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 3bxd_1_A DATA FIRST_RESID 28 DATA SEQUENCE FRNYTSGPLL DRVFTTYKLM HTHQTVDFVS RKRIQYGSFS YKKMTIMEAV DATA SEQUENCE GMLDDLVDES DPDVDFPNSF HAFQTAEGIR KAHPDKDWFH LVGLLHDLGK DATA SEQUENCE IMALWGEPQW AVVGDTFPVG CRPQASVVFC DSTFQDNPDL QDPRYSTELG DATA SEQUENCE MYQPHCGLEN VLMSWGHDEY LYQMMKFNKF SLPSEAFYMI RFHSFYPWHT DATA SEQUENCE GGDYRQLCSQ QDLDMLPWVQ EFNKFDLYTK CPDLPDVESL RPYYQGLIDK DATA SEQUENCE YCPGTLSW 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 F HA 0.000 4.545 4.527 0.029 0.000 0.279 28 F C 0.000 175.779 175.800 -0.035 0.000 0.967 28 F CA 0.000 58.031 58.000 0.052 0.000 1.383 28 F CB 0.000 39.127 39.000 0.212 0.000 1.145 29 R N 3.036 123.577 120.500 0.069 0.000 3.332 29 R HA -0.455 3.659 4.340 -0.376 0.000 0.263 29 R C -1.951 174.069 176.300 -0.467 0.000 1.053 29 R CA 0.559 56.524 56.100 -0.224 0.000 0.705 29 R CB -1.301 28.988 30.300 -0.018 0.000 1.166 29 R HN 0.117 8.816 8.270 0.083 -0.379 0.427 30 N N -1.201 117.247 118.700 -0.421 0.000 2.426 30 N HA 0.018 4.634 4.740 -0.206 0.000 0.257 30 N C -1.015 174.266 175.510 -0.380 0.000 1.002 30 N CA -0.356 52.517 53.050 -0.295 0.000 0.942 30 N CB -0.001 38.412 38.487 -0.123 0.000 1.112 30 N HN -0.086 8.094 8.380 -0.333 0.000 0.499 31 Y N 3.712 124.021 120.300 0.015 0.000 2.584 31 Y HA 0.185 4.815 4.550 0.134 0.000 0.254 31 Y C 0.504 176.470 175.900 0.112 0.000 1.177 31 Y CA -0.523 57.603 58.100 0.043 0.000 1.216 31 Y CB 0.048 38.376 38.460 -0.220 0.000 1.172 31 Y HN 0.478 8.739 8.280 -0.033 0.000 0.529 32 T N -0.060 114.589 114.554 0.159 0.000 2.990 32 T HA 0.047 4.493 4.350 0.160 0.000 0.250 32 T C -0.297 174.453 174.700 0.083 0.000 1.041 32 T CA 0.963 63.138 62.100 0.125 0.000 1.010 32 T CB 0.803 69.718 68.868 0.079 0.000 1.003 32 T HN -0.156 8.356 8.240 0.093 -0.216 0.499 33 S N -0.238 115.497 115.700 0.058 0.000 2.638 33 S HA 0.211 4.703 4.470 0.036 0.000 0.274 33 S C -1.997 172.613 174.600 0.016 0.000 1.157 33 S CA -0.575 57.644 58.200 0.031 0.000 0.826 33 S CB 3.177 66.383 63.200 0.010 0.000 1.139 33 S HN -0.736 7.765 8.310 0.048 -0.162 0.474 34 G N -0.907 107.898 108.800 0.009 0.000 2.335 34 G HA2 -0.057 3.892 3.960 -0.017 0.000 0.592 34 G HA3 -0.057 3.899 3.960 -0.007 0.000 0.592 34 G C -1.702 173.205 174.900 0.012 0.000 1.442 34 G CA -0.313 44.786 45.100 -0.002 0.000 0.976 34 G HN -0.309 7.986 8.290 0.009 0.000 0.652 35 P HA 0.107 4.533 4.420 0.010 0.000 0.245 35 P C -0.521 176.792 177.300 0.021 0.000 1.206 35 P CA 1.166 64.272 63.100 0.010 0.000 0.781 35 P CB 0.302 32.003 31.700 0.001 0.000 0.994 36 L N -3.223 118.018 121.223 0.030 0.000 2.693 36 L HA 0.382 4.745 4.340 0.038 0.000 0.235 36 L C 0.435 177.359 176.870 0.089 0.000 1.127 36 L CA -0.957 53.910 54.840 0.046 0.000 0.914 36 L CB 0.112 42.190 42.059 0.033 0.000 1.193 36 L HN -0.304 7.893 8.230 0.026 0.048 0.502 37 L N 0.386 121.670 121.223 0.102 0.000 2.187 37 L HA -0.413 4.073 4.340 0.243 0.000 0.213 37 L C 0.576 177.550 176.870 0.173 0.000 1.100 37 L CA 2.635 57.580 54.840 0.175 0.000 0.765 37 L CB -0.130 42.020 42.059 0.152 0.000 0.904 37 L HN -0.797 7.429 8.230 0.077 0.050 0.437 38 D N -2.798 117.665 120.400 0.105 0.000 2.097 38 D HA -0.310 4.383 4.640 0.088 0.000 0.195 38 D C 1.544 177.912 176.300 0.115 0.000 0.989 38 D CA 3.382 57.437 54.000 0.091 0.000 0.827 38 D CB -0.101 40.729 40.800 0.051 0.000 0.966 38 D HN 0.386 8.774 8.370 0.081 0.031 0.456 39 R N -2.050 118.504 120.500 0.091 0.000 2.236 39 R HA -0.076 4.295 4.340 0.053 0.000 0.208 39 R C 2.437 178.785 176.300 0.079 0.000 1.036 39 R CA 2.473 58.612 56.100 0.065 0.000 1.001 39 R CB -0.278 30.044 30.300 0.036 0.000 0.896 39 R HN -0.624 7.695 8.270 0.081 0.000 0.464 40 V N -2.230 117.780 119.914 0.161 0.000 2.649 40 V HA 0.120 4.448 4.120 0.135 -0.127 0.248 40 V C 1.285 177.575 176.094 0.326 0.000 1.054 40 V CA 2.347 64.795 62.300 0.247 0.000 1.073 40 V CB 0.166 32.233 31.823 0.407 0.000 0.699 40 V HN -0.710 7.561 8.190 0.184 0.030 0.463 41 F N 2.450 122.462 119.950 0.103 0.000 2.146 41 F HA -0.213 4.170 4.527 -0.240 0.000 0.298 41 F C 0.844 176.556 175.800 -0.147 0.000 1.096 41 F CA 3.942 61.832 58.000 -0.184 0.000 1.275 41 F CB 0.561 39.302 39.000 -0.431 0.000 1.008 41 F HN -0.235 8.275 8.300 0.351 0.000 0.480 42 T N 0.264 114.767 114.554 -0.085 0.000 2.720 42 T HA -0.502 3.696 4.350 -0.253 0.000 0.268 42 T C 1.871 176.424 174.700 -0.245 0.000 1.037 42 T CA 4.925 66.921 62.100 -0.173 0.000 1.144 42 T CB -0.083 68.770 68.868 -0.025 0.000 0.864 42 T HN -0.565 7.732 8.240 0.096 0.000 0.444 43 T N -0.770 113.680 114.554 -0.173 0.000 2.995 43 T HA -0.215 4.053 4.350 -0.136 0.000 0.269 43 T C 1.271 175.770 174.700 -0.335 0.000 1.091 43 T CA 2.879 64.859 62.100 -0.202 0.000 1.128 43 T CB 0.050 68.797 68.868 -0.201 0.000 0.891 43 T HN -0.575 7.593 8.240 -0.108 0.007 0.492 44 Y N -0.281 119.822 120.300 -0.328 0.000 2.476 44 Y HA -0.077 4.143 4.550 -0.550 0.000 0.283 44 Y C 1.226 176.613 175.900 -0.855 0.000 1.109 44 Y CA 2.850 60.616 58.100 -0.557 0.000 1.246 44 Y CB 0.313 38.590 38.460 -0.306 0.000 1.068 44 Y HN -0.752 7.406 8.280 -0.204 0.000 0.552 45 K N 1.362 121.417 120.400 -0.574 0.000 2.155 45 K HA -0.156 3.863 4.320 -0.501 0.000 0.203 45 K C 2.109 178.437 176.600 -0.454 0.000 1.052 45 K CA 2.691 58.624 56.287 -0.590 0.000 0.948 45 K CB -0.704 31.275 32.500 -0.867 0.000 0.728 45 K HN -0.439 7.441 8.250 -0.618 0.000 0.448 46 L N -2.701 118.266 121.223 -0.428 0.000 2.270 46 L HA -0.185 3.978 4.340 -0.296 0.000 0.210 46 L C 1.868 178.381 176.870 -0.596 0.000 1.104 46 L CA 2.611 57.199 54.840 -0.421 0.000 0.804 46 L CB 0.148 41.938 42.059 -0.447 0.000 0.937 46 L HN -0.503 7.459 8.230 -0.423 0.014 0.450 47 M N -3.882 115.433 119.600 -0.475 0.000 2.357 47 M HA -0.112 4.086 4.480 -0.470 0.000 0.266 47 M C 1.662 177.922 176.300 -0.067 0.000 1.095 47 M CA 2.940 58.095 55.300 -0.241 0.000 1.156 47 M CB 0.417 33.087 32.600 0.116 0.000 1.365 47 M HN -0.704 7.216 8.290 -0.436 0.108 0.447 48 H N -0.466 118.467 119.070 -0.229 0.000 2.293 48 H HA -0.094 4.273 4.556 -0.316 0.000 0.300 48 H C 2.411 177.493 175.328 -0.410 0.000 1.082 48 H CA 2.473 58.200 56.048 -0.535 0.000 1.308 48 H CB -0.303 28.663 29.762 -1.325 0.000 1.375 48 H HN -0.306 7.680 8.280 -0.491 0.000 0.495 49 T N -0.899 113.451 114.554 -0.339 0.000 3.139 49 T HA -0.179 3.985 4.350 -0.309 0.000 0.267 49 T C 0.009 174.304 174.700 -0.674 0.000 1.164 49 T CA 2.741 64.575 62.100 -0.443 0.000 1.075 49 T CB 0.246 68.793 68.868 -0.536 0.000 0.904 49 T HN -0.608 7.413 8.240 -0.366 0.000 0.540 50 H N -3.543 115.298 119.070 -0.381 0.000 3.650 50 H HA 0.137 4.520 4.556 -0.288 0.000 0.260 50 H C -1.089 174.023 175.328 -0.360 0.000 1.194 50 H CA -0.049 55.721 56.048 -0.463 0.000 1.135 50 H CB 1.575 30.756 29.762 -0.969 0.000 1.612 50 H HN -0.790 7.140 8.280 -0.270 0.188 0.703 51 Q N 1.556 121.353 119.800 -0.005 0.000 2.423 51 Q HA 0.079 4.390 4.340 -0.048 0.000 0.235 51 Q C -0.689 175.436 176.000 0.208 0.000 1.100 51 Q CA -0.432 55.448 55.803 0.128 0.000 0.908 51 Q CB -0.753 28.196 28.738 0.352 0.000 1.312 51 Q HN -0.418 7.899 8.270 0.078 0.000 0.497 52 T N -2.542 112.122 114.554 0.183 0.000 2.938 52 T HA 0.437 4.980 4.350 0.122 -0.120 0.285 52 T C 0.711 175.479 174.700 0.113 0.000 1.028 52 T CA -3.311 58.875 62.100 0.143 0.000 1.005 52 T CB 3.408 72.358 68.868 0.137 0.000 1.157 52 T HN -0.594 7.774 8.240 0.214 0.000 0.550 53 V N 0.265 120.141 119.914 -0.062 0.000 2.343 53 V HA -0.481 3.587 4.120 -0.087 0.000 0.247 53 V C 1.571 177.678 176.094 0.021 0.000 1.051 53 V CA 4.580 66.811 62.300 -0.115 0.000 1.036 53 V CB 0.011 31.591 31.823 -0.405 0.000 0.654 53 V HN 0.073 8.421 8.190 -0.162 -0.255 0.451 54 D N -1.178 119.267 120.400 0.075 0.000 2.097 54 D HA -0.301 4.374 4.640 0.058 0.000 0.195 54 D C 1.637 178.005 176.300 0.113 0.000 0.989 54 D CA 3.269 57.325 54.000 0.094 0.000 0.827 54 D CB -0.505 40.365 40.800 0.117 0.000 0.966 54 D HN -0.044 8.373 8.370 0.079 0.000 0.456 55 F N 0.995 120.972 119.950 0.045 0.000 2.051 55 F HA -0.342 4.214 4.527 0.049 0.000 0.296 55 F C 1.351 177.155 175.800 0.008 0.000 1.122 55 F CA 3.419 61.458 58.000 0.064 0.000 1.201 55 F CB 0.358 39.460 39.000 0.170 0.000 0.978 55 F HN -0.999 7.522 8.300 0.367 0.000 0.472 56 V N -1.564 118.523 119.914 0.289 0.000 2.380 56 V HA -0.657 3.528 4.120 0.108 0.000 0.251 56 V C 2.106 178.145 176.094 -0.092 0.000 1.063 56 V CA 4.407 66.784 62.300 0.127 0.000 1.055 56 V CB -0.518 31.437 31.823 0.221 0.000 0.657 56 V HN -0.350 8.111 8.190 0.451 0.000 0.455 57 S N -0.223 115.442 115.700 -0.059 0.000 2.387 57 S HA -0.201 4.229 4.470 -0.067 0.000 0.226 57 S C 2.217 176.714 174.600 -0.173 0.000 1.026 57 S CA 3.349 61.498 58.200 -0.084 0.000 0.972 57 S CB -0.569 62.611 63.200 -0.033 0.000 0.814 57 S HN -0.433 7.762 8.310 -0.005 0.112 0.477 58 R N 1.221 121.584 120.500 -0.229 0.000 2.073 58 R HA -0.253 3.955 4.340 -0.220 0.000 0.229 58 R C 2.393 178.428 176.300 -0.442 0.000 1.120 58 R CA 3.551 59.479 56.100 -0.286 0.000 0.967 58 R CB -0.074 30.064 30.300 -0.270 0.000 0.862 58 R HN -0.332 7.813 8.270 -0.208 0.000 0.436 59 K N -1.100 118.892 120.400 -0.679 0.000 2.148 59 K HA -0.145 3.718 4.320 -0.762 0.000 0.204 59 K C 2.551 178.549 176.600 -1.004 0.000 1.050 59 K CA 1.701 57.404 56.287 -0.974 0.000 0.942 59 K CB -0.681 30.845 32.500 -1.623 0.000 0.724 59 K HN -0.205 7.620 8.250 -0.710 0.000 0.446 60 R N -1.549 118.488 120.500 -0.772 0.000 2.105 60 R HA -0.307 3.731 4.340 -0.504 0.000 0.239 60 R C 2.123 178.256 176.300 -0.279 0.000 1.135 60 R CA 3.459 59.300 56.100 -0.431 0.000 0.967 60 R CB -0.241 29.983 30.300 -0.126 0.000 0.861 60 R HN -0.468 7.431 8.270 -0.619 0.000 0.442 61 I N -2.976 117.429 120.570 -0.276 0.000 2.233 61 I HA -0.289 3.778 4.170 -0.172 0.000 0.243 61 I C 2.320 178.274 176.117 -0.271 0.000 1.093 61 I CA 1.766 62.934 61.300 -0.219 0.000 1.380 61 I CB -0.985 36.906 38.000 -0.182 0.000 1.067 61 I HN -0.820 7.210 8.210 -0.296 0.002 0.413 62 Q N 0.955 120.537 119.800 -0.363 0.000 2.181 62 Q HA -0.344 3.777 4.340 -0.366 0.000 0.205 62 Q C 1.418 177.108 176.000 -0.517 0.000 0.980 62 Q CA 3.119 58.648 55.803 -0.457 0.000 0.862 62 Q CB 0.282 28.658 28.738 -0.604 0.000 0.905 62 Q HN -0.173 7.787 8.270 -0.399 0.071 0.429 63 Y N -5.795 114.361 120.300 -0.240 0.000 2.445 63 Y HA 0.162 4.660 4.550 -0.086 0.000 0.247 63 Y C 1.821 177.327 175.900 -0.657 0.000 1.129 63 Y CA 0.100 58.081 58.100 -0.197 0.000 1.251 63 Y CB 1.159 39.709 38.460 0.149 0.000 1.176 63 Y HN -0.501 7.604 8.280 -0.248 0.027 0.522 64 G N -0.706 107.843 108.800 -0.418 0.000 2.679 64 G HA2 -0.177 3.409 3.960 -0.624 0.000 0.212 64 G HA3 -0.177 3.709 3.960 -0.245 -0.073 0.212 64 G C 0.151 174.712 174.900 -0.565 0.000 1.137 64 G CA 1.442 46.240 45.100 -0.503 0.000 0.787 64 G HN -0.392 7.614 8.290 -0.291 0.109 0.534 65 S N -0.531 114.850 115.700 -0.532 0.000 2.524 65 S HA 0.028 4.344 4.470 -0.256 0.000 0.215 65 S C -0.682 173.653 174.600 -0.442 0.000 0.986 65 S CA -0.137 57.852 58.200 -0.351 0.000 0.911 65 S CB 0.940 64.037 63.200 -0.173 0.000 0.805 65 S HN -0.431 7.538 8.310 -0.478 0.054 0.501 66 F N -0.738 119.054 119.950 -0.263 0.000 2.635 66 F HA -0.287 4.401 4.527 0.101 -0.100 0.228 66 F C -0.375 175.374 175.800 -0.085 0.000 1.029 66 F CA 0.569 58.460 58.000 -0.182 0.000 0.907 66 F CB -1.943 36.734 39.000 -0.539 0.000 0.893 66 F HN -0.675 7.011 8.300 -1.024 0.000 0.845 67 S N -2.857 112.906 115.700 0.104 0.000 2.846 67 S HA 0.031 4.555 4.470 0.089 0.000 0.249 67 S C -0.727 173.879 174.600 0.010 0.000 1.028 67 S CA -0.215 58.017 58.200 0.053 0.000 1.043 67 S CB 1.186 64.362 63.200 -0.040 0.000 0.990 67 S HN -0.247 8.131 8.310 0.114 0.000 0.564 68 Y N 0.955 121.209 120.300 -0.075 0.000 2.153 68 Y HA -0.322 4.026 4.550 -0.336 0.000 0.289 68 Y C -0.338 175.440 175.900 -0.204 0.000 1.119 68 Y CA 2.229 60.145 58.100 -0.307 0.000 1.116 68 Y CB 0.436 38.435 38.460 -0.769 0.000 1.004 68 Y HN -0.425 8.083 8.280 0.381 0.000 0.501 69 K N -4.429 116.098 120.400 0.213 0.000 2.536 69 K HA 0.315 4.717 4.320 0.138 0.000 0.269 69 K C -2.677 174.165 176.600 0.403 0.000 0.965 69 K CA -0.970 55.461 56.287 0.240 0.000 0.860 69 K CB 3.129 35.789 32.500 0.266 0.000 1.423 69 K HN -0.554 7.920 8.250 0.374 0.000 0.438 70 K N 1.869 122.452 120.400 0.306 0.000 2.244 70 K HA 0.945 5.779 4.320 0.547 -0.186 0.260 70 K C -0.821 175.957 176.600 0.298 0.000 0.951 70 K CA -1.396 55.114 56.287 0.370 0.000 0.826 70 K CB 1.842 34.489 32.500 0.247 0.000 1.108 70 K HN 0.205 8.585 8.250 0.216 0.000 0.433 71 M N 2.346 122.190 119.600 0.406 0.000 2.643 71 M HA 0.295 4.994 4.480 0.153 -0.127 0.276 71 M C -1.584 174.956 176.300 0.401 0.000 1.200 71 M CA -0.379 55.063 55.300 0.237 0.000 0.863 71 M CB 6.061 38.583 32.600 -0.131 0.000 1.711 71 M HN 0.146 8.800 8.290 0.607 0.000 0.492 72 T N -1.896 112.798 114.554 0.233 0.000 2.816 72 T HA 0.411 5.085 4.350 0.289 -0.150 0.282 72 T C 1.502 176.369 174.700 0.277 0.000 0.993 72 T CA -2.263 59.985 62.100 0.246 0.000 0.994 72 T CB 2.123 71.073 68.868 0.138 0.000 1.025 72 T HN 0.031 8.600 8.240 0.150 -0.239 0.529 73 I N 1.375 122.118 120.570 0.290 0.000 2.151 73 I HA -0.389 4.043 4.170 0.438 0.000 0.243 73 I C 1.999 178.182 176.117 0.111 0.000 1.080 73 I CA 3.789 65.254 61.300 0.275 0.000 1.339 73 I CB -0.845 37.277 38.000 0.203 0.000 1.039 73 I HN 0.804 9.160 8.210 0.243 0.000 0.409 74 M N -2.018 117.634 119.600 0.087 0.000 2.175 74 M HA -0.337 4.172 4.480 0.048 0.000 0.264 74 M C 2.657 178.966 176.300 0.015 0.000 1.063 74 M CA 2.320 57.655 55.300 0.058 0.000 1.119 74 M CB -1.456 31.198 32.600 0.089 0.000 1.377 74 M HN -0.182 8.169 8.290 0.102 0.000 0.415 75 E N -0.185 120.020 120.200 0.008 0.000 2.038 75 E HA -0.414 3.921 4.350 -0.026 0.000 0.195 75 E C 2.162 178.684 176.600 -0.130 0.000 1.000 75 E CA 3.076 59.452 56.400 -0.040 0.000 0.803 75 E CB -0.218 29.467 29.700 -0.026 0.000 0.750 75 E HN -0.403 7.979 8.360 0.036 0.000 0.448 76 A N -0.640 122.047 122.820 -0.222 0.000 1.933 76 A HA -0.211 3.832 4.320 -0.461 0.000 0.218 76 A C 2.236 179.672 177.584 -0.246 0.000 1.175 76 A CA 2.913 54.709 52.037 -0.402 0.000 0.628 76 A CB -0.347 18.202 19.000 -0.752 0.000 0.814 76 A HN -0.444 7.599 8.150 -0.178 0.000 0.444 77 V N -2.024 117.803 119.914 -0.145 0.000 2.343 77 V HA -0.515 3.515 4.120 -0.150 0.000 0.247 77 V C 2.658 178.687 176.094 -0.107 0.000 1.051 77 V CA 3.670 65.894 62.300 -0.126 0.000 1.036 77 V CB -0.189 31.570 31.823 -0.106 0.000 0.654 77 V HN -0.060 8.067 8.190 -0.105 0.000 0.451 78 G N -1.530 107.221 108.800 -0.080 0.000 2.448 78 G HA2 -0.225 3.957 3.960 -0.074 0.000 0.218 78 G HA3 -0.225 3.705 3.960 -0.051 0.000 0.218 78 G C 1.324 176.167 174.900 -0.094 0.000 1.135 78 G CA 1.597 46.654 45.100 -0.072 0.000 0.784 78 G HN -0.285 7.963 8.290 -0.070 0.000 0.543 79 M N 1.923 121.448 119.600 -0.124 0.000 2.149 79 M HA -0.344 4.076 4.480 -0.099 0.000 0.261 79 M C 1.493 177.708 176.300 -0.142 0.000 1.064 79 M CA 3.801 59.020 55.300 -0.135 0.000 1.102 79 M CB 0.085 32.568 32.600 -0.195 0.000 1.369 79 M HN -0.388 7.707 8.290 -0.142 0.110 0.408 80 L N -4.000 117.129 121.223 -0.157 0.000 2.610 80 L HA -0.173 4.077 4.340 -0.150 0.000 0.232 80 L C 0.742 177.550 176.870 -0.103 0.000 1.149 80 L CA 0.543 55.298 54.840 -0.141 0.000 0.872 80 L CB -1.571 40.399 42.059 -0.148 0.000 0.992 80 L HN -0.607 7.413 8.230 -0.164 0.112 0.447 81 D N 0.890 121.225 120.400 -0.108 0.000 2.218 81 D HA -0.150 4.413 4.640 -0.128 0.000 0.204 81 D C 0.880 177.166 176.300 -0.023 0.000 0.976 81 D CA 2.631 56.576 54.000 -0.090 0.000 0.853 81 D CB -0.181 40.567 40.800 -0.087 0.000 0.939 81 D HN -0.346 7.767 8.370 -0.113 0.190 0.481 82 D N -2.283 118.092 120.400 -0.041 0.000 2.427 82 D HA 0.166 4.804 4.640 -0.002 0.000 0.224 82 D C -1.111 175.165 176.300 -0.041 0.000 1.157 82 D CA -0.295 53.689 54.000 -0.026 0.000 0.828 82 D CB 0.079 40.859 40.800 -0.033 0.000 0.974 82 D HN -0.398 7.787 8.370 -0.066 0.146 0.498 83 L N -0.693 120.503 121.223 -0.045 0.000 2.436 83 L HA 0.383 4.682 4.340 -0.069 0.000 0.268 83 L C -2.674 174.166 176.870 -0.050 0.000 0.974 83 L CA -0.293 54.505 54.840 -0.070 0.000 0.826 83 L CB 3.664 45.646 42.059 -0.127 0.000 1.291 83 L HN -0.877 7.269 8.230 -0.031 0.065 0.406 84 V N 4.411 124.288 119.914 -0.062 0.000 2.680 84 V HA 0.163 4.232 4.120 -0.085 0.000 0.309 84 V C -1.688 174.338 176.094 -0.114 0.000 1.052 84 V CA -1.634 60.619 62.300 -0.078 0.000 0.908 84 V CB 2.898 34.690 31.823 -0.051 0.000 1.001 84 V HN -0.075 8.077 8.190 -0.064 0.000 0.431 85 D N 4.269 124.580 120.400 -0.148 0.000 2.280 85 D HA 0.032 4.702 4.640 -0.157 -0.123 0.243 85 D C 0.073 176.302 176.300 -0.118 0.000 1.129 85 D CA -0.502 53.405 54.000 -0.154 0.000 0.848 85 D CB 1.179 41.866 40.800 -0.188 0.000 1.107 85 D HN 0.065 8.332 8.370 -0.171 0.000 0.471 86 E N 4.868 125.004 120.200 -0.105 0.000 2.478 86 E HA -0.122 4.194 4.350 -0.057 0.000 0.194 86 E C 0.901 177.463 176.600 -0.064 0.000 1.045 86 E CA 1.020 57.376 56.400 -0.073 0.000 0.868 86 E CB 0.634 30.294 29.700 -0.068 0.000 0.885 86 E HN 0.334 8.916 8.360 -0.120 -0.293 0.505 87 S N -2.822 112.823 115.700 -0.093 0.000 2.503 87 S HA 0.009 4.429 4.470 -0.083 0.000 0.215 87 S C -0.330 174.334 174.600 0.107 0.000 1.003 87 S CA 1.263 59.417 58.200 -0.075 0.000 0.910 87 S CB 0.949 63.995 63.200 -0.257 0.000 0.790 87 S HN -0.366 8.163 8.310 -0.111 -0.285 0.514 88 D N 3.559 123.980 120.400 0.036 0.000 2.316 88 D HA 0.335 5.037 4.640 0.104 0.000 0.245 88 D C -0.497 175.825 176.300 0.037 0.000 1.171 88 D CA -2.520 51.506 54.000 0.043 0.000 0.856 88 D CB 1.714 42.479 40.800 -0.059 0.000 1.090 88 D HN -0.793 7.660 8.370 -0.024 -0.098 0.476 89 P HA 0.119 4.562 4.420 0.039 0.000 0.249 89 P C -1.227 176.059 177.300 -0.022 0.000 1.229 89 P CA 0.341 63.450 63.100 0.015 0.000 0.788 89 P CB 0.296 31.960 31.700 -0.060 0.000 1.072 90 D N -3.661 116.732 120.400 -0.010 0.000 2.469 90 D HA 0.197 4.819 4.640 -0.029 0.000 0.213 90 D C -0.758 175.532 176.300 -0.016 0.000 1.135 90 D CA -0.008 53.995 54.000 0.005 0.000 0.834 90 D CB 2.101 42.977 40.800 0.127 0.000 1.009 90 D HN -0.483 7.996 8.370 -0.004 -0.111 0.507 91 V N -0.065 119.778 119.914 -0.119 0.000 2.760 91 V HA 0.081 3.981 4.120 -0.366 0.000 0.309 91 V C -2.280 173.623 176.094 -0.318 0.000 1.077 91 V CA -0.960 61.127 62.300 -0.356 0.000 0.910 91 V CB 3.101 34.594 31.823 -0.550 0.000 1.008 91 V HN -0.963 7.165 8.190 -0.105 0.000 0.424 92 D N 2.804 123.005 120.400 -0.333 0.000 3.007 92 D HA 0.115 4.671 4.640 -0.140 0.000 0.363 92 D C -1.685 174.623 176.300 0.013 0.000 1.474 92 D CA -0.386 53.542 54.000 -0.121 0.000 0.767 92 D CB 0.703 41.503 40.800 -0.001 0.000 1.227 92 D HN 0.178 8.318 8.370 -0.382 0.000 0.471 93 F N -3.771 116.214 119.950 0.058 0.000 2.643 93 F HA 0.518 5.091 4.527 0.077 0.000 0.314 93 F C -2.488 173.408 175.800 0.160 0.000 1.096 93 F CA -3.517 54.539 58.000 0.094 0.000 0.953 93 F CB -1.079 37.958 39.000 0.062 0.000 1.345 93 F HN -0.639 7.217 8.300 -0.741 0.000 0.468 94 P HA -0.125 4.619 4.420 0.184 -0.214 0.263 94 P C -0.196 177.331 177.300 0.379 0.000 1.175 94 P CA 0.171 63.484 63.100 0.355 0.000 0.761 94 P CB 0.551 32.483 31.700 0.386 0.000 0.794 95 N N 3.189 121.970 118.700 0.134 0.000 2.457 95 N HA -0.244 4.585 4.740 0.148 0.000 0.180 95 N C 1.384 176.987 175.510 0.155 0.000 1.050 95 N CA 1.745 54.862 53.050 0.112 0.000 0.906 95 N CB 0.816 39.281 38.487 -0.038 0.000 0.968 95 N HN 0.134 8.547 8.380 0.055 0.000 0.445 96 S N 0.979 116.704 115.700 0.041 0.000 2.370 96 S HA -0.377 4.055 4.470 -0.063 0.000 0.226 96 S C 1.400 176.044 174.600 0.074 0.000 1.033 96 S CA 3.481 61.647 58.200 -0.057 0.000 1.011 96 S CB -0.213 62.849 63.200 -0.230 0.000 0.852 96 S HN -0.551 7.728 8.310 0.005 0.034 0.457 97 F N 1.016 121.149 119.950 0.305 0.000 2.134 97 F HA -0.368 4.351 4.527 0.321 0.000 0.299 97 F C 2.020 178.028 175.800 0.347 0.000 1.097 97 F CA 3.389 61.578 58.000 0.315 0.000 1.264 97 F CB -0.513 38.609 39.000 0.203 0.000 1.001 97 F HN -0.915 7.480 8.300 0.159 0.000 0.479 98 H N 0.467 119.848 119.070 0.519 0.000 2.387 98 H HA -0.378 4.603 4.556 0.442 -0.159 0.299 98 H C 1.681 177.146 175.328 0.228 0.000 1.099 98 H CA 3.134 59.413 56.048 0.386 0.000 1.315 98 H CB -0.052 29.881 29.762 0.284 0.000 1.380 98 H HN -0.285 8.447 8.280 0.754 0.000 0.513 99 A N -1.400 121.412 122.820 -0.013 0.000 1.883 99 A HA -0.301 3.874 4.320 -0.242 0.000 0.217 99 A C 1.695 179.109 177.584 -0.283 0.000 1.186 99 A CA 2.864 54.767 52.037 -0.223 0.000 0.624 99 A CB -0.797 18.027 19.000 -0.294 0.000 0.822 99 A HN -0.393 7.737 8.150 0.126 0.095 0.444 100 F N -1.966 117.913 119.950 -0.117 0.000 2.259 100 F HA -0.353 3.983 4.527 -0.319 0.000 0.298 100 F C 2.192 177.934 175.800 -0.096 0.000 1.088 100 F CA 3.799 61.700 58.000 -0.165 0.000 1.358 100 F CB -0.237 38.717 39.000 -0.076 0.000 1.040 100 F HN -0.677 7.623 8.300 0.139 0.083 0.505 101 Q N -0.930 118.955 119.800 0.142 0.000 2.119 101 Q HA -0.354 4.054 4.340 0.113 0.000 0.201 101 Q C 2.568 178.568 176.000 0.001 0.000 0.972 101 Q CA 3.513 59.374 55.803 0.096 0.000 0.847 101 Q CB -0.145 28.686 28.738 0.154 0.000 0.903 101 Q HN -0.203 8.172 8.270 0.175 0.000 0.433 102 T N 2.002 116.486 114.554 -0.115 0.000 2.770 102 T HA -0.267 4.010 4.350 -0.122 0.000 0.263 102 T C 1.441 176.049 174.700 -0.154 0.000 1.039 102 T CA 4.230 66.232 62.100 -0.163 0.000 1.142 102 T CB 0.042 68.761 68.868 -0.249 0.000 0.868 102 T HN -0.392 7.742 8.240 -0.178 0.000 0.435 103 A N 1.157 123.899 122.820 -0.131 0.000 1.940 103 A HA -0.225 4.152 4.320 -0.064 -0.096 0.219 103 A C 2.088 179.673 177.584 0.002 0.000 1.176 103 A CA 3.038 55.032 52.037 -0.072 0.000 0.631 103 A CB -0.817 18.039 19.000 -0.240 0.000 0.814 103 A HN -0.402 7.653 8.150 -0.157 0.000 0.446 104 E N -1.630 118.582 120.200 0.021 0.000 2.072 104 E HA -0.176 4.214 4.350 0.067 0.000 0.190 104 E C 2.864 179.412 176.600 -0.087 0.000 0.982 104 E CA 2.575 58.992 56.400 0.028 0.000 0.803 104 E CB -0.118 29.626 29.700 0.072 0.000 0.755 104 E HN -0.454 7.806 8.360 0.010 0.106 0.453 105 G N -0.304 108.446 108.800 -0.084 0.000 2.421 105 G HA2 -0.265 3.700 3.960 0.009 0.000 0.216 105 G HA3 -0.265 3.727 3.960 0.053 0.000 0.216 105 G C 1.390 176.043 174.900 -0.412 0.000 1.171 105 G CA 2.028 47.088 45.100 -0.067 0.000 0.775 105 G HN -0.384 7.873 8.290 -0.056 0.000 0.543 106 I N 1.924 122.069 120.570 -0.708 0.000 2.226 106 I HA -0.526 2.611 4.170 -1.722 0.000 0.245 106 I C 1.488 177.294 176.117 -0.518 0.000 1.100 106 I CA 3.590 64.272 61.300 -1.030 0.000 1.374 106 I CB -0.103 37.311 38.000 -0.976 0.000 1.057 106 I HN -0.501 7.386 8.210 -0.538 0.000 0.413 107 R N -0.201 120.002 120.500 -0.494 0.000 2.081 107 R HA -0.364 3.093 4.340 -1.472 0.000 0.235 107 R C 2.100 178.156 176.300 -0.406 0.000 1.131 107 R CA 3.329 58.944 56.100 -0.809 0.000 0.960 107 R CB -0.142 29.717 30.300 -0.734 0.000 0.856 107 R HN -0.291 7.736 8.270 -0.406 0.000 0.436 108 K N -2.226 118.017 120.400 -0.260 0.000 2.217 108 K HA -0.207 4.024 4.320 -0.148 0.000 0.202 108 K C 1.800 178.337 176.600 -0.105 0.000 1.051 108 K CA 2.367 58.566 56.287 -0.148 0.000 0.952 108 K CB -0.077 32.368 32.500 -0.091 0.000 0.736 108 K HN -0.556 7.543 8.250 -0.252 0.000 0.453 109 A N -2.703 120.041 122.820 -0.126 0.000 2.095 109 A HA 0.001 4.261 4.320 -0.099 0.000 0.212 109 A C 0.150 177.542 177.584 -0.321 0.000 1.162 109 A CA 1.633 53.587 52.037 -0.138 0.000 0.753 109 A CB 0.904 19.938 19.000 0.056 0.000 0.840 109 A HN -0.519 7.519 8.150 -0.186 0.000 0.468 110 H N -2.846 116.234 119.070 0.016 0.000 2.511 110 H HA 0.577 5.219 4.556 0.142 0.000 0.228 110 H C -1.653 173.824 175.328 0.247 0.000 1.424 110 H CA -2.551 53.583 56.048 0.143 0.000 1.321 110 H CB 0.644 30.550 29.762 0.241 0.000 1.720 110 H HN -0.199 8.089 8.280 0.013 0.000 0.512 111 P HA -0.130 4.525 4.420 0.237 -0.093 0.218 111 P C -0.167 177.294 177.300 0.269 0.000 1.148 111 P CA 1.900 65.137 63.100 0.228 0.000 0.822 111 P CB 0.144 31.899 31.700 0.092 0.000 0.784 112 D N -4.768 115.754 120.400 0.203 0.000 2.363 112 D HA -0.107 4.621 4.640 0.145 0.000 0.226 112 D C -0.257 176.113 176.300 0.116 0.000 1.020 112 D CA 0.387 54.482 54.000 0.158 0.000 0.892 112 D CB -0.922 39.970 40.800 0.152 0.000 0.900 112 D HN 0.279 8.748 8.370 0.197 0.020 0.531 113 K N 1.561 121.977 120.400 0.027 0.000 2.606 113 K HA 0.291 4.530 4.320 -0.135 0.000 0.196 113 K C -0.804 175.316 176.600 -0.801 0.000 1.048 113 K CA -1.334 54.787 56.287 -0.276 0.000 1.017 113 K CB 0.288 32.598 32.500 -0.315 0.000 1.413 113 K HN -0.785 7.475 8.250 0.120 0.061 0.568 114 D N 2.297 122.341 120.400 -0.593 0.000 2.144 114 D HA -0.266 3.325 4.640 -1.748 0.000 0.199 114 D C 1.100 177.131 176.300 -0.447 0.000 0.984 114 D CA 2.563 56.118 54.000 -0.743 0.000 0.834 114 D CB -0.479 40.272 40.800 -0.081 0.000 0.955 114 D HN 0.421 8.650 8.370 -0.234 0.000 0.465 115 W N -2.130 119.028 121.300 -0.237 0.000 2.350 115 W HA -0.318 3.926 4.660 -0.692 0.000 0.289 115 W C 1.121 177.554 176.519 -0.143 0.000 1.215 115 W CA 1.062 58.137 57.345 -0.449 0.000 1.236 115 W CB -1.549 27.554 29.460 -0.596 0.000 1.130 115 W HN -0.332 7.829 8.180 -0.032 0.000 0.541 116 F N 1.262 120.529 119.950 -1.139 0.000 2.259 116 F HA -0.330 3.761 4.527 -0.725 0.000 0.298 116 F C 1.266 176.933 175.800 -0.221 0.000 1.088 116 F CA 1.187 58.631 58.000 -0.927 0.000 1.358 116 F CB -0.578 37.641 39.000 -1.302 0.000 1.040 116 F HN -0.663 6.692 8.300 -1.365 0.126 0.505 117 H N -0.811 118.160 119.070 -0.165 0.000 2.352 117 H HA -0.338 4.143 4.556 -0.124 0.000 0.299 117 H C 2.231 177.629 175.328 0.117 0.000 1.097 117 H CA 2.204 58.243 56.048 -0.014 0.000 1.311 117 H CB -0.027 29.837 29.762 0.171 0.000 1.377 117 H HN -0.929 7.062 8.280 -0.336 0.088 0.504 118 L N -0.741 120.619 121.223 0.228 0.000 2.027 118 L HA -0.322 4.179 4.340 0.267 0.000 0.206 118 L C 1.190 178.137 176.870 0.128 0.000 1.074 118 L CA 2.568 57.525 54.840 0.195 0.000 0.745 118 L CB -0.526 41.610 42.059 0.128 0.000 0.898 118 L HN -0.485 7.831 8.230 0.143 0.000 0.433 119 V N -0.989 119.000 119.914 0.126 0.000 2.317 119 V HA -0.702 3.465 4.120 0.078 0.000 0.251 119 V C 1.922 178.113 176.094 0.161 0.000 1.065 119 V CA 4.618 66.988 62.300 0.117 0.000 1.049 119 V CB -0.533 31.406 31.823 0.193 0.000 0.651 119 V HN -0.293 7.980 8.190 0.137 0.000 0.450 120 G N -1.679 107.218 108.800 0.161 0.000 2.446 120 G HA2 -0.302 3.888 3.960 0.382 0.000 0.217 120 G HA3 -0.302 3.686 3.960 0.046 0.000 0.217 120 G C 1.494 176.506 174.900 0.187 0.000 1.168 120 G CA 2.158 47.380 45.100 0.203 0.000 0.771 120 G HN -0.664 7.676 8.290 0.083 -0.000 0.551 121 L N 0.847 122.055 121.223 -0.025 0.000 2.083 121 L HA -0.161 4.129 4.340 -0.353 -0.162 0.209 121 L C 1.361 178.161 176.870 -0.118 0.000 1.083 121 L CA 1.907 56.610 54.840 -0.227 0.000 0.752 121 L CB 0.170 42.004 42.059 -0.374 0.000 0.899 121 L HN -0.841 7.308 8.230 -0.013 0.072 0.433 122 L N -4.690 116.542 121.223 0.014 0.000 2.270 122 L HA -0.140 4.223 4.340 0.038 0.000 0.210 122 L C 1.944 178.814 176.870 -0.000 0.000 1.104 122 L CA 2.265 57.127 54.840 0.037 0.000 0.804 122 L CB -0.232 41.880 42.059 0.087 0.000 0.937 122 L HN -0.241 7.908 8.230 0.063 0.118 0.450 123 H N -2.513 116.551 119.070 -0.010 0.000 2.457 123 H HA -0.301 4.187 4.556 -0.114 0.000 0.297 123 H C -0.263 175.103 175.328 0.063 0.000 1.092 123 H CA 2.857 58.865 56.048 -0.066 0.000 1.309 123 H CB -0.117 29.557 29.762 -0.146 0.000 1.382 123 H HN -0.587 7.825 8.280 0.220 0.000 0.535 124 D N -1.835 118.254 120.400 -0.519 0.000 2.424 124 D HA 0.219 4.942 4.640 0.138 0.000 0.220 124 D C 1.086 177.329 176.300 -0.095 0.000 1.150 124 D CA -0.332 53.546 54.000 -0.202 0.000 0.831 124 D CB 0.057 40.653 40.800 -0.340 0.000 0.981 124 D HN -0.088 7.812 8.370 -0.741 0.026 0.500 125 L N -0.786 120.424 121.223 -0.021 0.000 2.376 125 L HA -0.151 4.145 4.340 -0.073 0.000 0.219 125 L C 1.647 178.553 176.870 0.059 0.000 1.133 125 L CA 1.945 56.801 54.840 0.027 0.000 0.816 125 L CB -0.527 41.648 42.059 0.194 0.000 0.933 125 L HN -0.423 7.752 8.230 -0.001 0.055 0.449 126 G N -2.253 106.627 108.800 0.133 0.000 2.498 126 G HA2 -0.333 3.693 3.960 0.110 0.000 0.219 126 G HA3 -0.333 3.741 3.960 0.190 0.000 0.219 126 G C 0.607 175.314 174.900 -0.321 0.000 1.119 126 G CA 1.319 46.448 45.100 0.048 0.000 0.766 126 G HN 0.282 8.642 8.290 0.175 0.035 0.552 127 K N 1.181 121.420 120.400 -0.269 0.000 2.555 127 K HA -0.188 3.900 4.320 -0.386 0.000 0.193 127 K C 1.718 178.029 176.600 -0.482 0.000 1.032 127 K CA 1.348 57.410 56.287 -0.376 0.000 1.004 127 K CB -0.481 31.812 32.500 -0.345 0.000 0.804 127 K HN -0.705 7.384 8.250 -0.191 0.047 0.496 128 I N -3.021 117.189 120.570 -0.600 0.000 2.567 128 I HA -0.469 3.294 4.170 -0.678 0.000 0.257 128 I C 1.001 176.390 176.117 -1.212 0.000 1.184 128 I CA 2.712 63.497 61.300 -0.859 0.000 1.451 128 I CB -0.659 36.755 38.000 -0.977 0.000 1.089 128 I HN -0.647 7.181 8.210 -0.532 0.063 0.441 129 M N -0.439 118.530 119.600 -1.051 0.000 2.202 129 M HA -0.414 3.573 4.480 -0.821 0.000 0.262 129 M C 1.507 177.564 176.300 -0.404 0.000 1.063 129 M CA 3.579 58.417 55.300 -0.770 0.000 1.097 129 M CB -0.547 31.640 32.600 -0.688 0.000 1.382 129 M HN -0.613 7.073 8.290 -0.948 0.035 0.413 130 A N -1.606 120.978 122.820 -0.393 0.000 2.015 130 A HA -0.057 4.320 4.320 -0.194 -0.174 0.219 130 A C 2.274 179.753 177.584 -0.175 0.000 1.163 130 A CA 2.317 54.208 52.037 -0.243 0.000 0.646 130 A CB -0.383 18.474 19.000 -0.240 0.000 0.806 130 A HN -0.488 7.368 8.150 -0.451 0.024 0.448 131 L N -4.371 116.696 121.223 -0.260 0.000 2.395 131 L HA -0.107 4.188 4.340 -0.076 0.000 0.218 131 L C 0.792 177.712 176.870 0.084 0.000 1.130 131 L CA 1.194 55.954 54.840 -0.134 0.000 0.826 131 L CB -0.165 41.767 42.059 -0.212 0.000 0.941 131 L HN -0.621 7.248 8.230 -0.408 0.116 0.451 132 W N -1.718 119.561 121.300 -0.035 0.000 3.400 132 W HA 0.147 4.848 4.660 0.069 0.000 0.347 132 W C 0.419 176.972 176.519 0.057 0.000 1.218 132 W CA -1.881 55.489 57.345 0.041 0.000 1.837 132 W CB -1.732 27.760 29.460 0.053 0.000 1.067 132 W HN -0.695 7.292 8.180 -0.058 0.159 0.701 133 G N -3.438 105.476 108.800 0.190 0.000 2.175 133 G HA2 -0.352 3.656 3.960 0.079 0.000 0.244 133 G HA3 -0.352 3.691 3.960 0.137 0.000 0.244 133 G C 0.033 174.973 174.900 0.066 0.000 0.982 133 G CA -0.141 45.029 45.100 0.116 0.000 0.641 133 G HN -0.795 7.497 8.290 0.128 0.076 0.527 134 E N 2.040 122.267 120.200 0.046 0.000 2.338 134 E HA 0.314 4.652 4.350 -0.020 0.000 0.272 134 E C -1.729 174.777 176.600 -0.157 0.000 1.029 134 E CA -2.399 53.976 56.400 -0.041 0.000 0.872 134 E CB 0.099 29.775 29.700 -0.041 0.000 1.015 134 E HN -0.606 7.793 8.360 0.066 0.000 0.417 135 P HA 0.031 4.335 4.420 -0.195 0.000 0.269 135 P C 0.394 177.410 177.300 -0.472 0.000 1.209 135 P CA -0.030 62.850 63.100 -0.367 0.000 0.776 135 P CB 0.644 32.017 31.700 -0.546 0.000 0.876 136 Q N 2.313 121.953 119.800 -0.268 0.000 2.291 136 Q HA -0.305 3.897 4.340 -0.230 0.000 0.206 136 Q C 1.955 177.841 176.000 -0.190 0.000 0.976 136 Q CA 4.064 59.739 55.803 -0.212 0.000 0.875 136 Q CB -0.104 28.553 28.738 -0.136 0.000 0.927 136 Q HN 0.770 8.938 8.270 -0.171 0.000 0.450 137 W N -6.411 114.825 121.300 -0.107 0.000 2.525 137 W HA -0.122 4.427 4.660 -0.185 0.000 0.259 137 W C -0.542 175.961 176.519 -0.027 0.000 1.253 137 W CA -0.020 57.248 57.345 -0.129 0.000 1.262 137 W CB -0.958 28.404 29.460 -0.164 0.000 1.122 137 W HN -0.276 7.765 8.180 -0.189 0.026 0.607 138 A N -0.613 121.863 122.820 -0.573 0.000 2.460 138 A HA 0.283 4.635 4.320 0.054 0.000 0.258 138 A C -0.436 177.103 177.584 -0.074 0.000 1.300 138 A CA -0.604 51.273 52.037 -0.267 0.000 0.913 138 A CB 1.126 19.836 19.000 -0.483 0.000 1.031 138 A HN -0.374 7.086 8.150 -0.903 0.149 0.512 139 V N -2.992 116.832 119.914 -0.149 0.000 3.177 139 V HA 0.077 4.051 4.120 -0.243 0.000 0.220 139 V C -1.455 174.578 176.094 -0.101 0.000 1.395 139 V CA 1.105 63.290 62.300 -0.192 0.000 1.317 139 V CB 3.547 35.218 31.823 -0.253 0.000 1.148 139 V HN -0.334 7.616 8.190 -0.142 0.155 0.499 140 V N -6.387 113.460 119.914 -0.112 0.000 3.177 140 V HA 0.351 4.377 4.120 -0.157 0.000 0.319 140 V C -0.632 175.470 176.094 0.014 0.000 1.125 140 V CA -2.204 60.030 62.300 -0.110 0.000 1.029 140 V CB 2.518 34.218 31.823 -0.205 0.000 1.119 140 V HN -0.159 7.953 8.190 -0.129 0.000 0.452 141 G N -2.388 106.469 108.800 0.094 0.000 2.612 141 G HA2 -0.313 3.755 3.960 0.180 0.000 0.686 141 G HA3 -0.313 3.636 3.960 -0.018 0.000 0.686 141 G C -1.638 173.510 174.900 0.412 0.000 1.274 141 G CA -0.906 44.294 45.100 0.166 0.000 0.849 141 G HN -0.177 8.181 8.290 0.114 0.000 0.595 142 D N 2.276 123.043 120.400 0.612 0.000 2.449 142 D HA 0.005 5.129 4.640 0.515 -0.175 0.236 142 D C 0.756 177.370 176.300 0.522 0.000 1.149 142 D CA 1.377 55.694 54.000 0.529 0.000 0.878 142 D CB 0.527 41.544 40.800 0.362 0.000 1.198 142 D HN -0.014 8.857 8.370 0.836 0.000 0.446 143 T N -3.484 111.319 114.554 0.416 0.000 2.952 143 T HA 0.646 5.185 4.350 0.316 0.000 0.286 143 T C -0.705 174.185 174.700 0.316 0.000 1.024 143 T CA -1.843 60.414 62.100 0.261 0.000 1.029 143 T CB 2.885 71.727 68.868 -0.044 0.000 1.094 143 T HN -0.213 8.281 8.240 0.423 0.000 0.515 144 F N -4.973 114.926 119.950 -0.086 0.000 2.678 144 F HA 0.512 4.830 4.527 -0.348 0.000 0.308 144 F C -3.459 172.146 175.800 -0.325 0.000 1.118 144 F CA -2.378 55.506 58.000 -0.193 0.000 0.959 144 F CB 0.283 39.366 39.000 0.138 0.000 1.305 144 F HN -0.176 7.936 8.300 -0.313 0.000 0.443 145 P HA 0.151 4.415 4.420 -0.485 -0.135 0.276 145 P C -0.195 177.009 177.300 -0.160 0.000 1.243 145 P CA -0.531 62.315 63.100 -0.423 0.000 0.768 145 P CB -0.060 31.390 31.700 -0.416 0.000 0.856 146 V N 0.109 119.904 119.914 -0.197 0.000 3.083 146 V HA -0.029 4.149 4.120 0.098 0.000 0.306 146 V C 0.349 176.475 176.094 0.053 0.000 1.077 146 V CA -1.085 61.198 62.300 -0.028 0.000 1.073 146 V CB 0.977 32.752 31.823 -0.080 0.000 1.081 146 V HN -0.238 7.796 8.190 -0.260 0.000 0.474 147 G N -0.346 108.393 108.800 -0.103 0.000 2.157 147 G HA2 -0.325 3.226 3.960 -0.682 0.000 0.248 147 G HA3 -0.325 3.467 3.960 -0.280 0.000 0.248 147 G C -0.972 174.014 174.900 0.144 0.000 0.979 147 G CA 0.719 45.681 45.100 -0.229 0.000 0.650 147 G HN 0.739 8.949 8.290 -0.134 0.000 0.529 148 C N -3.682 115.764 119.300 0.242 0.000 3.311 148 C HA 0.603 5.352 4.460 0.237 -0.147 0.325 148 C C -1.784 173.327 174.990 0.202 0.000 1.352 148 C CA -2.269 56.910 59.018 0.268 0.000 1.308 148 C CB 3.184 31.154 27.740 0.383 0.000 1.619 148 C HN -0.850 7.464 8.230 0.226 0.051 0.469 149 R N 3.278 123.857 120.500 0.132 0.000 2.538 149 R HA 0.024 4.342 4.340 -0.036 0.000 0.282 149 R C -1.596 174.703 176.300 -0.000 0.000 1.009 149 R CA -0.048 56.062 56.100 0.016 0.000 1.063 149 R CB -0.120 30.176 30.300 -0.006 0.000 0.945 149 R HN -0.043 8.307 8.270 0.134 0.000 0.414 150 P HA 0.036 4.451 4.420 -0.009 0.000 0.267 150 P C -0.854 176.333 177.300 -0.189 0.000 1.205 150 P CA -0.250 62.679 63.100 -0.286 0.000 0.765 150 P CB 0.406 31.449 31.700 -1.094 0.000 0.828 151 Q N 3.759 123.476 119.800 -0.138 0.000 2.169 151 Q HA 0.096 4.308 4.340 -0.214 0.000 0.234 151 Q C 1.385 177.300 176.000 -0.143 0.000 0.980 151 Q CA -1.453 54.199 55.803 -0.252 0.000 0.941 151 Q CB 2.175 30.565 28.738 -0.580 0.000 1.199 151 Q HN -0.181 8.092 8.270 0.005 0.000 0.496 152 A N 1.127 123.872 122.820 -0.126 0.000 2.019 152 A HA -0.157 4.126 4.320 -0.063 0.000 0.219 152 A C 0.805 178.359 177.584 -0.049 0.000 1.164 152 A CA 2.166 54.160 52.037 -0.072 0.000 0.644 152 A CB -0.372 18.591 19.000 -0.061 0.000 0.805 152 A HN 0.670 8.733 8.150 -0.146 0.000 0.449 153 S N -3.704 111.972 115.700 -0.041 0.000 2.603 153 S HA -0.063 4.390 4.470 -0.028 0.000 0.220 153 S C 0.398 175.001 174.600 0.004 0.000 0.967 153 S CA 0.246 58.437 58.200 -0.013 0.000 0.920 153 S CB -0.145 63.059 63.200 0.006 0.000 0.773 153 S HN -0.463 8.051 8.310 -0.058 -0.239 0.529 154 V N 4.560 124.486 119.914 0.020 0.000 2.521 154 V HA -0.171 3.991 4.120 0.069 0.000 0.286 154 V C -0.257 175.762 176.094 -0.125 0.000 1.034 154 V CA 0.249 62.557 62.300 0.014 0.000 1.045 154 V CB 0.554 32.393 31.823 0.026 0.000 0.974 154 V HN -0.787 7.352 8.190 0.013 0.059 0.480 155 V N 8.531 128.272 119.914 -0.288 0.000 2.506 155 V HA -0.255 3.429 4.120 -0.727 0.000 0.296 155 V C -0.152 175.741 176.094 -0.335 0.000 1.004 155 V CA 1.853 63.761 62.300 -0.654 0.000 1.150 155 V CB -0.049 31.037 31.823 -1.227 0.000 0.911 155 V HN 0.293 8.323 8.190 -0.267 0.000 0.476 156 F N 0.444 120.333 119.950 -0.102 0.000 2.999 156 F HA -0.294 4.276 4.527 0.072 0.000 0.291 156 F C 0.873 176.706 175.800 0.055 0.000 0.824 156 F CA 0.097 58.119 58.000 0.037 0.000 1.255 156 F CB -2.891 36.178 39.000 0.114 0.000 1.333 156 F HN 0.036 8.055 8.300 -0.469 0.000 0.502 157 C N 1.072 120.462 119.300 0.150 0.000 2.413 157 C HA -0.424 4.222 4.460 0.310 0.000 0.277 157 C C 1.424 176.545 174.990 0.219 0.000 1.265 157 C CA 3.168 62.300 59.018 0.190 0.000 1.752 157 C CB -0.890 26.880 27.740 0.050 0.000 1.998 157 C HN -0.261 8.007 8.230 0.064 0.000 0.489 158 D N -0.887 119.609 120.400 0.161 0.000 2.347 158 D HA -0.075 4.626 4.640 0.102 0.000 0.215 158 D C -0.217 176.171 176.300 0.146 0.000 0.976 158 D CA 1.694 55.770 54.000 0.127 0.000 0.884 158 D CB 0.222 41.079 40.800 0.096 0.000 0.915 158 D HN 0.289 8.729 8.370 0.157 0.024 0.526 159 S N -4.247 111.568 115.700 0.192 0.000 2.847 159 S HA 0.233 4.785 4.470 0.136 0.000 0.254 159 S C 0.000 174.683 174.600 0.137 0.000 1.039 159 S CA 0.067 58.374 58.200 0.178 0.000 1.113 159 S CB 1.644 64.981 63.200 0.229 0.000 1.092 159 S HN -0.491 7.901 8.310 0.230 0.055 0.620 160 T N -3.230 111.370 114.554 0.076 0.000 3.192 160 T HA 0.222 4.501 4.350 -0.119 0.000 0.295 160 T C -0.791 173.762 174.700 -0.246 0.000 0.947 160 T CA -0.249 61.786 62.100 -0.109 0.000 0.916 160 T CB 1.463 70.245 68.868 -0.144 0.000 1.169 160 T HN -0.592 7.722 8.240 0.123 0.000 0.540 161 F N 1.105 121.031 119.950 -0.040 0.000 2.706 161 F HA 0.119 4.602 4.527 -0.072 0.000 0.313 161 F C 0.962 176.729 175.800 -0.054 0.000 1.096 161 F CA 0.490 58.447 58.000 -0.072 0.000 1.219 161 F CB 0.681 39.610 39.000 -0.118 0.000 1.051 161 F HN -0.152 8.245 8.300 0.162 0.000 0.568 162 Q N -0.985 118.874 119.800 0.099 0.000 2.224 162 Q HA -0.240 4.144 4.340 0.074 0.000 0.203 162 Q C -0.057 175.954 176.000 0.017 0.000 0.970 162 Q CA 2.520 58.358 55.803 0.058 0.000 0.865 162 Q CB -1.048 27.712 28.738 0.037 0.000 0.922 162 Q HN 0.242 8.554 8.270 0.070 0.000 0.445 163 D N -1.733 118.648 120.400 -0.031 0.000 2.363 163 D HA 0.130 4.740 4.640 -0.050 0.000 0.214 163 D C -0.631 175.609 176.300 -0.101 0.000 1.093 163 D CA -0.033 53.919 54.000 -0.078 0.000 0.837 163 D CB 0.441 41.160 40.800 -0.136 0.000 0.948 163 D HN -0.171 8.141 8.370 -0.050 0.028 0.507 164 N N 2.003 120.685 118.700 -0.030 0.000 2.411 164 N HA 0.174 4.870 4.740 -0.073 0.000 0.259 164 N C -0.524 175.016 175.510 0.050 0.000 1.103 164 N CA -2.258 50.798 53.050 0.009 0.000 0.954 164 N CB 1.418 40.003 38.487 0.163 0.000 1.085 164 N HN -0.837 7.501 8.380 0.022 0.054 0.485 165 P HA -0.129 4.320 4.420 0.048 0.000 0.218 165 P C 1.073 178.443 177.300 0.116 0.000 1.149 165 P CA 1.822 64.960 63.100 0.064 0.000 0.817 165 P CB 0.301 32.037 31.700 0.061 0.000 0.785 166 D N -0.138 120.357 120.400 0.157 0.000 2.182 166 D HA -0.186 4.665 4.640 0.351 0.000 0.201 166 D C 2.750 179.188 176.300 0.230 0.000 0.986 166 D CA 2.952 57.105 54.000 0.256 0.000 0.847 166 D CB -0.460 40.457 40.800 0.195 0.000 0.942 166 D HN -0.135 8.565 8.370 0.140 -0.246 0.467 167 L N -3.165 118.147 121.223 0.147 0.000 2.291 167 L HA -0.190 4.213 4.340 0.105 0.000 0.214 167 L C 0.868 177.780 176.870 0.071 0.000 1.120 167 L CA 1.653 56.553 54.840 0.099 0.000 0.799 167 L CB -0.336 41.765 42.059 0.070 0.000 0.925 167 L HN -0.796 7.492 8.230 0.136 0.024 0.446 168 Q N -4.934 114.907 119.800 0.069 0.000 2.472 168 Q HA -0.048 4.311 4.340 0.031 0.000 0.208 168 Q C -0.094 175.923 176.000 0.028 0.000 0.958 168 Q CA 0.170 55.998 55.803 0.041 0.000 0.932 168 Q CB 0.234 28.994 28.738 0.037 0.000 1.007 168 Q HN -0.738 7.456 8.270 0.081 0.125 0.508 169 D N 0.349 120.776 120.400 0.045 0.000 2.317 169 D HA 0.357 4.973 4.640 -0.039 0.000 0.234 169 D C -0.579 175.671 176.300 -0.083 0.000 1.112 169 D CA -3.090 50.896 54.000 -0.024 0.000 0.840 169 D CB 1.908 42.707 40.800 -0.001 0.000 1.078 169 D HN -0.668 7.561 8.370 0.087 0.193 0.486 170 P HA -0.004 4.383 4.420 -0.055 0.000 0.222 170 P C 0.723 177.932 177.300 -0.153 0.000 1.147 170 P CA 1.436 64.481 63.100 -0.092 0.000 0.790 170 P CB 0.555 32.209 31.700 -0.077 0.000 0.780 171 R N -3.509 116.800 120.500 -0.319 0.000 2.120 171 R HA -0.269 3.889 4.340 -0.304 0.000 0.234 171 R C 1.010 177.087 176.300 -0.371 0.000 1.123 171 R CA 2.812 58.623 56.100 -0.482 0.000 0.975 171 R CB 0.323 30.070 30.300 -0.921 0.000 0.866 171 R HN -0.489 7.804 8.270 -0.362 -0.239 0.446 172 Y N -6.867 113.426 120.300 -0.011 0.000 2.527 172 Y HA 0.358 5.043 4.550 -0.014 -0.143 0.247 172 Y C 0.928 176.838 175.900 0.017 0.000 1.138 172 Y CA -2.201 55.900 58.100 0.001 0.000 1.228 172 Y CB 0.922 39.393 38.460 0.019 0.000 1.252 172 Y HN -0.317 7.705 8.280 -0.203 0.136 0.531 173 S N -0.486 115.279 115.700 0.108 0.000 2.527 173 S HA -0.108 4.409 4.470 0.078 0.000 0.222 173 S C 0.388 175.016 174.600 0.046 0.000 0.985 173 S CA 1.714 59.954 58.200 0.067 0.000 0.921 173 S CB 0.253 63.472 63.200 0.032 0.000 0.772 173 S HN -0.518 7.823 8.310 0.050 0.000 0.529 174 T N -1.692 112.893 114.554 0.051 0.000 2.810 174 T HA 0.160 4.524 4.350 0.025 0.000 0.277 174 T C 0.824 175.561 174.700 0.062 0.000 0.973 174 T CA -2.075 60.048 62.100 0.040 0.000 0.949 174 T CB 2.519 71.405 68.868 0.030 0.000 1.075 174 T HN -0.761 7.472 8.240 0.057 0.041 0.537 175 E N 0.750 120.978 120.200 0.047 0.000 2.031 175 E HA -0.229 4.147 4.350 0.045 0.000 0.193 175 E C 0.659 177.324 176.600 0.109 0.000 0.994 175 E CA 2.883 59.315 56.400 0.053 0.000 0.800 175 E CB -0.287 29.427 29.700 0.022 0.000 0.752 175 E HN 0.504 8.883 8.360 0.032 0.000 0.447 176 L N -4.359 116.928 121.223 0.106 0.000 2.375 176 L HA -0.011 4.445 4.340 0.194 0.000 0.215 176 L C 0.798 177.797 176.870 0.216 0.000 1.108 176 L CA 0.016 54.952 54.840 0.161 0.000 0.830 176 L CB 0.161 42.281 42.059 0.102 0.000 0.959 176 L HN -0.330 7.946 8.230 0.077 0.000 0.457 177 G N -0.338 108.546 108.800 0.139 0.000 2.629 177 G HA2 -0.504 3.587 3.960 0.100 0.000 0.313 177 G HA3 -0.504 3.793 3.960 0.164 -0.238 0.313 177 G C 0.192 175.104 174.900 0.020 0.000 1.217 177 G CA 1.553 46.722 45.100 0.116 0.000 0.994 177 G HN -0.355 8.000 8.290 0.110 0.000 0.549 178 M N 1.647 121.170 119.600 -0.130 0.000 2.561 178 M HA -0.003 4.414 4.480 -0.106 0.000 0.238 178 M C -0.675 175.433 176.300 -0.322 0.000 1.131 178 M CA 1.167 56.325 55.300 -0.237 0.000 1.046 178 M CB 0.341 32.803 32.600 -0.231 0.000 1.532 178 M HN -0.512 7.655 8.290 -0.205 0.000 0.497 179 Y N -1.313 119.028 120.300 0.068 0.000 2.387 179 Y HA 0.132 4.705 4.550 0.038 0.000 0.330 179 Y C 0.259 176.172 175.900 0.022 0.000 1.133 179 Y CA -1.160 56.963 58.100 0.040 0.000 1.152 179 Y CB 1.039 39.518 38.460 0.032 0.000 1.215 179 Y HN -0.516 7.683 8.280 -0.013 0.073 0.466 180 Q N 1.848 121.756 119.800 0.180 0.000 2.306 180 Q HA 0.353 4.737 4.340 0.075 0.000 0.241 180 Q C -1.951 174.084 176.000 0.058 0.000 0.948 180 Q CA -2.161 53.699 55.803 0.096 0.000 0.886 180 Q CB -0.203 28.583 28.738 0.080 0.000 1.227 180 Q HN 0.069 8.456 8.270 0.195 0.000 0.457 181 P HA -0.034 4.388 4.420 -0.244 -0.148 0.267 181 P C -0.721 176.499 177.300 -0.134 0.000 1.205 181 P CA 0.500 63.485 63.100 -0.191 0.000 0.765 181 P CB 0.454 32.032 31.700 -0.203 0.000 0.828 182 H N -2.942 116.152 119.070 0.039 0.000 2.862 182 H HA -0.371 4.365 4.556 0.011 -0.173 0.290 182 H C 0.549 175.886 175.328 0.015 0.000 1.211 182 H CA 0.566 56.627 56.048 0.021 0.000 1.140 182 H CB -3.031 26.748 29.762 0.028 0.000 1.341 182 H HN 0.513 8.467 8.280 -0.367 0.106 0.392 183 C N -2.610 116.731 119.300 0.069 0.000 2.422 183 C HA -0.237 4.269 4.460 0.076 0.000 0.286 183 C C 0.574 175.583 174.990 0.032 0.000 1.412 183 C CA 0.131 59.185 59.018 0.060 0.000 1.786 183 C CB 0.591 28.373 27.740 0.071 0.000 1.835 183 C HN -0.586 7.640 8.230 0.030 0.023 0.533 184 G N 0.185 108.986 108.800 0.002 0.000 2.895 184 G HA2 -0.267 3.845 3.960 -0.038 0.000 0.686 184 G HA3 -0.267 3.691 3.960 -0.004 0.000 0.686 184 G C 0.260 175.091 174.900 -0.114 0.000 1.108 184 G CA -0.623 44.456 45.100 -0.034 0.000 0.761 184 G HN -0.461 7.781 8.290 0.006 0.052 0.611 185 L N 2.569 123.659 121.223 -0.222 0.000 2.275 185 L HA -0.297 3.830 4.340 -0.355 0.000 0.215 185 L C 1.679 178.487 176.870 -0.104 0.000 1.119 185 L CA 2.111 56.737 54.840 -0.356 0.000 0.790 185 L CB -0.318 41.197 42.059 -0.908 0.000 0.919 185 L HN 0.107 8.498 8.230 -0.239 -0.304 0.443 186 E N -3.267 116.936 120.200 0.005 0.000 2.347 186 E HA -0.275 4.141 4.350 0.109 0.000 0.196 186 E C 0.300 176.922 176.600 0.036 0.000 1.008 186 E CA 1.871 58.314 56.400 0.070 0.000 0.852 186 E CB -0.885 28.865 29.700 0.084 0.000 0.783 186 E HN 0.359 8.681 8.360 -0.008 0.034 0.505 187 N N -1.810 116.897 118.700 0.012 0.000 2.235 187 N HA 0.102 4.879 4.740 0.061 0.000 0.209 187 N C -0.804 174.730 175.510 0.040 0.000 1.122 187 N CA -0.037 53.037 53.050 0.041 0.000 0.845 187 N CB 0.844 39.365 38.487 0.058 0.000 1.004 187 N HN -0.499 7.725 8.380 -0.014 0.148 0.499 188 V N 0.800 120.673 119.914 -0.069 0.000 2.532 188 V HA 0.002 4.015 4.120 -0.178 0.000 0.295 188 V C -1.156 174.914 176.094 -0.039 0.000 1.041 188 V CA -0.753 61.429 62.300 -0.197 0.000 0.926 188 V CB 1.939 33.475 31.823 -0.478 0.000 0.992 188 V HN -0.620 7.356 8.190 -0.077 0.168 0.457 189 L N 7.372 128.657 121.223 0.103 0.000 2.295 189 L HA 0.100 4.466 4.340 0.043 0.000 0.288 189 L C -0.995 175.830 176.870 -0.074 0.000 1.079 189 L CA -0.762 54.115 54.840 0.060 0.000 0.830 189 L CB -0.144 41.981 42.059 0.110 0.000 1.200 189 L HN -0.201 8.217 8.230 0.313 0.000 0.438 190 M N 3.417 122.932 119.600 -0.142 0.000 2.288 190 M HA 0.073 4.300 4.480 -0.421 0.000 0.334 190 M C 0.496 176.665 176.300 -0.219 0.000 1.150 190 M CA -3.235 51.889 55.300 -0.293 0.000 1.118 190 M CB 0.557 32.964 32.600 -0.322 0.000 1.501 190 M HN 0.134 8.366 8.290 -0.096 0.000 0.462 191 S N 2.037 117.485 115.700 -0.421 0.000 2.558 191 S HA -0.318 4.133 4.470 -0.141 -0.065 0.293 191 S C -0.184 174.434 174.600 0.031 0.000 1.292 191 S CA 0.569 58.616 58.200 -0.256 0.000 1.063 191 S CB 0.168 63.058 63.200 -0.516 0.000 0.831 191 S HN 0.225 8.145 8.310 -0.650 0.000 0.499 192 W N 6.338 127.689 121.300 0.086 0.000 2.253 192 W HA -0.167 4.513 4.660 0.033 0.000 0.322 192 W C -1.209 175.364 176.519 0.090 0.000 1.342 192 W CA 1.593 59.002 57.345 0.107 0.000 1.218 192 W CB 1.239 30.820 29.460 0.201 0.000 1.205 192 W HN -0.207 8.523 8.180 0.526 -0.234 0.551 193 G N 3.354 111.546 108.800 -1.013 0.000 2.490 193 G HA2 -0.010 3.699 3.960 -0.661 0.000 0.308 193 G HA3 -0.010 3.749 3.960 -0.335 0.000 0.308 193 G C -0.478 173.969 174.900 -0.755 0.000 1.286 193 G CA 0.081 44.753 45.100 -0.712 0.000 0.825 193 G HN -0.481 6.994 8.290 -1.358 0.000 0.479 194 H N -1.496 117.307 119.070 -0.446 0.000 2.456 194 H HA -0.240 4.128 4.556 -0.313 0.000 0.296 194 H C 1.281 176.530 175.328 -0.132 0.000 1.079 194 H CA 2.906 58.795 56.048 -0.266 0.000 1.322 194 H CB -0.412 29.267 29.762 -0.139 0.000 1.388 194 H HN 0.101 8.492 8.280 0.186 0.000 0.538 195 D N 1.029 121.012 120.400 -0.694 0.000 2.077 195 D HA -0.337 4.119 4.640 -0.306 0.000 0.193 195 D C 2.479 178.590 176.300 -0.314 0.000 0.989 195 D CA 4.240 57.955 54.000 -0.474 0.000 0.831 195 D CB -0.600 39.864 40.800 -0.559 0.000 0.979 195 D HN 0.208 8.003 8.370 -0.914 0.027 0.449 196 E N -0.439 119.523 120.200 -0.397 0.000 2.106 196 E HA -0.247 3.993 4.350 -0.183 0.000 0.192 196 E C 1.799 178.337 176.600 -0.104 0.000 0.984 196 E CA 2.503 58.756 56.400 -0.244 0.000 0.806 196 E CB -0.370 29.199 29.700 -0.219 0.000 0.750 196 E HN -0.206 7.857 8.360 -0.496 0.000 0.458 197 Y N 0.531 120.569 120.300 -0.435 0.000 2.097 197 Y HA -0.402 4.254 4.550 0.177 0.000 0.282 197 Y C 1.618 177.549 175.900 0.053 0.000 1.152 197 Y CA 3.716 61.753 58.100 -0.104 0.000 1.136 197 Y CB 0.113 38.418 38.460 -0.258 0.000 0.975 197 Y HN -0.608 7.366 8.280 -0.510 0.000 0.498 198 L N -1.820 119.415 121.223 0.020 0.000 2.083 198 L HA -0.409 3.781 4.340 -0.250 0.000 0.209 198 L C 1.315 178.013 176.870 -0.286 0.000 1.083 198 L CA 2.818 57.579 54.840 -0.133 0.000 0.752 198 L CB -0.553 41.517 42.059 0.019 0.000 0.899 198 L HN -0.244 8.056 8.230 0.117 0.000 0.433 199 Y N -0.694 119.448 120.300 -0.263 0.000 2.128 199 Y HA -0.539 3.864 4.550 -0.245 0.000 0.284 199 Y C 1.334 177.130 175.900 -0.174 0.000 1.154 199 Y CA 3.666 61.630 58.100 -0.225 0.000 1.149 199 Y CB -0.233 38.094 38.460 -0.223 0.000 0.976 199 Y HN -0.242 8.040 8.280 0.003 0.000 0.505 200 Q N -2.937 116.715 119.800 -0.247 0.000 2.119 200 Q HA -0.384 3.729 4.340 -0.379 0.000 0.201 200 Q C 2.478 178.188 176.000 -0.484 0.000 0.972 200 Q CA 2.268 57.950 55.803 -0.202 0.000 0.847 200 Q CB -0.506 28.395 28.738 0.272 0.000 0.903 200 Q HN -0.438 7.829 8.270 -0.004 0.000 0.433 201 M N 1.469 120.543 119.600 -0.878 0.000 2.065 201 M HA -0.405 2.350 4.480 -2.875 0.000 0.259 201 M C 1.962 177.647 176.300 -1.024 0.000 1.069 201 M CA 3.299 57.616 55.300 -1.638 0.000 1.110 201 M CB -0.259 31.508 32.600 -1.388 0.000 1.328 201 M HN -0.093 7.803 8.290 -0.657 0.000 0.405 202 M N -2.041 116.989 119.600 -0.951 0.000 2.213 202 M HA -0.465 3.076 4.480 -1.566 0.000 0.263 202 M C 2.122 178.235 176.300 -0.311 0.000 1.062 202 M CA 3.947 58.597 55.300 -1.083 0.000 1.105 202 M CB -0.387 31.373 32.600 -1.400 0.000 1.385 202 M HN -0.285 7.470 8.290 -0.891 0.000 0.417 203 K N -0.905 119.351 120.400 -0.240 0.000 2.026 203 K HA -0.280 3.992 4.320 -0.079 0.000 0.208 203 K C 2.457 178.987 176.600 -0.117 0.000 1.048 203 K CA 2.960 59.148 56.287 -0.165 0.000 0.929 203 K CB -0.351 31.942 32.500 -0.345 0.000 0.713 203 K HN -0.714 7.287 8.250 -0.414 0.000 0.439 204 F N 0.152 119.916 119.950 -0.309 0.000 2.134 204 F HA -0.363 4.090 4.527 -0.124 0.000 0.299 204 F C 0.982 176.682 175.800 -0.167 0.000 1.097 204 F CA 3.125 60.992 58.000 -0.221 0.000 1.264 204 F CB 0.476 39.296 39.000 -0.300 0.000 1.001 204 F HN -0.300 7.909 8.300 -0.153 0.000 0.479 205 N N -3.700 114.982 118.700 -0.030 0.000 2.467 205 N HA -0.116 4.604 4.740 -0.034 0.000 0.184 205 N C -0.337 175.223 175.510 0.083 0.000 1.106 205 N CA 1.017 54.086 53.050 0.031 0.000 0.892 205 N CB 0.575 39.151 38.487 0.150 0.000 0.969 205 N HN -0.528 7.801 8.380 -0.086 0.000 0.454 206 K N -4.650 115.802 120.400 0.087 0.000 3.162 206 K HA -0.393 3.989 4.320 0.102 0.000 0.268 206 K C -0.350 176.409 176.600 0.265 0.000 1.062 206 K CA 0.533 56.889 56.287 0.115 0.000 0.769 206 K CB -3.106 29.390 32.500 -0.006 0.000 1.274 206 K HN -0.616 7.485 8.250 0.035 0.169 0.478 207 F N -0.633 119.350 119.950 0.055 0.000 2.629 207 F HA -0.224 4.442 4.527 0.023 -0.125 0.369 207 F C 1.383 177.288 175.800 0.174 0.000 1.125 207 F CA 0.289 58.323 58.000 0.057 0.000 1.330 207 F CB 0.252 39.183 39.000 -0.115 0.000 1.071 207 F HN -0.593 8.145 8.300 0.730 0.000 0.595 208 S N 2.143 118.010 115.700 0.278 0.000 2.519 208 S HA 0.074 4.676 4.470 0.220 0.000 0.245 208 S C -0.168 174.629 174.600 0.328 0.000 1.152 208 S CA -0.321 58.031 58.200 0.253 0.000 1.175 208 S CB 0.504 63.789 63.200 0.142 0.000 0.829 208 S HN 0.152 8.585 8.310 0.206 0.000 0.472 209 L N 1.414 122.805 121.223 0.280 0.000 2.416 209 L HA 0.246 4.519 4.340 -0.111 0.000 0.262 209 L C -1.922 174.952 176.870 0.006 0.000 1.093 209 L CA -2.350 52.501 54.840 0.018 0.000 0.801 209 L CB 0.244 42.222 42.059 -0.135 0.000 1.191 209 L HN -0.552 7.825 8.230 0.368 0.074 0.459 210 P HA 0.079 4.316 4.420 -0.305 0.000 0.270 210 P C -0.196 176.972 177.300 -0.220 0.000 1.223 210 P CA -0.541 62.293 63.100 -0.444 0.000 0.785 210 P CB 0.674 31.779 31.700 -0.991 0.000 0.923 211 S N 2.200 117.787 115.700 -0.188 0.000 2.392 211 S HA -0.487 3.966 4.470 -0.028 0.000 0.232 211 S C 1.992 176.561 174.600 -0.053 0.000 1.041 211 S CA 3.833 61.981 58.200 -0.086 0.000 1.026 211 S CB -0.199 62.921 63.200 -0.134 0.000 0.845 211 S HN 0.423 8.598 8.310 -0.225 0.000 0.465 212 E N 0.658 120.664 120.200 -0.322 0.000 2.118 212 E HA -0.252 3.933 4.350 -0.275 0.000 0.195 212 E C 1.997 178.495 176.600 -0.170 0.000 0.992 212 E CA 3.426 59.582 56.400 -0.407 0.000 0.804 212 E CB -0.485 28.612 29.700 -1.004 0.000 0.741 212 E HN 0.302 8.361 8.360 -0.468 0.021 0.458 213 A N -0.364 122.331 122.820 -0.209 0.000 1.877 213 A HA -0.236 4.148 4.320 0.107 0.000 0.216 213 A C 1.800 179.393 177.584 0.014 0.000 1.186 213 A CA 2.888 54.912 52.037 -0.022 0.000 0.620 213 A CB -0.687 18.257 19.000 -0.093 0.000 0.822 213 A HN -0.466 7.437 8.150 -0.394 0.010 0.443 214 F N -1.821 118.120 119.950 -0.014 0.000 2.126 214 F HA -0.387 4.170 4.527 0.050 0.000 0.299 214 F C 2.171 178.036 175.800 0.108 0.000 1.096 214 F CA 4.213 62.263 58.000 0.083 0.000 1.255 214 F CB -0.289 38.800 39.000 0.148 0.000 0.997 214 F HN -0.820 7.725 8.300 0.409 0.000 0.479 215 Y N -0.490 119.926 120.300 0.194 0.000 2.200 215 Y HA -0.510 4.080 4.550 0.067 0.000 0.290 215 Y C 1.656 177.655 175.900 0.166 0.000 1.137 215 Y CA 3.995 62.180 58.100 0.142 0.000 1.163 215 Y CB 0.281 38.841 38.460 0.168 0.000 0.988 215 Y HN -0.550 7.974 8.280 0.421 0.009 0.518 216 M N -1.708 118.082 119.600 0.318 0.000 2.117 216 M HA -0.603 4.114 4.480 0.395 0.000 0.262 216 M C 2.120 178.441 176.300 0.036 0.000 1.065 216 M CA 4.603 60.034 55.300 0.217 0.000 1.114 216 M CB 0.194 32.847 32.600 0.089 0.000 1.361 216 M HN -0.509 7.952 8.290 0.285 0.000 0.408 217 I N -2.248 118.285 120.570 -0.061 0.000 2.252 217 I HA -0.428 3.722 4.170 -0.034 0.000 0.245 217 I C 2.991 179.123 176.117 0.024 0.000 1.102 217 I CA 3.554 64.839 61.300 -0.026 0.000 1.385 217 I CB -0.085 37.857 38.000 -0.096 0.000 1.064 217 I HN -0.550 7.630 8.210 -0.050 0.000 0.414 218 R N -0.121 120.230 120.500 -0.248 0.000 2.148 218 R HA -0.280 3.754 4.340 -0.511 0.000 0.227 218 R C 0.425 176.173 176.300 -0.920 0.000 1.103 218 R CA 2.792 58.466 56.100 -0.710 0.000 0.983 218 R CB 0.358 29.864 30.300 -1.324 0.000 0.874 218 R HN -0.541 7.592 8.270 -0.228 0.000 0.451 219 F N -7.268 112.607 119.950 -0.125 0.000 2.772 219 F HA 0.311 4.815 4.527 -0.038 0.000 0.316 219 F C 0.460 176.427 175.800 0.278 0.000 1.114 219 F CA -1.852 56.164 58.000 0.027 0.000 1.191 219 F CB 0.782 39.785 39.000 0.004 0.000 1.065 219 F HN -0.741 7.459 8.300 -0.115 0.031 0.534 220 H N 0.232 119.486 119.070 0.307 0.000 2.491 220 H HA -0.146 4.622 4.556 0.352 0.000 0.290 220 H C 0.398 176.021 175.328 0.491 0.000 1.050 220 H CA 3.150 59.418 56.048 0.367 0.000 1.309 220 H CB -0.311 29.651 29.762 0.332 0.000 1.392 220 H HN -0.677 7.765 8.280 0.271 0.000 0.554 221 S N -1.254 114.384 115.700 -0.104 0.000 2.558 221 S HA 0.000 4.733 4.470 0.438 0.000 0.217 221 S C -0.577 174.336 174.600 0.522 0.000 0.975 221 S CA 0.846 59.169 58.200 0.206 0.000 0.912 221 S CB 0.793 63.953 63.200 -0.066 0.000 0.776 221 S HN -0.388 7.994 8.310 -0.333 -0.272 0.526 222 F N 5.021 125.152 119.950 0.301 0.000 2.669 222 F HA 0.205 4.867 4.527 0.225 0.000 0.353 222 F C -0.791 174.958 175.800 -0.085 0.000 1.192 222 F CA -3.524 54.613 58.000 0.228 0.000 1.317 222 F CB -2.232 36.955 39.000 0.312 0.000 1.652 222 F HN -0.440 8.088 8.300 0.657 0.166 0.608 223 Y N 4.419 124.710 120.300 -0.015 0.000 2.145 223 Y HA -0.216 3.637 4.550 -1.161 0.000 0.286 223 Y C -0.766 174.963 175.900 -0.284 0.000 1.145 223 Y CA 5.758 63.615 58.100 -0.404 0.000 1.148 223 Y CB -2.994 35.471 38.460 0.009 0.000 0.981 223 Y HN -0.214 8.383 8.280 0.598 0.042 0.507 224 P HA -0.308 4.186 4.420 0.123 0.000 0.217 224 P C 0.777 178.051 177.300 -0.043 0.000 1.151 224 P CA 2.920 66.111 63.100 0.152 0.000 0.849 224 P CB -0.497 31.500 31.700 0.494 0.000 0.787 225 W N -1.498 119.397 121.300 -0.675 0.000 2.519 225 W HA -0.039 4.526 4.660 -0.466 -0.185 0.313 225 W C 1.298 177.585 176.519 -0.386 0.000 1.156 225 W CA 2.920 59.818 57.345 -0.745 0.000 1.394 225 W CB 0.030 28.542 29.460 -1.581 0.000 1.154 225 W HN -0.531 7.252 8.180 -0.643 0.011 0.498 226 H N -6.252 112.513 119.070 -0.509 0.000 2.547 226 H HA 0.056 3.934 4.556 -1.129 0.000 0.272 226 H C 1.440 176.540 175.328 -0.379 0.000 0.989 226 H CA 1.832 57.469 56.048 -0.685 0.000 1.214 226 H CB -0.180 29.328 29.762 -0.425 0.000 1.389 226 H HN -0.471 7.416 8.280 -0.654 0.000 0.577 227 T N -0.789 113.645 114.554 -0.199 0.000 3.176 227 T HA 0.097 4.453 4.350 0.011 0.000 0.259 227 T C 1.209 175.888 174.700 -0.034 0.000 0.978 227 T CA 1.466 63.560 62.100 -0.011 0.000 1.050 227 T CB 1.615 70.577 68.868 0.158 0.000 1.136 227 T HN -0.178 7.800 8.240 -0.366 0.043 0.465 228 G N -0.889 107.885 108.800 -0.043 0.000 2.598 228 G HA2 -0.093 3.871 3.960 0.008 0.000 0.215 228 G HA3 -0.093 3.903 3.960 0.005 -0.033 0.215 228 G C 0.340 175.213 174.900 -0.044 0.000 1.131 228 G CA 0.335 45.426 45.100 -0.014 0.000 0.785 228 G HN -0.197 8.049 8.290 -0.072 0.000 0.539 229 G N -0.307 108.440 108.800 -0.089 0.000 2.159 229 G HA2 -0.445 3.446 3.960 -0.116 0.000 0.256 229 G HA3 -0.445 3.478 3.960 -0.062 0.000 0.256 229 G C -0.613 174.265 174.900 -0.037 0.000 0.977 229 G CA -0.138 44.914 45.100 -0.080 0.000 0.652 229 G HN -0.495 7.670 8.290 -0.137 0.042 0.531 230 D N 0.233 120.622 120.400 -0.019 0.000 2.432 230 D HA 0.187 4.779 4.640 -0.080 0.000 0.258 230 D C 0.122 176.502 176.300 0.133 0.000 1.146 230 D CA -0.435 53.537 54.000 -0.047 0.000 1.015 230 D CB 1.408 42.088 40.800 -0.199 0.000 1.107 230 D HN -0.457 7.859 8.370 -0.018 0.043 0.529 231 Y N -6.534 113.823 120.300 0.095 0.000 4.490 231 Y HA -0.458 4.264 4.550 0.086 -0.120 0.233 231 Y C 1.128 177.090 175.900 0.104 0.000 1.101 231 Y CA 1.464 59.628 58.100 0.107 0.000 2.010 231 Y CB -2.663 35.900 38.460 0.170 0.000 1.622 231 Y HN 0.155 8.549 8.280 -0.263 -0.271 0.675 232 R N -1.717 118.914 120.500 0.219 0.000 2.285 232 R HA -0.280 4.229 4.340 0.282 0.000 0.213 232 R C 1.011 177.429 176.300 0.197 0.000 1.068 232 R CA 1.867 58.104 56.100 0.227 0.000 1.004 232 R CB -0.692 29.718 30.300 0.183 0.000 0.873 232 R HN 0.438 8.765 8.270 0.156 0.037 0.467 233 Q N -2.623 117.234 119.800 0.095 0.000 2.364 233 Q HA -0.140 4.108 4.340 -0.153 0.000 0.207 233 Q C 0.941 176.844 176.000 -0.162 0.000 0.970 233 Q CA 2.734 58.493 55.803 -0.074 0.000 0.888 233 Q CB -0.616 28.093 28.738 -0.047 0.000 0.951 233 Q HN 0.385 8.666 8.270 0.095 0.046 0.469 234 L N -3.088 118.132 121.223 -0.004 0.000 2.609 234 L HA 0.135 4.420 4.340 -0.092 0.000 0.230 234 L C -0.942 175.920 176.870 -0.014 0.000 1.087 234 L CA -0.247 54.558 54.840 -0.058 0.000 0.874 234 L CB 0.940 42.924 42.059 -0.124 0.000 1.114 234 L HN -0.554 7.672 8.230 0.072 0.047 0.488 235 C N -1.577 117.773 119.300 0.084 0.000 2.601 235 C HA 0.069 4.640 4.460 -0.068 -0.151 0.409 235 C C 0.455 175.542 174.990 0.161 0.000 1.293 235 C CA 1.048 60.106 59.018 0.068 0.000 2.101 235 C CB 1.178 29.010 27.740 0.153 0.000 2.639 235 C HN -0.760 7.441 8.230 0.142 0.115 0.592 236 S N 4.220 119.962 115.700 0.070 0.000 2.707 236 S HA 0.199 4.708 4.470 0.064 0.000 0.276 236 S C 0.813 175.436 174.600 0.038 0.000 1.179 236 S CA -1.567 56.667 58.200 0.056 0.000 0.992 236 S CB 2.352 65.575 63.200 0.038 0.000 1.030 236 S HN 0.089 8.738 8.310 0.021 -0.327 0.554 237 Q N 1.197 121.000 119.800 0.005 0.000 2.167 237 Q HA -0.367 3.981 4.340 0.013 0.000 0.202 237 Q C 2.138 178.150 176.000 0.020 0.000 0.970 237 Q CA 3.825 59.632 55.803 0.006 0.000 0.855 237 Q CB -0.584 28.145 28.738 -0.014 0.000 0.911 237 Q HN 0.635 8.901 8.270 -0.007 0.000 0.438 238 Q N -1.320 118.487 119.800 0.011 0.000 2.096 238 Q HA -0.285 4.044 4.340 -0.018 0.000 0.204 238 Q C 1.788 177.775 176.000 -0.022 0.000 0.982 238 Q CA 3.076 58.873 55.803 -0.011 0.000 0.850 238 Q CB -1.033 27.699 28.738 -0.010 0.000 0.901 238 Q HN 0.202 8.468 8.270 0.011 0.010 0.422 239 D N -0.711 119.710 120.400 0.036 0.000 2.117 239 D HA -0.251 4.427 4.640 0.063 0.000 0.198 239 D C 2.229 178.716 176.300 0.312 0.000 0.982 239 D CA 2.816 56.891 54.000 0.124 0.000 0.828 239 D CB -0.228 40.596 40.800 0.039 0.000 0.967 239 D HN -0.706 7.597 8.370 0.041 0.091 0.464 240 L N -1.419 119.944 121.223 0.233 0.000 2.046 240 L HA -0.313 4.186 4.340 0.265 0.000 0.208 240 L C 2.344 179.283 176.870 0.116 0.000 1.077 240 L CA 3.031 57.989 54.840 0.197 0.000 0.747 240 L CB -0.658 41.469 42.059 0.114 0.000 0.896 240 L HN -0.697 7.633 8.230 0.167 0.000 0.432 241 D N -1.450 118.993 120.400 0.073 0.000 2.218 241 D HA -0.206 4.463 4.640 0.048 0.000 0.204 241 D C 1.398 177.747 176.300 0.083 0.000 0.976 241 D CA 2.679 56.711 54.000 0.053 0.000 0.853 241 D CB -0.429 40.388 40.800 0.028 0.000 0.939 241 D HN -0.282 8.124 8.370 0.061 0.000 0.481 242 M N -2.733 116.904 119.600 0.061 0.000 2.514 242 M HA 0.062 4.641 4.480 0.165 0.000 0.258 242 M C 1.363 177.807 176.300 0.241 0.000 1.119 242 M CA -0.896 54.453 55.300 0.081 0.000 1.111 242 M CB 0.253 32.602 32.600 -0.417 0.000 1.390 242 M HN -0.690 7.485 8.290 0.048 0.144 0.475 243 L N 1.128 122.452 121.223 0.169 0.000 2.021 243 L HA -0.266 4.000 4.340 -0.124 0.000 0.215 243 L C -1.584 175.279 176.870 -0.012 0.000 1.074 243 L CA 6.032 60.853 54.840 -0.032 0.000 0.760 243 L CB -2.677 39.274 42.059 -0.180 0.000 0.889 243 L HN -0.622 7.549 8.230 0.162 0.157 0.433 244 P HA -0.175 4.194 4.420 -0.084 0.000 0.217 244 P C 1.755 179.028 177.300 -0.044 0.000 1.150 244 P CA 2.874 65.929 63.100 -0.074 0.000 0.832 244 P CB -0.526 31.083 31.700 -0.151 0.000 0.787 245 W N -2.944 118.385 121.300 0.048 0.000 2.358 245 W HA -0.324 4.364 4.660 0.048 0.000 0.303 245 W C 2.219 178.841 176.519 0.171 0.000 1.208 245 W CA 4.199 61.590 57.345 0.077 0.000 1.274 245 W CB -0.220 29.276 29.460 0.060 0.000 1.138 245 W HN -0.766 7.560 8.180 0.243 0.000 0.515 246 V N -1.281 118.888 119.914 0.425 0.000 2.427 246 V HA -0.692 3.695 4.120 0.444 0.000 0.248 246 V C 2.219 178.400 176.094 0.145 0.000 1.051 246 V CA 4.492 67.002 62.300 0.350 0.000 1.048 246 V CB -0.385 31.660 31.823 0.371 0.000 0.666 246 V HN -0.481 7.949 8.190 0.401 0.000 0.456 247 Q N -1.417 118.403 119.800 0.034 0.000 2.123 247 Q HA -0.374 3.860 4.340 -0.176 0.000 0.199 247 Q C 2.245 178.252 176.000 0.011 0.000 0.966 247 Q CA 3.357 59.120 55.803 -0.066 0.000 0.845 247 Q CB -0.165 28.524 28.738 -0.082 0.000 0.907 247 Q HN -0.119 8.179 8.270 0.046 0.000 0.439 248 E N 0.459 120.732 120.200 0.122 0.000 2.072 248 E HA -0.264 4.140 4.350 0.091 0.000 0.191 248 E C 1.986 178.845 176.600 0.432 0.000 0.985 248 E CA 2.381 58.910 56.400 0.215 0.000 0.801 248 E CB -0.370 29.464 29.700 0.223 0.000 0.750 248 E HN -0.442 7.998 8.360 0.133 0.000 0.452 249 F N -0.267 119.947 119.950 0.441 0.000 2.171 249 F HA -0.335 4.551 4.527 0.598 0.000 0.300 249 F C 1.378 177.279 175.800 0.169 0.000 1.090 249 F CA 3.122 61.390 58.000 0.446 0.000 1.293 249 F CB 0.310 39.559 39.000 0.415 0.000 1.013 249 F HN -0.468 8.238 8.300 0.676 0.000 0.486 250 N N -0.958 117.722 118.700 -0.034 0.000 2.166 250 N HA -0.412 4.153 4.740 -0.291 0.000 0.186 250 N C 1.643 176.938 175.510 -0.359 0.000 1.019 250 N CA 3.418 56.308 53.050 -0.266 0.000 0.856 250 N CB -0.101 38.171 38.487 -0.359 0.000 0.993 250 N HN -0.247 8.097 8.380 0.110 0.102 0.426 251 K N -1.148 119.062 120.400 -0.316 0.000 2.211 251 K HA -0.255 3.805 4.320 -0.435 0.000 0.203 251 K C 2.283 178.637 176.600 -0.410 0.000 1.050 251 K CA 2.888 58.962 56.287 -0.354 0.000 0.945 251 K CB -0.611 31.747 32.500 -0.236 0.000 0.732 251 K HN -0.539 7.567 8.250 -0.240 0.000 0.451 252 F N -0.607 119.196 119.950 -0.245 0.000 2.293 252 F HA -0.192 4.250 4.527 -0.141 0.000 0.297 252 F C 1.638 177.210 175.800 -0.381 0.000 1.089 252 F CA 2.867 60.706 58.000 -0.268 0.000 1.377 252 F CB -0.389 38.423 39.000 -0.314 0.000 1.051 252 F HN -0.736 7.351 8.300 -0.355 0.000 0.511 253 D N -0.581 119.548 120.400 -0.451 0.000 2.117 253 D HA -0.296 4.097 4.640 -0.410 0.000 0.197 253 D C 1.715 177.971 176.300 -0.074 0.000 0.987 253 D CA 2.790 56.542 54.000 -0.414 0.000 0.829 253 D CB 0.220 40.653 40.800 -0.611 0.000 0.961 253 D HN -0.530 7.391 8.370 -0.597 0.091 0.460 254 L N -1.807 119.257 121.223 -0.265 0.000 2.084 254 L HA -0.155 4.120 4.340 -0.108 0.000 0.202 254 L C 1.513 178.099 176.870 -0.474 0.000 1.074 254 L CA 2.724 57.348 54.840 -0.361 0.000 0.757 254 L CB 0.578 42.226 42.059 -0.685 0.000 0.918 254 L HN -0.504 7.478 8.230 -0.396 0.010 0.444 255 Y N -3.468 116.606 120.300 -0.377 0.000 2.546 255 Y HA -0.020 3.824 4.550 -1.176 0.000 0.287 255 Y C 1.561 177.396 175.900 -0.109 0.000 1.158 255 Y CA 0.446 58.208 58.100 -0.564 0.000 1.307 255 Y CB -0.548 37.608 38.460 -0.507 0.000 1.036 255 Y HN -0.361 7.574 8.280 -0.576 0.000 0.532 256 T N -4.827 109.803 114.554 0.127 0.000 3.129 256 T HA -0.068 4.398 4.350 0.193 0.000 0.251 256 T C 0.135 175.003 174.700 0.280 0.000 1.117 256 T CA 0.262 62.476 62.100 0.191 0.000 1.034 256 T CB 0.200 69.151 68.868 0.139 0.000 0.968 256 T HN -0.595 7.649 8.240 0.068 0.036 0.526 257 K N 3.042 123.663 120.400 0.369 0.000 2.402 257 K HA -0.174 4.613 4.320 0.525 -0.153 0.285 257 K C -0.836 176.036 176.600 0.455 0.000 1.054 257 K CA 0.818 57.394 56.287 0.481 0.000 1.001 257 K CB -0.196 32.589 32.500 0.475 0.000 0.946 257 K HN -0.743 7.650 8.250 0.326 0.053 0.473 258 C N 4.710 124.248 119.300 0.396 0.000 2.985 258 C HA 0.312 4.910 4.460 0.229 0.000 0.332 258 C C -2.487 172.550 174.990 0.078 0.000 1.164 258 C CA -3.810 55.345 59.018 0.228 0.000 1.347 258 C CB 2.835 30.664 27.740 0.148 0.000 1.764 258 C HN -0.260 8.400 8.230 0.454 -0.157 0.489 259 P HA -0.137 4.136 4.420 -0.245 0.000 0.220 259 P C -1.249 175.867 177.300 -0.306 0.000 1.148 259 P CA 1.104 64.112 63.100 -0.153 0.000 0.803 259 P CB 0.349 32.029 31.700 -0.033 0.000 0.782 260 D N 0.162 120.453 120.400 -0.181 0.000 2.349 260 D HA -0.116 4.407 4.640 -0.195 0.000 0.266 260 D C -0.622 175.534 176.300 -0.239 0.000 1.293 260 D CA 0.948 54.840 54.000 -0.180 0.000 0.926 260 D CB -0.486 40.261 40.800 -0.090 0.000 1.090 260 D HN -0.549 7.745 8.370 -0.104 0.014 0.502 261 L N 5.748 126.764 121.223 -0.345 0.000 2.395 261 L HA 0.199 4.325 4.340 -0.355 0.000 0.269 261 L C -1.612 175.158 176.870 -0.167 0.000 1.133 261 L CA -2.244 52.369 54.840 -0.378 0.000 0.812 261 L CB -0.276 41.331 42.059 -0.754 0.000 1.125 261 L HN -0.003 8.010 8.230 -0.362 0.000 0.452 262 P HA 0.113 4.516 4.420 -0.028 0.000 0.276 262 P C -1.340 175.937 177.300 -0.039 0.000 1.252 262 P CA -0.834 62.257 63.100 -0.016 0.000 0.802 262 P CB 0.696 32.419 31.700 0.037 0.000 1.035 263 D N 0.829 121.193 120.400 -0.060 0.000 2.508 263 D HA -0.014 4.594 4.640 -0.053 0.000 0.224 263 D C 0.877 177.086 176.300 -0.151 0.000 1.171 263 D CA -0.676 53.282 54.000 -0.071 0.000 1.006 263 D CB -0.913 39.858 40.800 -0.048 0.000 1.073 263 D HN 0.138 8.478 8.370 -0.049 0.000 0.513 264 V N 4.886 124.658 119.914 -0.236 0.000 2.332 264 V HA -0.582 2.963 4.120 -0.958 0.000 0.248 264 V C 1.061 176.956 176.094 -0.331 0.000 1.055 264 V CA 3.673 65.632 62.300 -0.568 0.000 1.038 264 V CB 0.245 31.730 31.823 -0.562 0.000 0.651 264 V HN -0.286 7.822 8.190 -0.136 0.000 0.450 265 E N -2.224 117.887 120.200 -0.148 0.000 2.085 265 E HA -0.288 4.033 4.350 -0.048 0.000 0.194 265 E C 1.694 178.278 176.600 -0.027 0.000 0.994 265 E CA 2.453 58.816 56.400 -0.061 0.000 0.801 265 E CB -1.010 28.672 29.700 -0.029 0.000 0.743 265 E HN 0.307 8.597 8.360 -0.117 0.000 0.453 266 S N -0.876 114.804 115.700 -0.033 0.000 2.402 266 S HA -0.195 4.284 4.470 0.014 0.000 0.229 266 S C 1.643 176.271 174.600 0.047 0.000 1.021 266 S CA 2.129 60.330 58.200 0.003 0.000 0.974 266 S CB 0.366 63.561 63.200 -0.008 0.000 0.800 266 S HN -0.732 7.727 8.310 -0.053 -0.182 0.484 267 L N -0.851 120.397 121.223 0.041 0.000 2.341 267 L HA -0.042 4.436 4.340 0.231 0.000 0.214 267 L C 1.004 178.108 176.870 0.390 0.000 1.115 267 L CA 1.320 56.292 54.840 0.221 0.000 0.820 267 L CB -0.143 42.058 42.059 0.238 0.000 0.944 267 L HN -0.710 7.391 8.230 -0.049 0.099 0.452 268 R N 0.446 121.086 120.500 0.235 0.000 2.096 268 R HA -0.318 4.312 4.340 0.482 0.000 0.240 268 R C -1.050 175.422 176.300 0.286 0.000 1.139 268 R CA 5.541 61.828 56.100 0.313 0.000 0.952 268 R CB -2.222 28.180 30.300 0.171 0.000 0.854 268 R HN -0.347 7.980 8.270 0.095 0.000 0.436 269 P HA -0.223 4.266 4.420 0.116 0.000 0.215 269 P C 1.262 178.646 177.300 0.139 0.000 1.153 269 P CA 2.912 66.097 63.100 0.141 0.000 0.853 269 P CB -0.594 31.170 31.700 0.107 0.000 0.788 270 Y N -0.611 119.714 120.300 0.043 0.000 2.128 270 Y HA -0.452 4.058 4.550 -0.067 0.000 0.284 270 Y C 1.769 177.599 175.900 -0.118 0.000 1.154 270 Y CA 3.822 61.870 58.100 -0.086 0.000 1.149 270 Y CB -0.091 38.233 38.460 -0.226 0.000 0.976 270 Y HN -0.767 7.690 8.280 0.295 0.000 0.505 271 Y N -4.041 116.324 120.300 0.108 0.000 2.373 271 Y HA -0.449 4.022 4.550 -0.132 0.000 0.293 271 Y C 2.148 178.040 175.900 -0.013 0.000 1.129 271 Y CA 3.643 61.755 58.100 0.019 0.000 1.226 271 Y CB -0.514 38.056 38.460 0.182 0.000 1.000 271 Y HN -0.669 7.840 8.280 0.383 0.000 0.549 272 Q N 0.189 120.076 119.800 0.145 0.000 2.119 272 Q HA -0.337 4.061 4.340 0.097 0.000 0.201 272 Q C 2.192 178.193 176.000 0.002 0.000 0.972 272 Q CA 2.400 58.252 55.803 0.083 0.000 0.847 272 Q CB -0.763 28.029 28.738 0.090 0.000 0.903 272 Q HN 0.107 8.486 8.270 0.182 0.000 0.433 273 G N -0.978 107.783 108.800 -0.065 0.000 2.440 273 G HA2 -0.293 3.623 3.960 -0.074 0.000 0.218 273 G HA3 -0.293 3.575 3.960 -0.155 0.000 0.218 273 G C 1.409 176.233 174.900 -0.127 0.000 1.154 273 G CA 1.961 46.993 45.100 -0.113 0.000 0.767 273 G HN -0.399 7.845 8.290 -0.076 0.000 0.552 274 L N 0.542 121.668 121.223 -0.161 0.000 2.093 274 L HA -0.316 4.025 4.340 0.002 0.000 0.208 274 L C 2.198 179.123 176.870 0.092 0.000 1.085 274 L CA 2.344 57.176 54.840 -0.012 0.000 0.755 274 L CB -0.269 41.788 42.059 -0.003 0.000 0.904 274 L HN -0.908 7.172 8.230 -0.250 0.000 0.435 275 I N 0.355 120.956 120.570 0.052 0.000 2.226 275 I HA -0.489 3.706 4.170 0.042 0.000 0.245 275 I C 2.203 178.300 176.117 -0.034 0.000 1.100 275 I CA 4.263 65.582 61.300 0.030 0.000 1.374 275 I CB -0.117 37.909 38.000 0.043 0.000 1.057 275 I HN -0.099 8.136 8.210 0.041 0.000 0.413 276 D N -0.823 119.550 120.400 -0.044 0.000 2.218 276 D HA -0.194 4.408 4.640 -0.064 0.000 0.204 276 D C 1.065 177.290 176.300 -0.125 0.000 0.976 276 D CA 3.044 57.001 54.000 -0.072 0.000 0.853 276 D CB -0.444 40.321 40.800 -0.059 0.000 0.939 276 D HN -0.292 8.057 8.370 -0.034 0.000 0.481 277 K N -2.215 118.081 120.400 -0.174 0.000 2.211 277 K HA -0.088 4.057 4.320 -0.291 0.000 0.201 277 K C 1.186 177.511 176.600 -0.458 0.000 1.052 277 K CA 2.398 58.475 56.287 -0.351 0.000 0.973 277 K CB 1.090 33.294 32.500 -0.493 0.000 0.766 277 K HN -0.706 7.318 8.250 -0.137 0.143 0.466 278 Y N -5.359 114.877 120.300 -0.105 0.000 2.483 278 Y HA 0.308 4.803 4.550 -0.091 0.000 0.258 278 Y C -0.428 175.279 175.900 -0.322 0.000 1.083 278 Y CA -0.229 57.791 58.100 -0.132 0.000 1.283 278 Y CB 3.309 41.734 38.460 -0.058 0.000 1.178 278 Y HN -0.570 7.682 8.280 -0.046 0.000 0.515 279 C N -5.315 113.818 119.300 -0.279 0.000 2.996 279 C HA 0.449 4.532 4.460 -0.629 0.000 0.221 279 C C -2.963 171.821 174.990 -0.344 0.000 1.122 279 C CA -3.178 55.461 59.018 -0.631 0.000 1.040 279 C CB 0.830 27.636 27.740 -1.557 0.000 1.804 279 C HN -0.129 7.992 8.230 -0.182 0.000 0.659 280 P HA -0.002 4.433 4.420 -0.077 -0.061 0.274 280 P C 0.154 177.421 177.300 -0.055 0.000 1.256 280 P CA -0.261 62.780 63.100 -0.098 0.000 0.795 280 P CB 0.576 32.226 31.700 -0.082 0.000 1.038 281 G N -1.166 107.630 108.800 -0.007 0.000 2.697 281 G HA2 -0.322 3.659 3.960 0.034 0.000 0.240 281 G HA3 -0.322 3.649 3.960 0.018 0.000 0.240 281 G C -0.841 174.104 174.900 0.074 0.000 1.346 281 G CA -0.494 44.623 45.100 0.028 0.000 0.887 281 G HN 0.034 8.323 8.290 -0.002 0.000 0.569 282 T N 2.533 117.144 114.554 0.096 0.000 2.851 282 T HA -0.111 4.488 4.350 0.205 -0.126 0.298 282 T C -0.191 174.612 174.700 0.171 0.000 0.977 282 T CA 1.182 63.379 62.100 0.161 0.000 1.126 282 T CB 0.444 69.400 68.868 0.147 0.000 0.916 282 T HN -0.085 8.201 8.240 0.078 0.000 0.529 283 L N 6.135 127.521 121.223 0.271 0.000 2.286 283 L HA 0.420 4.819 4.340 0.099 0.000 0.265 283 L C -1.200 175.781 176.870 0.185 0.000 1.012 283 L CA -1.926 53.004 54.840 0.150 0.000 0.818 283 L CB 3.751 45.818 42.059 0.014 0.000 1.337 283 L HN 0.713 9.082 8.230 0.411 0.108 0.438 284 S N 0.309 116.026 115.700 0.027 0.000 2.442 284 S HA 0.221 4.881 4.470 0.317 0.000 0.297 284 S C -1.068 173.506 174.600 -0.043 0.000 1.131 284 S CA 0.296 58.587 58.200 0.152 0.000 1.092 284 S CB 1.260 64.631 63.200 0.286 0.000 0.998 284 S HN -0.283 8.316 8.310 -0.018 -0.299 0.478 285 W N 0.000 121.513 121.300 0.356 0.000 2.388 285 W HA 0.000 4.986 4.660 0.543 0.000 0.303 285 W CA 0.000 57.693 57.345 0.580 0.000 1.226 285 W CB 0.000 29.846 29.460 0.643 0.000 1.126 285 W HN 0.000 8.593 8.180 0.688 0.000 0.535