032 4.198 4.170 -0.007 0.000 0.259 343 I C 1.551 177.516 176.117 -0.254 0.000 1.194 343 I CA 0.647 61.525 61.300 -0.704 0.000 1.473 343 I CB -0.273 37.045 38.000 -1.136 0.000 1.096 343 I HN 0.560 8.770 8.210 -0.000 0.000 0.443 344 G N 1.056 109.825 108.800 -0.052 0.000 2.428 344 G HA2 -0.129 3.827 3.960 -0.007 0.000 0.202 344 G HA3 -0.129 3.827 3.960 -0.007 0.000 0.202 344 G C -1.200 173.900 174.900 0.333 0.000 1.247 344 G CA -0.569 44.597 45.100 0.110 0.000 1.020 344 G HN 0.028 8.318 8.290 -0.000 0.000 0.529 345 L N 2.391 123.741 121.223 0.212 0.000 2.514 345 L HA 0.608 4.944 4.340 -0.007 0.000 0.257 345 L C -1.680 175.199 176.870 0.015 0.000 1.101 345 L CA -1.152 53.770 54.840 0.136 0.000 0.911 345 L CB 1.013 43.160 42.059 0.146 0.000 1.162 345 L HN 0.740 8.970 8.230 -0.000 0.000 0.477 346 P HA 0.404 4.824 4.420 -0.000 0.000 0.279 346 P C 0.555 177.814 177.300 -0.068 0.000 1.276 346 P CA -0.348 62.742 63.100 -0.017 0.000 0.801 346 P CB 1.048 32.771 31.700 0.037 0.000 1.127 347 A N 0.240 123.035 122.820 -0.042 0.000 1.978 347 A HA -0.183 4.133 4.320 -0.007 0.000 0.220 347 A C 1.657 179.196 177.584 -0.075 0.000 1.170 347 A CA 1.887 53.891 52.037 -0.056 0.000 0.636 347 A CB -1.132 17.842 19.000 -0.043 0.000 0.810 347 A HN 0.531 8.681 8.150 -0.000 0.000 0.448 348 D N -0.375 119.991 120.400 -0.057 0.000 2.310 348 D HA -0.015 4.621 4.640 -0.007 0.000 0.212 348 D C 0.244 176.514 176.300 -0.049 0.000 0.965 348 D CA 0.572 54.539 54.000 -0.056 0.000 0.879 348 D CB -0.038 40.800 40.800 0.063 0.000 0.921 348 D HN 0.267 8.637 8.370 -0.000 0.000 0.510 349 I N 1.748 122.196 120.570 -0.204 0.000 2.282 349 I HA 0.080 4.246 4.170 -0.007 0.000 0.290 349 I C 1.247 177.217 176.117 -0.245 0.000 1.090 349 I CA -0.239 60.845 61.300 -0.360 0.000 1.231 349 I CB 1.143 38.583 38.000 -0.933 0.000 1.434 349 I HN -0.262 7.948 8.210 -0.000 0.000 0.487 350 K N 3.966 124.290 120.400 -0.126 0.000 2.166 350 K HA 0.186 4.502 4.320 -0.007 0.000 0.201 350 K C 0.210 176.758 176.600 -0.087 0.000 1.052 350 K CA 0.574 56.809 56.287 -0.086 0.000 0.969 350 K CB 0.544 33.022 32.500 -0.037 0.000 0.761 350 K HN 0.350 8.600 8.250 -0.000 0.000 0.459 351 L N 0.852 122.010 121.223 -0.107 0.000 2.541 351 L HA 0.267 4.603 4.340 -0.007 0.000 0.266 351 L C -1.347 175.427 176.870 -0.160 0.000 0.966 351 L CA -0.554 54.228 54.840 -0.097 0.000 0.871 351 L CB 1.923 43.948 42.059 -0.058 0.000 1.232 351 L HN -0.280 7.950 8.230 -0.000 0.000 0.408 352 V N 5.957 125.792 119.914 -0.133 0.000 2.508 352 V HA 0.216 4.332 4.120 -0.007 0.000 0.281 352 V C 0.856 176.879 176.094 -0.119 0.000 1.041 352 V CA -0.100 62.111 62.300 -0.148 0.000 1.016 352 V CB 1.049 32.833 31.823 -0.065 0.000 0.984 352 V HN 0.785 8.975 8.190 -0.000 0.000 0.478 353 K N 3.482 123.773 120.400 -0.181 0.000 2.334 353 K HA 0.348 4.664 4.320 -0.007 0.000 0.195 353 K C 0.144 176.795 176.600 0.084 0.000 1.045 353 K CA 0.403 56.635 56.287 -0.091 0.000 1.004 353 K CB 0.317 32.661 32.500 -0.261 0.000 0.837 353 K HN 0.639 8.889 8.250 -0.000 0.000 0.510 354 M N 0.004 119.645 119.600 0.068 0.000 2.413 354 M HA 0.300 4.776 4.480 -0.007 0.000 0.287 354 M C -1.801 174.565 176.300 0.111 0.000 1.186 354 M CA -0.399 54.930 55.300 0.048 0.000 0.927 354 M CB 2.279 34.865 32.600 -0.024 0.000 1.715 354 M HN 0.012 8.302 8.290 -0.000 0.000 0.478 355 S N 2.184 117.967 115.700 0.138 0.000 2.542 355 S HA 0.794 5.260 4.470 -0.007 0.000 0.293 355 S C -1.545 173.238 174.600 0.306 0.000 1.089 355 S CA -0.753 57.567 58.200 0.199 0.000 0.961 355 S CB 0.805 64.149 63.200 0.240 0.000 1.062 355 S HN 0.690 9.000 8.310 -0.000 0.000 0.483 356 W N 2.053 123.363 121.300 0.017 0.000 2.181 356 W HA 0.316 4.972 4.660 -0.006 0.000 0.335 356 W C 0.861 177.404 176.519 0.040 0.000 1.310 356 W CA -0.810 56.551 57.345 0.028 0.000 1.226 356 W CB -0.066 29.416 29.460 0.037 0.000 1.155 356 W HN 0.575 8.755 8.180 -0.000 0.000 0.565 357 Q N 1.524 121.442 119.800 0.198 0.000 2.340 357 Q HA 0.129 4.465 4.340 -0.007 0.000 0.249 357 Q C 0.267 176.353 176.000 0.144 0.000 0.957 357 Q CA 0.023 55.909 55.803 0.137 0.000 0.882 357 Q CB 0.518 29.259 28.738 0.006 0.000 1.235 357 Q HN 0.336 8.606 8.270 -0.000 0.000 0.439 358 T N 3.552 118.188 114.554 0.136 0.000 2.934 358 T HA 0.013 4.360 4.350 -0.007 0.000 0.306 358 T C 0.397 175.101 174.700 0.007 0.000 1.042 358 T CA -0.134 62.008 62.100 0.072 0.000 1.145 358 T CB 0.298 69.200 68.868 0.057 0.000 0.982 358 T HN 0.106 8.347 8.240 -0.000 0.000 0.544 359 K N 3.327 123.657 120.400 -0.118 0.000 2.355 359 K HA 0.161 4.477 4.320 -0.007 0.000 0.270 359 K C 0.570 176.995 176.600 -0.291 0.000 1.003 359 K CA 0.084 56.160 56.287 -0.350 0.000 0.957 359 K CB 0.546 32.599 32.500 -0.744 0.000 0.939 359 K HN 0.682 8.932 8.250 -0.000 0.000 0.482 360 E N 1.787 121.829 120.200 -0.264 0.000 3.729 360 E HA 0.086 4.432 4.350 -0.007 0.000 0.195 360 E C 0.191 176.737 176.600 -0.089 0.000 1.005 360 E CA -0.044 56.280 56.400 -0.127 0.000 1.356 360 E CB 0.169 29.849 29.700 -0.033 0.000 1.138 360 E HN 0.522 8.882 8.360 -0.000 0.000 0.450 361 Y N 0.189 120.422 120.300 -0.112 0.000 2.315 361 Y HA -0.258 4.288 4.550 -0.007 0.000 0.288 361 Y C 2.425 178.248 175.900 -0.127 0.000 1.154 361 Y CA 0.868 58.873 58.100 -0.159 0.000 1.229 361 Y CB -0.052 38.309 38.460 -0.165 0.000 0.980 361 Y HN 0.274 8.554 8.280 -0.000 0.000 0.540 362 N N 0.287 119.021 118.700 0.056 0.000 2.289 362 N HA -0.150 4.586 4.740 -0.007 0.000 0.184 362 N C 1.304 176.808 175.510 -0.010 0.000 1.016 362 N CA 1.333 54.398 53.050 0.025 0.000 0.872 362 N CB -0.166 38.333 38.487 0.019 0.000 0.973 362 N HN 0.074 8.454 8.380 -0.000 0.000 0.433 363 V N -0.518 119.361 119.914 -0.059 0.000 2.672 363 V HA -0.015 4.101 4.120 -0.007 0.000 0.242 363 V C 2.054 178.048 176.094 -0.167 0.000 1.059 363 V CA 1.128 63.362 62.300 -0.109 0.000 1.081 363 V CB 0.158 31.890 31.823 -0.151 0.000 0.752 363 V HN 0.394 8.584 8.190 -0.000 0.000 0.472 364 V N -1.697 118.068 119.914 -0.248 0.000 3.406 364 V HA 0.237 4.353 4.120 -0.007 0.000 0.263 364 V C 1.010 177.104 176.094 0.000 0.000 1.172 364 V CA 0.412 62.548 62.300 -0.274 0.000 1.140 364 V CB -0.588 30.825 31.823 -0.684 0.000 0.784 364 V HN 0.367 8.557 8.190 -0.000 0.000 0.467 365 R N 0.842 121.339 120.500 -0.004 0.000 2.664 365 R HA 0.543 4.879 4.340 -0.007 0.000 0.286 365 R C -0.478 175.855 176.300 0.055 0.000 0.967 365 R CA 0.034 56.148 56.100 0.024 0.000 0.933 365 R CB 1.172 31.324 30.300 -0.247 0.000 1.146 365 R HN 0.374 8.644 8.270 -0.000 0.000 0.468 366 N N 0.453 119.225 118.700 0.121 0.000 2.241 366 N HA 0.047 4.783 4.740 -0.007 0.000 0.238 366 N C -1.244 174.341 175.510 0.125 0.000 1.244 366 N CA -0.414 52.697 53.050 0.102 0.000 0.880 366 N CB 0.494 39.032 38.487 0.085 0.000 1.179 366 N HN 0.590 8.970 8.380 -0.000 0.000 0.513 367 N N -1.976 116.845 118.700 0.202 0.000 2.416 367 N HA 0.455 5.191 4.740 -0.007 0.000 0.276 367 N C -0.788 174.881 175.510 0.265 0.000 1.261 367 N CA -0.864 52.300 53.050 0.189 0.000 0.790 367 N CB 1.383 39.951 38.487 0.134 0.000 1.554 367 N HN -0.335 8.045 8.380 -0.000 0.000 0.481 368 V N 0.000 120.022 119.914 0.181 0.000 2.409 368 V HA 0.000 4.116 4.120 -0.007 0.000 0.244 368 V CA 0.000 62.424 62.300 0.207 0.000 1.235 368 V CB 0.000 31.890 31.823 0.112 0.000 1.184 368 V HN 0.000 8.190 8.190 -0.000 0.000 0.556