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 3n16_1_A DATA FIRST_RESID 2 DATA SEQUENCE SALFEPYTLK DVTLRNRIAI PPMCQYMAED GMINDWHHVH LAGLARGGAG DATA SEQUENCE LLVVEATAVA PEGRITPGCA GIWSDAHAQA FVPVVQAIKA AGSVPGIQIA DATA SEQUENCE HAGRKASANR PWEGDDHIAA DDTRGWETIA PSAIAFGAHL PKVPREMTLD DATA SEQUENCE DIARVKQDFV DAARRARDAG FEWIELHFAH GFLGQSFFSE HSNKRTDAYG DATA SEQUENCE GSFDNRSRFL LETLAAVREV WPENLPLTAR FGVLEYDGRD EQTLEESIEL DATA SEQUENCE ARRFKAGGLD LLSVSVGFTI PDTNIPWGPA FMGPIAERVR REAKLPVTSA DATA SEQUENCE WGFGTPQLAE AALQANQLDL VSVGRAHLAD PHWAYFAAKE LGVEKASWTL DATA SEQUENCE PAPYAHWLE 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 2 S HA 0.000 4.526 4.470 0.093 0.000 0.327 2 S C 0.000 174.678 174.600 0.130 0.000 1.055 2 S CA 0.000 58.276 58.200 0.127 0.000 1.107 2 S CB 0.000 63.322 63.200 0.203 0.000 0.593 3 A N 7.415 130.286 122.820 0.085 0.000 1.933 3 A HA -0.107 4.246 4.320 0.055 0.000 0.218 3 A C 1.368 178.959 177.584 0.011 0.000 1.175 3 A CA 2.597 54.665 52.037 0.051 0.000 0.628 3 A CB -0.044 18.976 19.000 0.035 0.000 0.814 3 A HN 0.837 9.420 8.150 0.076 -0.387 0.444 4 L N -1.942 119.276 121.223 -0.009 0.000 2.187 4 L HA -0.255 3.976 4.340 -0.181 0.000 0.213 4 L C 0.062 176.667 176.870 -0.441 0.000 1.100 4 L CA 2.583 57.302 54.840 -0.202 0.000 0.765 4 L CB -0.036 41.889 42.059 -0.222 0.000 0.904 4 L HN -0.083 8.484 8.230 0.044 -0.310 0.437 5 F N -4.057 115.911 119.950 0.031 0.000 2.641 5 F HA 0.123 4.678 4.527 0.046 0.000 0.302 5 F C -0.008 175.819 175.800 0.044 0.000 1.098 5 F CA -1.090 56.932 58.000 0.036 0.000 1.318 5 F CB 0.436 39.449 39.000 0.021 0.000 1.035 5 F HN -0.825 7.538 8.300 0.161 0.033 0.551 6 E N 1.222 121.486 120.200 0.106 0.000 2.301 6 E HA 0.250 4.671 4.350 0.118 0.000 0.275 6 E C -1.855 174.804 176.600 0.098 0.000 1.030 6 E CA -3.115 53.347 56.400 0.103 0.000 0.852 6 E CB 1.181 30.933 29.700 0.086 0.000 1.060 6 E HN -0.571 7.777 8.360 0.062 0.049 0.401 7 P HA -0.018 4.595 4.420 0.124 -0.119 0.272 7 P C -1.994 175.424 177.300 0.197 0.000 1.240 7 P CA -0.205 62.972 63.100 0.129 0.000 0.791 7 P CB 1.053 32.814 31.700 0.102 0.000 0.978 8 Y N -0.535 119.792 120.300 0.046 0.000 2.421 8 Y HA 0.161 4.745 4.550 0.057 0.000 0.339 8 Y C -2.350 173.601 175.900 0.086 0.000 0.996 8 Y CA -1.171 56.967 58.100 0.062 0.000 1.046 8 Y CB 3.651 42.150 38.460 0.064 0.000 1.226 8 Y HN -0.012 8.415 8.280 0.246 0.000 0.445 9 T N 9.285 123.625 114.554 -0.355 0.000 2.779 9 T HA 0.724 5.182 4.350 -0.168 -0.208 0.280 9 T C -1.593 172.795 174.700 -0.520 0.000 0.987 9 T CA -0.589 61.331 62.100 -0.300 0.000 0.966 9 T CB 1.204 69.991 68.868 -0.135 0.000 0.933 9 T HN 0.163 8.181 8.240 -0.370 0.000 0.442 10 L N 8.353 129.395 121.223 -0.302 0.000 2.438 10 L HA 0.473 4.666 4.340 -0.244 0.000 0.270 10 L C -1.369 175.454 176.870 -0.079 0.000 0.972 10 L CA -1.124 53.590 54.840 -0.210 0.000 0.831 10 L CB 2.500 44.491 42.059 -0.115 0.000 1.273 10 L HN 0.219 8.358 8.230 -0.152 0.000 0.405 11 K N 3.065 123.420 120.400 -0.075 0.000 1.779 11 K HA -0.324 3.969 4.320 -0.045 0.000 0.128 11 K C -0.507 176.074 176.600 -0.033 0.000 1.288 11 K CA 2.100 58.360 56.287 -0.045 0.000 0.398 11 K CB -1.182 31.298 32.500 -0.033 0.000 0.609 11 K HN 0.449 8.648 8.250 -0.085 0.000 0.874 12 D N 1.250 121.641 120.400 -0.015 0.000 2.339 12 D HA 0.181 4.812 4.640 -0.015 0.000 0.217 12 D C -0.376 175.934 176.300 0.017 0.000 1.050 12 D CA 0.441 54.436 54.000 -0.008 0.000 0.856 12 D CB 0.548 41.337 40.800 -0.017 0.000 0.922 12 D HN -0.134 8.229 8.370 -0.013 0.000 0.518 13 V N 1.577 121.519 119.914 0.047 0.000 2.427 13 V HA 0.097 4.270 4.120 0.088 0.000 0.286 13 V C -1.440 174.705 176.094 0.085 0.000 1.034 13 V CA -0.226 62.134 62.300 0.101 0.000 0.893 13 V CB 1.876 33.828 31.823 0.215 0.000 0.982 13 V HN -0.398 7.757 8.190 0.042 0.061 0.452 14 T N 8.531 123.132 114.554 0.078 0.000 2.815 14 T HA 0.408 4.977 4.350 0.056 -0.185 0.289 14 T C -0.853 173.903 174.700 0.094 0.000 1.000 14 T CA -0.815 61.326 62.100 0.068 0.000 0.958 14 T CB 1.100 69.994 68.868 0.043 0.000 0.944 14 T HN 0.122 8.408 8.240 0.076 0.000 0.442 15 L N 5.498 126.798 121.223 0.128 0.000 2.349 15 L HA 0.123 4.508 4.340 0.075 0.000 0.275 15 L C 1.290 178.220 176.870 0.099 0.000 1.115 15 L CA -0.394 54.510 54.840 0.107 0.000 0.820 15 L CB 0.419 42.553 42.059 0.125 0.000 1.135 15 L HN 0.589 8.916 8.230 0.162 0.000 0.445 16 R N 2.228 122.775 120.500 0.078 0.000 2.236 16 R HA -0.297 4.098 4.340 0.092 0.000 0.208 16 R C -1.352 175.010 176.300 0.103 0.000 1.036 16 R CA 1.802 57.958 56.100 0.092 0.000 1.001 16 R CB 0.273 30.630 30.300 0.095 0.000 0.896 16 R HN 0.684 8.993 8.270 0.065 0.000 0.464 17 N N -5.757 112.979 118.700 0.061 0.000 3.243 17 N HA 0.091 5.022 4.740 0.016 -0.181 0.280 17 N C -0.455 175.019 175.510 -0.061 0.000 1.545 17 N CA -1.281 51.761 53.050 -0.013 0.000 0.854 17 N CB 2.355 40.774 38.487 -0.113 0.000 1.612 17 N HN -0.884 7.499 8.380 0.048 0.026 0.577 18 R N -3.588 116.820 120.500 -0.153 0.000 2.426 18 R HA 0.279 4.535 4.340 -0.141 0.000 0.263 18 R C -1.050 175.152 176.300 -0.164 0.000 0.961 18 R CA -1.776 54.227 56.100 -0.161 0.000 1.086 18 R CB -0.779 29.416 30.300 -0.174 0.000 1.186 18 R HN 0.153 8.284 8.270 -0.231 0.000 0.537 19 I N 0.590 121.079 120.570 -0.134 0.000 2.325 19 I HA 0.168 4.451 4.170 -0.028 -0.130 0.291 19 I C -1.960 174.114 176.117 -0.070 0.000 1.019 19 I CA 0.019 61.296 61.300 -0.038 0.000 1.302 19 I CB 0.729 38.789 38.000 0.100 0.000 1.401 19 I HN -0.147 8.230 8.210 -0.148 -0.256 0.485 20 A N 7.508 130.268 122.820 -0.100 0.000 2.331 20 A HA 0.755 5.133 4.320 -0.195 -0.175 0.320 20 A C -1.714 175.790 177.584 -0.133 0.000 1.138 20 A CA -2.437 49.505 52.037 -0.159 0.000 0.790 20 A CB 3.183 22.069 19.000 -0.191 0.000 1.206 20 A HN 0.562 8.657 8.150 -0.092 0.000 0.470 21 I N 3.852 124.310 120.570 -0.187 0.000 2.301 21 I HA 0.568 4.644 4.170 -0.157 0.000 0.292 21 I C -1.634 174.416 176.117 -0.111 0.000 1.046 21 I CA -3.027 58.157 61.300 -0.194 0.000 1.282 21 I CB 1.180 38.976 38.000 -0.340 0.000 1.409 21 I HN 0.204 8.287 8.210 -0.212 0.000 0.484 22 P HA 0.191 4.600 4.420 -0.019 0.000 0.274 22 P C -2.187 175.131 177.300 0.030 0.000 1.246 22 P CA -2.084 61.018 63.100 0.005 0.000 0.795 22 P CB -0.767 30.973 31.700 0.066 0.000 1.006 23 P HA -0.074 4.568 4.420 0.052 -0.190 0.263 23 P C -0.934 176.431 177.300 0.108 0.000 1.195 23 P CA 0.285 63.415 63.100 0.050 0.000 0.762 23 P CB 0.650 32.348 31.700 -0.003 0.000 0.799 24 M N 2.453 122.136 119.600 0.138 0.000 2.090 24 M HA 0.208 4.788 4.480 0.166 0.000 0.277 24 M C -0.781 175.600 176.300 0.135 0.000 0.935 24 M CA -1.112 54.287 55.300 0.165 0.000 0.966 24 M CB 2.972 35.691 32.600 0.198 0.000 1.635 24 M HN 0.155 8.534 8.290 0.149 0.000 0.446 25 C N 5.026 124.350 119.300 0.040 0.000 2.563 25 C HA -0.338 4.191 4.460 -0.143 -0.154 0.411 25 C C 0.763 175.643 174.990 -0.184 0.000 1.386 25 C CA 1.482 60.376 59.018 -0.207 0.000 1.703 25 C CB 0.516 27.888 27.740 -0.613 0.000 2.596 25 C HN 0.366 8.636 8.230 0.066 0.000 0.605 26 Q N 2.801 122.517 119.800 -0.141 0.000 2.350 26 Q HA 0.049 4.489 4.340 0.166 0.000 0.225 26 Q C -0.459 175.637 176.000 0.160 0.000 0.878 26 Q CA -0.346 55.492 55.803 0.058 0.000 0.935 26 Q CB 1.132 29.933 28.738 0.105 0.000 1.099 26 Q HN 0.095 8.606 8.270 -0.112 -0.308 0.527 27 Y N -6.297 114.076 120.300 0.122 0.000 3.825 27 Y HA -0.406 4.202 4.550 0.043 -0.033 0.221 27 Y C -0.414 175.511 175.900 0.042 0.000 1.195 27 Y CA 1.091 59.212 58.100 0.034 0.000 1.699 27 Y CB -3.292 35.053 38.460 -0.191 0.000 1.531 27 Y HN -0.376 7.669 8.280 -0.392 0.000 0.640 28 M N -3.584 116.098 119.600 0.137 0.000 2.306 28 M HA 0.111 4.608 4.480 0.029 0.000 0.292 28 M C -0.507 175.953 176.300 0.266 0.000 1.018 28 M CA -1.245 54.087 55.300 0.053 0.000 1.007 28 M CB -0.266 32.121 32.600 -0.355 0.000 1.510 28 M HN -0.205 8.182 8.290 0.188 0.017 0.537 29 A N -0.052 122.960 122.820 0.319 0.000 2.304 29 A HA 0.158 4.727 4.320 0.260 -0.093 0.271 29 A C -1.378 176.291 177.584 0.142 0.000 1.091 29 A CA -0.894 51.272 52.037 0.216 0.000 0.812 29 A CB 1.921 20.971 19.000 0.082 0.000 1.056 29 A HN -0.414 7.916 8.150 0.300 0.000 0.489 30 E N 0.626 120.882 120.200 0.093 0.000 2.191 30 E HA 0.284 4.699 4.350 0.108 0.000 0.263 30 E C -0.630 176.023 176.600 0.087 0.000 0.881 30 E CA -1.025 55.429 56.400 0.089 0.000 0.757 30 E CB 2.672 32.412 29.700 0.067 0.000 1.147 30 E HN -0.315 8.081 8.360 0.059 0.000 0.414 31 D N 6.636 127.124 120.400 0.147 0.000 2.701 31 D HA -0.396 4.416 4.640 0.286 0.000 0.235 31 D C 0.103 176.579 176.300 0.293 0.000 1.155 31 D CA 1.215 55.360 54.000 0.241 0.000 0.649 31 D CB -0.434 40.485 40.800 0.199 0.000 1.050 31 D HN 1.107 9.567 8.370 0.150 0.000 0.425 32 G N -5.778 103.138 108.800 0.193 0.000 2.205 32 G HA2 -0.505 3.703 3.960 0.039 0.000 0.261 32 G HA3 -0.505 3.263 3.960 -0.321 0.000 0.261 32 G C -0.299 174.565 174.900 -0.060 0.000 0.980 32 G CA 0.365 45.459 45.100 -0.009 0.000 0.632 32 G HN 0.353 8.735 8.290 0.186 0.020 0.533 33 M N 2.689 122.215 119.600 -0.123 0.000 2.146 33 M HA 0.246 4.511 4.480 -0.359 0.000 0.357 33 M C -0.240 175.911 176.300 -0.247 0.000 1.261 33 M CA -0.733 54.403 55.300 -0.275 0.000 1.106 33 M CB -0.735 31.687 32.600 -0.296 0.000 1.612 33 M HN -0.294 7.783 8.290 -0.069 0.172 0.470 34 I N 0.824 121.130 120.570 -0.440 0.000 3.269 34 I HA -0.066 3.722 4.170 -0.637 0.000 0.287 34 I C -1.067 174.953 176.117 -0.161 0.000 1.152 34 I CA -0.203 60.758 61.300 -0.565 0.000 1.263 34 I CB 0.818 38.258 38.000 -0.934 0.000 1.439 34 I HN 0.270 8.154 8.210 -0.544 0.000 0.637 35 N N -0.738 118.067 118.700 0.174 0.000 3.439 35 N HA 0.095 4.877 4.740 0.070 0.000 0.313 35 N C -1.094 174.581 175.510 0.275 0.000 1.598 35 N CA -0.650 52.517 53.050 0.195 0.000 0.830 35 N CB 0.942 39.541 38.487 0.187 0.000 1.849 35 N HN -0.288 8.405 8.380 0.523 0.000 0.598 36 D N -0.712 119.798 120.400 0.184 0.000 2.310 36 D HA -0.139 4.592 4.640 0.153 0.000 0.212 36 D C 0.992 177.389 176.300 0.162 0.000 0.965 36 D CA 2.909 56.999 54.000 0.150 0.000 0.879 36 D CB -0.163 40.682 40.800 0.075 0.000 0.921 36 D HN 0.198 8.658 8.370 0.149 0.000 0.510 37 W N 0.568 121.908 121.300 0.066 0.000 2.315 37 W HA -0.509 4.136 4.660 -0.025 0.000 0.323 37 W C 1.159 177.657 176.519 -0.036 0.000 1.233 37 W CA 4.209 61.515 57.345 -0.065 0.000 1.267 37 W CB -0.099 29.206 29.460 -0.259 0.000 1.160 37 W HN -0.103 8.553 8.180 0.367 -0.256 0.474 38 H N -3.311 115.848 119.070 0.148 0.000 2.357 38 H HA -0.343 4.290 4.556 0.128 0.000 0.301 38 H C 2.281 177.650 175.328 0.068 0.000 1.082 38 H CA 4.325 60.452 56.048 0.133 0.000 1.342 38 H CB -0.464 29.421 29.762 0.204 0.000 1.389 38 H HN -0.596 7.883 8.280 0.332 0.000 0.511 39 H N 0.611 119.749 119.070 0.113 0.000 2.290 39 H HA -0.335 4.263 4.556 0.070 0.000 0.298 39 H C 2.149 177.463 175.328 -0.023 0.000 1.087 39 H CA 4.057 60.133 56.048 0.046 0.000 1.291 39 H CB 0.024 29.801 29.762 0.024 0.000 1.369 39 H HN -0.436 8.042 8.280 0.330 0.000 0.492 40 V N -1.154 118.757 119.914 -0.005 0.000 2.379 40 V HA -0.556 3.520 4.120 -0.072 0.000 0.245 40 V C 1.498 177.472 176.094 -0.200 0.000 1.044 40 V CA 4.210 66.448 62.300 -0.104 0.000 1.036 40 V CB -0.046 31.717 31.823 -0.100 0.000 0.664 40 V HN -0.620 7.594 8.190 0.041 0.000 0.453 41 H N 0.956 119.769 119.070 -0.429 0.000 2.319 41 H HA -0.349 3.976 4.556 -0.384 0.000 0.297 41 H C 2.046 177.272 175.328 -0.170 0.000 1.097 41 H CA 4.152 59.969 56.048 -0.385 0.000 1.285 41 H CB 0.114 29.545 29.762 -0.552 0.000 1.368 41 H HN -0.460 7.611 8.280 -0.347 0.000 0.495 42 L N -2.744 118.339 121.223 -0.232 0.000 2.127 42 L HA -0.235 3.902 4.340 -0.340 0.000 0.203 42 L C 1.992 178.740 176.870 -0.203 0.000 1.080 42 L CA 2.491 57.198 54.840 -0.221 0.000 0.768 42 L CB -0.181 41.868 42.059 -0.017 0.000 0.924 42 L HN -0.221 7.945 8.230 -0.108 0.000 0.444 43 A N -1.051 121.623 122.820 -0.242 0.000 1.930 43 A HA -0.273 3.940 4.320 -0.178 0.000 0.217 43 A C 2.053 179.568 177.584 -0.114 0.000 1.175 43 A CA 2.975 54.885 52.037 -0.212 0.000 0.627 43 A CB -0.773 18.042 19.000 -0.309 0.000 0.815 43 A HN 0.239 8.210 8.150 -0.297 0.000 0.443 44 G N -1.671 107.066 108.800 -0.104 0.000 2.418 44 G HA2 -0.321 3.672 3.960 0.055 0.000 0.217 44 G HA3 -0.321 3.627 3.960 -0.020 0.000 0.217 44 G C 1.311 176.231 174.900 0.033 0.000 1.158 44 G CA 1.708 46.804 45.100 -0.007 0.000 0.771 44 G HN -0.129 8.075 8.290 -0.143 0.000 0.545 45 L N 1.327 122.502 121.223 -0.079 0.000 2.046 45 L HA -0.336 4.030 4.340 0.042 0.000 0.208 45 L C 3.039 179.895 176.870 -0.022 0.000 1.077 45 L CA 2.572 57.376 54.840 -0.059 0.000 0.747 45 L CB -0.200 41.722 42.059 -0.229 0.000 0.896 45 L HN -0.528 7.597 8.230 -0.176 0.000 0.432 46 A N -0.328 122.457 122.820 -0.057 0.000 1.908 46 A HA -0.351 3.946 4.320 -0.038 0.000 0.218 46 A C 1.476 179.063 177.584 0.006 0.000 1.181 46 A CA 2.951 54.968 52.037 -0.034 0.000 0.627 46 A CB -0.650 18.318 19.000 -0.053 0.000 0.818 46 A HN -0.053 8.044 8.150 -0.088 0.000 0.445 47 R N -4.074 116.438 120.500 0.021 0.000 2.237 47 R HA -0.238 4.096 4.340 -0.011 0.000 0.219 47 R C 1.952 178.267 176.300 0.025 0.000 1.080 47 R CA 2.421 58.533 56.100 0.021 0.000 0.995 47 R CB -0.129 30.195 30.300 0.041 0.000 0.875 47 R HN -0.406 7.875 8.270 0.018 0.000 0.462 48 G N -5.492 103.382 108.800 0.122 0.000 2.509 48 G HA2 -0.097 3.846 3.960 -0.028 0.000 0.218 48 G HA3 -0.097 4.275 3.960 0.356 -0.199 0.218 48 G C -0.661 174.339 174.900 0.166 0.000 1.124 48 G CA 0.534 45.737 45.100 0.172 0.000 0.776 48 G HN -0.459 7.763 8.290 0.152 0.160 0.547 49 G N -2.616 106.268 108.800 0.141 0.000 2.255 49 G HA2 -0.321 3.716 3.960 0.129 0.000 0.196 49 G HA3 -0.321 3.768 3.960 0.216 0.000 0.196 49 G C -0.812 174.199 174.900 0.185 0.000 0.998 49 G CA -0.460 44.742 45.100 0.171 0.000 0.656 49 G HN -0.714 7.611 8.290 0.107 0.029 0.490 50 A N 1.266 124.185 122.820 0.166 0.000 2.483 50 A HA -0.033 4.375 4.320 0.146 0.000 0.238 50 A C 0.652 178.254 177.584 0.029 0.000 1.070 50 A CA -0.063 52.036 52.037 0.104 0.000 0.770 50 A CB 0.499 19.505 19.000 0.009 0.000 1.008 50 A HN -0.441 7.809 8.150 0.167 0.000 0.497 51 G N -0.362 108.437 108.800 -0.002 0.000 2.421 51 G HA2 -0.085 3.882 3.960 0.013 0.000 0.217 51 G HA3 -0.085 3.862 3.960 -0.021 0.000 0.217 51 G C -1.482 173.369 174.900 -0.082 0.000 1.143 51 G CA 1.334 46.422 45.100 -0.019 0.000 0.784 51 G HN 0.200 8.659 8.290 -0.008 -0.175 0.541 52 L N -1.138 119.992 121.223 -0.154 0.000 2.464 52 L HA 0.572 4.907 4.340 -0.233 -0.135 0.266 52 L C -2.826 173.900 176.870 -0.240 0.000 0.965 52 L CA -0.229 54.450 54.840 -0.267 0.000 0.833 52 L CB 4.116 45.866 42.059 -0.515 0.000 1.296 52 L HN -0.720 7.424 8.230 -0.144 0.000 0.405 53 L N 7.145 128.251 121.223 -0.194 0.000 2.342 53 L HA 0.494 4.729 4.340 -0.175 0.000 0.276 53 L C -2.543 174.262 176.870 -0.108 0.000 0.997 53 L CA -1.326 53.425 54.840 -0.148 0.000 0.838 53 L CB 2.762 44.761 42.059 -0.100 0.000 1.224 53 L HN 0.320 8.450 8.230 -0.166 0.000 0.416 54 V N 8.635 128.477 119.914 -0.121 0.000 2.364 54 V HA 0.040 4.165 4.120 -0.061 -0.041 0.272 54 V C -1.376 174.712 176.094 -0.009 0.000 1.036 54 V CA -0.934 61.321 62.300 -0.076 0.000 0.880 54 V CB 0.871 32.636 31.823 -0.096 0.000 0.991 54 V HN 0.605 8.713 8.190 -0.136 0.000 0.460 55 V N 8.025 127.953 119.914 0.023 0.000 2.788 55 V HA -0.178 4.029 4.120 0.145 0.000 0.307 55 V C 0.202 176.313 176.094 0.028 0.000 1.069 55 V CA 0.034 62.380 62.300 0.076 0.000 1.173 55 V CB 0.100 31.984 31.823 0.102 0.000 0.925 55 V HN 0.287 8.391 8.190 0.025 0.100 0.492 56 E N 6.260 126.523 120.200 0.104 0.000 2.485 56 E HA -0.282 4.175 4.350 0.071 -0.065 0.266 56 E C -0.354 176.259 176.600 0.022 0.000 1.090 56 E CA 0.755 57.201 56.400 0.078 0.000 0.987 56 E CB 0.240 30.011 29.700 0.117 0.000 0.974 56 E HN 0.317 8.781 8.360 0.173 0.000 0.455 57 A N 2.194 125.029 122.820 0.025 0.000 2.572 57 A HA -0.256 4.263 4.320 0.022 -0.186 0.256 57 A C -0.604 176.978 177.584 -0.003 0.000 1.041 57 A CA 1.307 53.361 52.037 0.030 0.000 0.790 57 A CB -0.401 18.655 19.000 0.092 0.000 0.947 57 A HN 0.405 8.582 8.150 0.046 0.000 0.518 58 T N 6.993 121.523 114.554 -0.040 0.000 2.791 58 T HA 0.106 4.616 4.350 0.017 -0.149 0.288 58 T C -1.232 173.432 174.700 -0.060 0.000 0.999 58 T CA -0.572 61.508 62.100 -0.034 0.000 0.952 58 T CB 1.869 70.681 68.868 -0.094 0.000 0.938 58 T HN -0.053 8.148 8.240 -0.065 0.000 0.444 59 A N 7.658 130.475 122.820 -0.005 0.000 2.488 59 A HA 0.197 4.652 4.320 -0.107 -0.200 0.249 59 A C 0.837 178.416 177.584 -0.008 0.000 1.083 59 A CA -0.306 51.716 52.037 -0.026 0.000 0.768 59 A CB 0.815 19.837 19.000 0.037 0.000 1.017 59 A HN 0.493 8.667 8.150 0.040 0.000 0.496 60 V N -1.494 118.319 119.914 -0.168 0.000 3.217 60 V HA -0.113 3.938 4.120 -0.116 0.000 0.264 60 V C -1.600 174.483 176.094 -0.019 0.000 1.135 60 V CA 0.421 62.620 62.300 -0.169 0.000 1.142 60 V CB -0.604 30.908 31.823 -0.519 0.000 0.754 60 V HN -0.042 7.993 8.190 -0.259 0.000 0.484 61 A N -2.569 120.196 122.820 -0.093 0.000 2.604 61 A HA 0.346 4.455 4.320 -0.352 0.000 0.295 61 A C -2.590 174.534 177.584 -0.766 0.000 1.067 61 A CA -1.416 50.420 52.037 -0.334 0.000 0.683 61 A CB 1.221 20.118 19.000 -0.171 0.000 1.281 61 A HN -0.744 7.272 8.150 -0.142 0.049 0.407 62 P HA -0.320 2.835 4.420 -2.108 0.000 0.216 62 P C 0.080 176.680 177.300 -1.166 0.000 1.150 62 P CA 2.391 64.506 63.100 -1.642 0.000 0.843 62 P CB 0.185 30.999 31.700 -1.477 0.000 0.787 63 E N -3.522 116.141 120.200 -0.896 0.000 2.482 63 E HA -0.167 3.289 4.350 -1.491 0.000 0.196 63 E C 0.707 177.109 176.600 -0.330 0.000 1.047 63 E CA 1.383 57.337 56.400 -0.742 0.000 0.869 63 E CB -2.094 27.446 29.700 -0.267 0.000 0.836 63 E HN 0.478 8.389 8.360 -0.725 0.015 0.520 64 G N -0.579 107.814 108.800 -0.679 0.000 3.042 64 G HA2 -0.026 3.298 3.960 -1.060 0.000 0.212 64 G HA3 -0.026 3.027 3.960 -1.512 0.000 0.212 64 G C -0.724 173.964 174.900 -0.354 0.000 1.166 64 G CA -0.866 43.647 45.100 -0.979 0.000 0.767 64 G HN -0.189 7.524 8.290 -0.689 0.163 0.546 65 R N 0.362 120.765 120.500 -0.162 0.000 2.643 65 R HA -0.095 4.243 4.340 -0.004 0.000 0.270 65 R C 0.063 176.492 176.300 0.214 0.000 1.061 65 R CA 0.618 56.749 56.100 0.052 0.000 1.107 65 R CB 0.510 30.880 30.300 0.116 0.000 0.999 65 R HN -0.904 7.160 8.270 -0.275 0.041 0.460 66 I N 0.239 120.870 120.570 0.102 0.000 2.286 66 I HA -0.222 4.022 4.170 0.123 0.000 0.245 66 I C 0.006 176.247 176.117 0.206 0.000 1.104 66 I CA 2.802 64.182 61.300 0.134 0.000 1.397 66 I CB 0.530 38.597 38.000 0.112 0.000 1.072 66 I HN 0.302 8.530 8.210 0.030 0.000 0.417 67 T N -5.546 109.174 114.554 0.277 0.000 2.865 67 T HA 0.738 5.341 4.350 0.147 -0.164 0.294 67 T C -1.438 173.487 174.700 0.376 0.000 1.119 67 T CA -3.364 58.885 62.100 0.248 0.000 1.007 67 T CB 1.178 70.169 68.868 0.205 0.000 1.225 67 T HN -0.701 7.702 8.240 0.272 0.000 0.515 68 P HA 0.010 4.655 4.420 0.374 0.000 0.234 68 P C -0.378 177.047 177.300 0.208 0.000 1.167 68 P CA 1.314 64.590 63.100 0.293 0.000 0.763 68 P CB -0.104 31.725 31.700 0.215 0.000 0.835 69 G N -4.106 104.810 108.800 0.193 0.000 3.126 69 G HA2 0.118 4.381 3.960 0.163 0.000 0.224 69 G HA3 0.118 4.328 3.960 0.184 -0.140 0.224 69 G C -0.666 174.330 174.900 0.161 0.000 1.142 69 G CA -0.764 44.443 45.100 0.178 0.000 0.759 69 G HN -0.503 7.857 8.290 0.204 0.052 0.550 70 C N 1.737 121.130 119.300 0.154 0.000 2.644 70 C HA -0.057 4.411 4.460 0.013 0.000 0.417 70 C C -0.153 174.899 174.990 0.102 0.000 1.304 70 C CA 0.559 59.629 59.018 0.088 0.000 2.035 70 C CB -0.036 27.759 27.740 0.091 0.000 2.673 70 C HN -0.662 7.639 8.230 0.194 0.045 0.602 71 A N 3.619 126.479 122.820 0.067 0.000 2.425 71 A HA -0.066 4.371 4.320 -0.012 -0.124 0.242 71 A C -0.927 176.689 177.584 0.052 0.000 1.077 71 A CA 0.312 52.374 52.037 0.041 0.000 0.781 71 A CB 0.818 19.869 19.000 0.086 0.000 1.020 71 A HN 0.674 8.858 8.150 0.057 0.000 0.494 72 G N -0.691 108.071 108.800 -0.064 0.000 2.672 72 G HA2 0.775 4.938 3.960 -0.024 0.000 0.292 72 G HA3 0.775 4.297 3.960 -0.729 0.000 0.292 72 G C -2.260 172.473 174.900 -0.278 0.000 1.375 72 G CA -0.306 44.634 45.100 -0.266 0.000 0.890 72 G HN -0.208 8.034 8.290 -0.080 0.000 0.476 73 I N -1.021 119.395 120.570 -0.256 0.000 3.336 73 I HA 0.445 4.584 4.170 -0.052 0.000 0.323 73 I C -1.129 174.907 176.117 -0.134 0.000 1.520 73 I CA -1.147 60.082 61.300 -0.117 0.000 0.959 73 I CB 1.784 39.765 38.000 -0.033 0.000 1.463 73 I HN 0.156 8.280 8.210 -0.144 0.000 0.571 74 W N -1.104 120.021 121.300 -0.292 0.000 3.256 74 W HA 0.200 4.764 4.660 -0.160 0.000 0.269 74 W C -1.558 174.889 176.519 -0.120 0.000 1.310 74 W CA -1.422 55.787 57.345 -0.228 0.000 1.673 74 W CB -0.600 28.688 29.460 -0.287 0.000 1.115 74 W HN -0.336 7.308 8.180 -0.894 0.000 0.686 75 S N -1.621 114.032 115.700 -0.077 0.000 2.618 75 S HA 0.151 4.698 4.470 0.127 0.000 0.277 75 S C -0.354 174.302 174.600 0.094 0.000 1.138 75 S CA -1.748 56.514 58.200 0.102 0.000 0.844 75 S CB 2.272 65.594 63.200 0.203 0.000 1.127 75 S HN -0.939 7.151 8.310 -0.274 0.056 0.474 76 D N 1.027 121.479 120.400 0.087 0.000 2.178 76 D HA -0.210 4.478 4.640 0.080 0.000 0.202 76 D C 1.484 177.816 176.300 0.053 0.000 0.974 76 D CA 3.507 57.550 54.000 0.071 0.000 0.841 76 D CB -0.396 40.438 40.800 0.057 0.000 0.953 76 D HN 0.488 8.911 8.370 0.087 0.000 0.478 77 A N -0.781 122.053 122.820 0.024 0.000 1.969 77 A HA -0.223 4.071 4.320 -0.043 0.000 0.218 77 A C 1.501 179.013 177.584 -0.120 0.000 1.169 77 A CA 2.459 54.460 52.037 -0.059 0.000 0.635 77 A CB -0.602 18.332 19.000 -0.109 0.000 0.810 77 A HN -0.492 7.673 8.150 0.041 0.009 0.445 78 H N -0.640 118.338 119.070 -0.154 0.000 2.389 78 H HA -0.141 4.261 4.556 -0.257 0.000 0.299 78 H C 2.110 177.439 175.328 0.001 0.000 1.081 78 H CA 4.050 59.975 56.048 -0.205 0.000 1.345 78 H CB -0.101 29.423 29.762 -0.397 0.000 1.393 78 H HN -0.692 7.638 8.280 0.082 0.000 0.520 79 A N -2.169 120.779 122.820 0.215 0.000 1.929 79 A HA -0.275 4.361 4.320 0.528 0.000 0.216 79 A C 1.750 179.491 177.584 0.262 0.000 1.176 79 A CA 2.832 55.058 52.037 0.316 0.000 0.628 79 A CB -0.518 18.599 19.000 0.195 0.000 0.816 79 A HN -0.498 7.666 8.150 0.162 0.083 0.444 80 Q N 0.102 119.970 119.800 0.114 0.000 2.170 80 Q HA -0.359 4.029 4.340 0.079 0.000 0.203 80 Q C 2.051 178.067 176.000 0.026 0.000 0.976 80 Q CA 2.925 58.764 55.803 0.061 0.000 0.858 80 Q CB -0.213 28.531 28.738 0.009 0.000 0.907 80 Q HN -0.052 8.265 8.270 0.078 0.000 0.433 81 A N -0.785 122.004 122.820 -0.053 0.000 2.019 81 A HA -0.188 4.053 4.320 -0.131 0.000 0.219 81 A C 1.484 178.960 177.584 -0.179 0.000 1.164 81 A CA 2.513 54.449 52.037 -0.169 0.000 0.644 81 A CB -0.833 17.968 19.000 -0.330 0.000 0.805 81 A HN -0.525 7.573 8.150 -0.064 0.014 0.449 82 F N -3.848 116.125 119.950 0.040 0.000 2.558 82 F HA -0.226 4.352 4.527 0.084 0.000 0.298 82 F C 1.461 177.256 175.800 -0.008 0.000 1.119 82 F CA 2.412 60.454 58.000 0.069 0.000 1.451 82 F CB -0.108 39.023 39.000 0.217 0.000 1.091 82 F HN -0.783 7.616 8.300 0.193 0.017 0.563 83 V N 1.444 121.434 119.914 0.128 0.000 2.287 83 V HA -0.298 3.823 4.120 0.001 0.000 0.248 83 V C -0.809 175.301 176.094 0.026 0.000 1.053 83 V CA 6.054 68.379 62.300 0.040 0.000 1.027 83 V CB -2.136 29.705 31.823 0.031 0.000 0.646 83 V HN -0.596 7.526 8.190 0.118 0.139 0.447 84 P HA -0.146 4.310 4.420 0.060 0.000 0.218 84 P C 1.610 179.009 177.300 0.164 0.000 1.149 84 P CA 2.980 66.132 63.100 0.087 0.000 0.817 84 P CB -0.467 31.265 31.700 0.054 0.000 0.785 85 V N -1.951 118.068 119.914 0.175 0.000 2.307 85 V HA -0.465 3.670 4.120 0.024 0.000 0.245 85 V C 1.854 177.942 176.094 -0.011 0.000 1.045 85 V CA 4.063 66.423 62.300 0.100 0.000 1.024 85 V CB -0.332 31.595 31.823 0.173 0.000 0.651 85 V HN -0.894 7.385 8.190 0.166 0.011 0.449 86 V N 0.060 119.931 119.914 -0.071 0.000 2.343 86 V HA -0.620 3.356 4.120 -0.240 0.000 0.247 86 V C 1.942 177.963 176.094 -0.122 0.000 1.051 86 V CA 4.688 66.853 62.300 -0.225 0.000 1.036 86 V CB -0.374 31.166 31.823 -0.471 0.000 0.654 86 V HN -0.316 7.845 8.190 -0.048 0.000 0.451 87 Q N -1.163 118.597 119.800 -0.067 0.000 2.124 87 Q HA -0.389 3.924 4.340 -0.046 0.000 0.202 87 Q C 2.419 178.406 176.000 -0.021 0.000 0.977 87 Q CA 3.367 59.149 55.803 -0.034 0.000 0.850 87 Q CB -0.297 28.435 28.738 -0.010 0.000 0.901 87 Q HN -0.296 7.943 8.270 -0.051 0.000 0.429 88 A N -0.143 122.669 122.820 -0.013 0.000 1.969 88 A HA -0.208 4.104 4.320 -0.013 0.000 0.218 88 A C 2.062 179.607 177.584 -0.065 0.000 1.169 88 A CA 2.859 54.874 52.037 -0.037 0.000 0.635 88 A CB -0.757 18.187 19.000 -0.094 0.000 0.810 88 A HN -0.315 7.836 8.150 0.002 0.000 0.445 89 I N -1.483 119.044 120.570 -0.071 0.000 2.202 89 I HA -0.621 3.511 4.170 -0.063 0.000 0.242 89 I C 1.739 177.833 176.117 -0.038 0.000 1.091 89 I CA 4.274 65.539 61.300 -0.058 0.000 1.368 89 I CB -0.076 37.896 38.000 -0.046 0.000 1.058 89 I HN -0.196 7.969 8.210 -0.075 0.000 0.410 90 K N -0.744 119.634 120.400 -0.036 0.000 2.097 90 K HA -0.219 4.237 4.320 -0.012 -0.144 0.206 90 K C 3.186 179.776 176.600 -0.016 0.000 1.049 90 K CA 3.108 59.383 56.287 -0.021 0.000 0.933 90 K CB -0.178 32.307 32.500 -0.025 0.000 0.717 90 K HN -0.376 7.846 8.250 -0.047 0.000 0.442 91 A N -0.239 122.570 122.820 -0.019 0.000 1.978 91 A HA -0.144 4.169 4.320 -0.011 0.000 0.220 91 A C 1.349 178.923 177.584 -0.017 0.000 1.170 91 A CA 2.634 54.662 52.037 -0.015 0.000 0.636 91 A CB -0.863 18.128 19.000 -0.014 0.000 0.810 91 A HN -0.221 7.915 8.150 -0.023 0.000 0.448 92 A N -4.402 118.405 122.820 -0.023 0.000 2.206 92 A HA 0.009 4.313 4.320 -0.027 0.000 0.211 92 A C -0.170 177.411 177.584 -0.006 0.000 1.158 92 A CA -0.032 51.991 52.037 -0.022 0.000 0.761 92 A CB 0.371 19.352 19.000 -0.031 0.000 0.801 92 A HN -0.438 7.679 8.150 -0.027 0.017 0.473 93 G N -3.728 105.072 108.800 -0.000 0.000 2.141 93 G HA2 -0.448 3.521 3.960 0.015 0.000 0.242 93 G HA3 -0.448 3.525 3.960 0.022 0.000 0.242 93 G C -0.673 174.237 174.900 0.017 0.000 0.982 93 G CA 0.010 45.119 45.100 0.014 0.000 0.662 93 G HN -0.099 8.014 8.290 -0.005 0.174 0.527 94 S N -0.322 115.381 115.700 0.003 0.000 2.654 94 S HA 0.150 4.621 4.470 0.001 0.000 0.283 94 S C -0.679 173.919 174.600 -0.004 0.000 1.180 94 S CA -0.973 57.224 58.200 -0.006 0.000 1.021 94 S CB 1.530 64.716 63.200 -0.024 0.000 1.018 94 S HN -0.818 7.449 8.310 -0.004 0.041 0.532 95 V N 3.999 123.906 119.914 -0.012 0.000 2.406 95 V HA 0.308 4.455 4.120 0.045 0.000 0.272 95 V C -1.870 174.237 176.094 0.022 0.000 1.043 95 V CA -2.715 59.597 62.300 0.021 0.000 0.915 95 V CB 0.708 32.550 31.823 0.032 0.000 0.988 95 V HN -0.234 7.935 8.190 -0.035 0.000 0.466 96 P HA 0.306 4.802 4.420 0.128 0.000 0.282 96 P C -1.054 176.471 177.300 0.373 0.000 1.274 96 P CA -0.835 62.366 63.100 0.167 0.000 0.770 96 P CB 0.165 31.896 31.700 0.052 0.000 0.867 97 G N 1.539 110.517 108.800 0.296 0.000 2.600 97 G HA2 0.926 5.324 3.960 0.431 0.000 0.303 97 G HA3 0.926 4.965 3.960 0.131 0.000 0.303 97 G C -2.867 172.039 174.900 0.011 0.000 1.253 97 G CA -1.854 43.405 45.100 0.265 0.000 0.974 97 G HN 0.534 8.932 8.290 0.180 0.000 0.483 98 I N -1.565 118.830 120.570 -0.292 0.000 2.722 98 I HA 0.296 4.227 4.170 -0.398 0.000 0.295 98 I C -2.954 172.957 176.117 -0.343 0.000 1.161 98 I CA -1.641 59.324 61.300 -0.558 0.000 1.032 98 I CB 4.156 41.334 38.000 -1.370 0.000 1.244 98 I HN -0.117 7.981 8.210 -0.188 0.000 0.421 99 Q N 8.163 127.809 119.800 -0.256 0.000 2.331 99 Q HA 0.655 5.100 4.340 -0.198 -0.223 0.257 99 Q C -0.829 175.062 176.000 -0.181 0.000 0.957 99 Q CA -1.850 53.839 55.803 -0.191 0.000 0.923 99 Q CB 2.148 30.799 28.738 -0.144 0.000 1.212 99 Q HN -0.106 8.027 8.270 -0.229 0.000 0.443 100 I N 1.333 121.805 120.570 -0.165 0.000 2.437 100 I HA 0.889 5.140 4.170 -0.156 -0.174 0.298 100 I C -2.254 173.885 176.117 0.036 0.000 0.984 100 I CA -2.280 58.944 61.300 -0.127 0.000 1.214 100 I CB 2.341 40.223 38.000 -0.196 0.000 1.365 100 I HN 0.107 8.208 8.210 -0.182 0.000 0.469 101 A N 2.419 125.210 122.820 -0.048 0.000 2.594 101 A HA 0.457 5.000 4.320 0.372 0.000 0.291 101 A C -2.808 174.800 177.584 0.039 0.000 1.105 101 A CA -0.912 51.207 52.037 0.137 0.000 0.694 101 A CB 3.702 22.777 19.000 0.124 0.000 1.291 101 A HN 0.056 8.098 8.150 -0.180 0.000 0.410 102 H N -0.187 118.970 119.070 0.146 0.000 3.017 102 H HA 0.330 5.029 4.556 0.015 -0.135 0.340 102 H C -1.311 174.084 175.328 0.112 0.000 1.014 102 H CA -0.129 55.991 56.048 0.119 0.000 1.341 102 H CB 3.513 33.455 29.762 0.300 0.000 1.739 102 H HN 0.531 9.058 8.280 0.413 0.000 0.506 103 A N 7.099 129.935 122.820 0.026 0.000 2.206 103 A HA -0.083 4.128 4.320 -0.182 0.000 0.211 103 A C -0.250 177.611 177.584 0.461 0.000 1.158 103 A CA 0.080 52.148 52.037 0.051 0.000 0.761 103 A CB 0.614 19.536 19.000 -0.130 0.000 0.801 103 A HN 0.132 8.042 8.150 -0.192 0.125 0.473 104 G N -1.159 107.998 108.800 0.594 0.000 2.614 104 G HA2 -0.504 3.848 3.960 0.408 0.000 0.303 104 G HA3 -0.504 3.678 3.960 0.371 0.000 0.303 104 G C 0.924 176.013 174.900 0.315 0.000 1.270 104 G CA 1.202 46.559 45.100 0.428 0.000 0.988 104 G HN -0.537 8.278 8.290 0.935 0.035 0.551 105 R N 1.796 122.438 120.500 0.236 0.000 2.280 105 R HA -0.198 4.246 4.340 0.173 0.000 0.207 105 R C 1.231 177.679 176.300 0.246 0.000 1.043 105 R CA 2.162 58.381 56.100 0.198 0.000 1.006 105 R CB -0.481 29.912 30.300 0.155 0.000 0.885 105 R HN 0.447 8.846 8.270 0.216 0.000 0.467 106 K N -1.566 118.978 120.400 0.240 0.000 2.476 106 K HA -0.057 4.247 4.320 -0.028 0.000 0.196 106 K C -0.465 176.266 176.600 0.218 0.000 1.025 106 K CA -0.163 56.211 56.287 0.146 0.000 1.138 106 K CB -0.684 31.888 32.500 0.121 0.000 0.860 106 K HN -0.614 7.778 8.250 0.299 0.037 0.515 107 A N -0.898 122.076 122.820 0.255 0.000 2.280 107 A HA 0.074 4.574 4.320 0.174 -0.076 0.268 107 A C -0.753 176.791 177.584 -0.065 0.000 1.111 107 A CA -1.003 51.139 52.037 0.175 0.000 0.814 107 A CB 1.876 21.080 19.000 0.341 0.000 1.093 107 A HN -0.647 7.605 8.150 0.279 0.065 0.498 108 S N -4.357 111.018 115.700 -0.542 0.000 3.706 108 S HA -0.488 2.775 4.470 -2.012 0.000 0.363 108 S C -1.598 172.754 174.600 -0.413 0.000 0.999 108 S CA 0.116 57.578 58.200 -1.231 0.000 1.143 108 S CB -1.023 61.242 63.200 -1.558 0.000 0.902 108 S HN 0.346 8.449 8.310 -0.345 0.000 0.476 109 A N -0.706 121.991 122.820 -0.205 0.000 2.320 109 A HA 0.578 4.994 4.320 -0.062 -0.133 0.334 109 A C -0.947 176.566 177.584 -0.117 0.000 1.147 109 A CA -2.016 49.961 52.037 -0.100 0.000 0.820 109 A CB 2.942 21.888 19.000 -0.090 0.000 1.218 109 A HN 0.017 8.057 8.150 -0.183 0.000 0.482 110 N N 0.349 118.976 118.700 -0.121 0.000 2.416 110 N HA -0.106 4.545 4.740 -0.149 0.000 0.246 110 N C 0.615 175.964 175.510 -0.268 0.000 1.260 110 N CA 0.960 53.912 53.050 -0.163 0.000 0.897 110 N CB 0.902 39.300 38.487 -0.148 0.000 1.110 110 N HN 0.034 8.351 8.380 -0.104 0.000 0.439 111 R N 1.099 121.351 120.500 -0.414 0.000 2.756 111 R HA -0.064 3.732 4.340 -0.907 0.000 0.264 111 R C -0.669 175.127 176.300 -0.841 0.000 1.026 111 R CA 0.887 56.476 56.100 -0.852 0.000 1.121 111 R CB -1.033 28.559 30.300 -1.180 0.000 0.999 111 R HN 0.328 8.384 8.270 -0.357 0.000 0.449 112 P HA -0.056 4.349 4.420 -0.348 -0.194 0.220 112 P C 0.275 177.448 177.300 -0.211 0.000 1.148 112 P CA 2.418 65.235 63.100 -0.471 0.000 0.803 112 P CB 0.237 31.723 31.700 -0.357 0.000 0.782 113 W N -5.670 115.497 121.300 -0.221 0.000 3.353 113 W HA 0.271 4.853 4.660 -0.131 0.000 0.304 113 W C -0.327 176.121 176.519 -0.118 0.000 1.273 113 W CA -0.522 56.733 57.345 -0.149 0.000 1.773 113 W CB -0.659 28.717 29.460 -0.140 0.000 1.095 113 W HN -0.055 7.668 8.180 -0.732 0.018 0.676 114 E N -0.060 120.003 120.200 -0.228 0.000 2.789 114 E HA 0.199 4.513 4.350 -0.060 0.000 0.208 114 E C -0.381 176.140 176.600 -0.132 0.000 0.988 114 E CA -1.192 55.110 56.400 -0.164 0.000 1.092 114 E CB 0.031 29.581 29.700 -0.251 0.000 1.066 114 E HN -0.544 7.398 8.360 -0.387 0.187 0.465 115 G N -1.936 106.800 108.800 -0.106 0.000 2.352 115 G HA2 -0.283 3.644 3.960 -0.055 0.000 0.204 115 G HA3 -0.283 3.636 3.960 -0.069 0.000 0.204 115 G C -0.317 174.530 174.900 -0.089 0.000 1.004 115 G CA -0.215 44.838 45.100 -0.078 0.000 0.648 115 G HN -0.479 7.753 8.290 -0.097 0.000 0.491 116 D N -2.522 117.794 120.400 -0.140 0.000 3.067 116 D HA -0.399 4.275 4.640 -0.170 -0.136 0.216 116 D C -1.421 174.875 176.300 -0.007 0.000 1.162 116 D CA 1.512 55.440 54.000 -0.120 0.000 0.960 116 D CB -0.537 40.178 40.800 -0.141 0.000 1.129 116 D HN -0.322 7.934 8.370 -0.191 0.000 0.408 117 D N -5.758 114.633 120.400 -0.016 0.000 2.392 117 D HA 0.076 4.853 4.640 0.070 -0.095 0.246 117 D C -0.632 175.644 176.300 -0.041 0.000 1.013 117 D CA -1.506 52.503 54.000 0.015 0.000 0.993 117 D CB 1.648 42.472 40.800 0.041 0.000 1.219 117 D HN -0.683 7.606 8.370 -0.049 0.052 0.538 118 H N -1.156 117.870 119.070 -0.074 0.000 3.001 118 H HA -0.231 4.346 4.556 -0.164 -0.119 0.334 118 H C 0.674 175.928 175.328 -0.125 0.000 1.034 118 H CA 1.383 57.355 56.048 -0.128 0.000 1.420 118 H CB 0.617 30.305 29.762 -0.123 0.000 1.405 118 H HN -0.353 7.883 8.280 -0.072 0.000 0.593 119 I N 3.474 124.032 120.570 -0.021 0.000 2.648 119 I HA -0.184 3.951 4.170 -0.058 0.000 0.284 119 I C -0.343 175.731 176.117 -0.072 0.000 1.153 119 I CA 0.491 61.743 61.300 -0.079 0.000 1.426 119 I CB 0.526 38.436 38.000 -0.150 0.000 1.381 119 I HN -0.277 7.902 8.210 -0.053 0.000 0.571 120 A N 6.853 129.645 122.820 -0.046 0.000 2.507 120 A HA -0.136 4.164 4.320 -0.032 0.000 0.235 120 A C 0.844 178.398 177.584 -0.049 0.000 1.070 120 A CA 0.315 52.330 52.037 -0.037 0.000 0.768 120 A CB 0.831 19.817 19.000 -0.022 0.000 1.011 120 A HN 0.268 8.395 8.150 -0.039 0.000 0.502 121 A N -0.159 122.635 122.820 -0.044 0.000 2.019 121 A HA -0.178 4.106 4.320 -0.060 0.000 0.219 121 A C -0.163 177.405 177.584 -0.027 0.000 1.164 121 A CA 2.198 54.209 52.037 -0.044 0.000 0.644 121 A CB -0.101 18.877 19.000 -0.036 0.000 0.805 121 A HN 0.445 8.573 8.150 -0.036 0.000 0.449 122 D N -6.127 114.262 120.400 -0.019 0.000 2.501 122 D HA 0.031 4.668 4.640 -0.005 0.000 0.226 122 D C -1.231 175.067 176.300 -0.004 0.000 1.198 122 D CA -1.424 52.571 54.000 -0.008 0.000 0.830 122 D CB -0.710 40.086 40.800 -0.005 0.000 1.014 122 D HN -0.326 8.005 8.370 -0.019 0.027 0.496 123 D N 0.670 121.065 120.400 -0.009 0.000 2.280 123 D HA 0.143 4.785 4.640 0.003 0.000 0.243 123 D C 0.984 177.291 176.300 0.013 0.000 1.129 123 D CA -0.570 53.429 54.000 -0.001 0.000 0.848 123 D CB 1.610 42.401 40.800 -0.014 0.000 1.107 123 D HN -0.667 7.634 8.370 -0.018 0.058 0.471 124 T N 2.548 117.117 114.554 0.026 0.000 3.098 124 T HA -0.095 4.279 4.350 0.040 0.000 0.266 124 T C 1.262 176.004 174.700 0.071 0.000 1.145 124 T CA 1.786 63.911 62.100 0.042 0.000 1.092 124 T CB -0.020 68.871 68.868 0.038 0.000 0.908 124 T HN 0.482 8.736 8.240 0.023 0.000 0.526 125 R N 0.691 121.235 120.500 0.074 0.000 2.200 125 R HA 0.015 4.444 4.340 0.149 0.000 0.208 125 R C 0.836 177.256 176.300 0.199 0.000 1.033 125 R CA 1.122 57.298 56.100 0.128 0.000 1.000 125 R CB 0.536 30.894 30.300 0.098 0.000 0.906 125 R HN -0.330 8.234 8.270 0.050 -0.264 0.462 126 G N -2.261 106.590 108.800 0.086 0.000 2.580 126 G HA2 0.106 3.957 3.960 -0.181 0.000 0.278 126 G HA3 0.106 3.993 3.960 -0.122 0.000 0.278 126 G C -1.522 173.493 174.900 0.192 0.000 1.212 126 G CA -0.679 44.408 45.100 -0.022 0.000 0.939 126 G HN -0.637 7.648 8.290 0.047 0.034 0.513 127 W N -3.727 117.546 121.300 -0.045 0.000 3.066 127 W HA 0.304 4.934 4.660 -0.050 0.000 0.330 127 W C -2.235 174.245 176.519 -0.065 0.000 1.253 127 W CA -2.067 55.245 57.345 -0.055 0.000 1.187 127 W CB 0.950 30.372 29.460 -0.064 0.000 1.434 127 W HN -0.323 7.587 8.180 -0.450 0.000 0.572 128 E N 1.820 122.139 120.200 0.198 0.000 2.360 128 E HA -0.033 4.304 4.350 -0.021 0.000 0.269 128 E C -0.765 175.949 176.600 0.189 0.000 1.022 128 E CA -0.237 56.216 56.400 0.088 0.000 0.887 128 E CB 1.687 31.431 29.700 0.073 0.000 0.990 128 E HN 0.049 8.547 8.360 0.230 0.000 0.426 129 T N -0.249 114.341 114.554 0.060 0.000 2.934 129 T HA 0.193 4.695 4.350 0.253 0.000 0.283 129 T C -0.934 173.834 174.700 0.113 0.000 1.005 129 T CA -1.575 60.603 62.100 0.130 0.000 1.041 129 T CB 1.695 70.589 68.868 0.044 0.000 1.042 129 T HN -0.102 8.120 8.240 -0.031 0.000 0.505 130 I N -5.927 114.738 120.570 0.157 0.000 2.785 130 I HA 0.963 5.334 4.170 0.045 -0.174 0.302 130 I C -2.392 173.751 176.117 0.044 0.000 1.069 130 I CA -2.288 59.062 61.300 0.083 0.000 1.045 130 I CB 4.158 42.203 38.000 0.075 0.000 1.236 130 I HN 0.129 8.478 8.210 0.232 0.000 0.429 131 A N 1.046 123.833 122.820 -0.055 0.000 2.540 131 A HA 0.524 4.739 4.320 -0.175 0.000 0.291 131 A C -3.248 174.131 177.584 -0.341 0.000 1.083 131 A CA -0.783 51.156 52.037 -0.163 0.000 0.650 131 A CB 1.345 20.295 19.000 -0.084 0.000 1.292 131 A HN 0.106 8.218 8.150 -0.065 0.000 0.435 132 P HA -0.100 3.856 4.420 -0.772 0.000 0.221 132 P C -0.537 176.571 177.300 -0.319 0.000 1.150 132 P CA 1.873 64.511 63.100 -0.769 0.000 0.800 132 P CB 0.656 31.659 31.700 -1.161 0.000 0.787 133 S N -2.558 113.005 115.700 -0.227 0.000 2.546 133 S HA 0.210 4.621 4.470 -0.098 0.000 0.274 133 S C -1.362 173.192 174.600 -0.077 0.000 1.121 133 S CA -1.571 56.557 58.200 -0.119 0.000 0.887 133 S CB 3.075 66.216 63.200 -0.098 0.000 1.094 133 S HN -0.449 7.698 8.310 -0.237 0.021 0.474 134 A N 4.874 127.665 122.820 -0.048 0.000 3.026 134 A HA 0.066 4.539 4.320 -0.028 -0.170 0.272 134 A C -0.935 176.638 177.584 -0.019 0.000 1.782 134 A CA -0.187 51.832 52.037 -0.029 0.000 1.451 134 A CB -1.056 17.931 19.000 -0.023 0.000 1.081 134 A HN 0.670 8.793 8.150 -0.045 0.000 0.611 135 I N 0.005 120.567 120.570 -0.013 0.000 2.534 135 I HA 0.191 4.360 4.170 -0.002 0.000 0.288 135 I C -2.378 173.755 176.117 0.026 0.000 1.077 135 I CA -0.795 60.505 61.300 -0.001 0.000 1.051 135 I CB 3.502 41.497 38.000 -0.008 0.000 1.234 135 I HN -0.483 7.675 8.210 -0.015 0.042 0.425 136 A N 7.587 130.429 122.820 0.035 0.000 2.371 136 A HA 0.053 4.441 4.320 0.114 0.000 0.257 136 A C -0.712 176.929 177.584 0.095 0.000 1.089 136 A CA -0.069 52.018 52.037 0.084 0.000 0.794 136 A CB 0.664 19.710 19.000 0.077 0.000 1.029 136 A HN -0.053 8.110 8.150 0.021 0.000 0.488 137 F N 3.995 123.945 119.950 0.000 0.000 2.126 137 F HA -0.393 4.118 4.527 -0.027 0.000 0.299 137 F C 0.707 176.480 175.800 -0.045 0.000 1.096 137 F CA 2.240 60.220 58.000 -0.034 0.000 1.255 137 F CB 0.994 39.948 39.000 -0.077 0.000 0.997 137 F HN 0.340 8.833 8.300 0.320 0.000 0.479 138 G N -3.528 105.330 108.800 0.097 0.000 2.548 138 G HA2 -0.319 3.667 3.960 0.043 0.000 0.208 138 G HA3 -0.319 3.598 3.960 -0.073 0.000 0.208 138 G C -1.837 173.135 174.900 0.120 0.000 1.308 138 G CA -1.073 44.043 45.100 0.027 0.000 0.924 138 G HN -0.786 7.610 8.290 0.194 0.011 0.540 139 A N -0.913 121.956 122.820 0.081 0.000 5.391 139 A HA -0.292 4.103 4.320 0.125 0.000 0.315 139 A C -0.571 177.111 177.584 0.163 0.000 1.874 139 A CA 2.151 54.285 52.037 0.162 0.000 0.714 139 A CB -1.876 17.306 19.000 0.304 0.000 1.335 139 A HN 0.355 8.527 8.150 0.037 0.000 0.382 140 H N -1.814 117.315 119.070 0.099 0.000 2.555 140 H HA -0.057 4.510 4.556 0.017 0.000 0.269 140 H C -0.759 174.537 175.328 -0.053 0.000 0.988 140 H CA 1.171 57.228 56.048 0.016 0.000 1.178 140 H CB 0.098 29.848 29.762 -0.020 0.000 1.373 140 H HN 0.042 8.633 8.280 0.519 0.000 0.588 141 L N 0.679 121.661 121.223 -0.401 0.000 2.599 141 L HA 0.634 4.578 4.340 -0.659 0.000 0.241 141 L C -2.201 174.734 176.870 0.108 0.000 1.207 141 L CA -2.868 51.691 54.840 -0.469 0.000 0.987 141 L CB -0.068 41.475 42.059 -0.860 0.000 1.318 141 L HN -0.112 7.896 8.230 -0.282 0.052 0.458 142 P HA 0.010 4.508 4.420 0.130 0.000 0.240 142 P C -0.437 176.953 177.300 0.151 0.000 1.190 142 P CA -0.348 62.850 63.100 0.163 0.000 0.781 142 P CB 0.086 31.843 31.700 0.096 0.000 0.931 143 K N 0.710 121.213 120.400 0.171 0.000 2.448 143 K HA -0.204 4.066 4.320 -0.083 0.000 0.278 143 K C -0.603 175.978 176.600 -0.032 0.000 1.009 143 K CA 0.700 56.921 56.287 -0.110 0.000 0.995 143 K CB 0.103 32.281 32.500 -0.538 0.000 0.917 143 K HN -0.494 8.038 8.250 0.471 0.000 0.481 144 V N 3.846 123.738 119.914 -0.037 0.000 2.455 144 V HA 0.008 4.134 4.120 0.011 0.000 0.273 144 V C -0.913 175.162 176.094 -0.032 0.000 1.045 144 V CA -3.412 58.879 62.300 -0.014 0.000 0.976 144 V CB -0.786 31.028 31.823 -0.014 0.000 0.993 144 V HN 0.123 8.285 8.190 -0.046 0.000 0.475 145 P HA 0.158 4.567 4.420 -0.019 0.000 0.274 145 P C -1.314 175.978 177.300 -0.013 0.000 1.246 145 P CA -1.136 61.958 63.100 -0.009 0.000 0.795 145 P CB 1.297 33.007 31.700 0.016 0.000 1.006 146 R N -0.133 120.364 120.500 -0.005 0.000 2.340 146 R HA 0.052 4.385 4.340 -0.012 0.000 0.300 146 R C -1.002 175.286 176.300 -0.021 0.000 1.069 146 R CA -0.842 55.253 56.100 -0.008 0.000 0.984 146 R CB 1.449 31.752 30.300 0.005 0.000 1.003 146 R HN -0.110 8.164 8.270 0.006 0.000 0.459 147 E N 6.560 126.743 120.200 -0.028 0.000 2.415 147 E HA -0.162 4.282 4.350 -0.068 -0.135 0.260 147 E C -0.244 176.337 176.600 -0.031 0.000 1.016 147 E CA 0.521 56.895 56.400 -0.043 0.000 0.924 147 E CB 0.392 30.072 29.700 -0.033 0.000 0.961 147 E HN 0.290 8.636 8.360 -0.023 0.000 0.459 148 M N 8.846 128.420 119.600 -0.045 0.000 2.239 148 M HA -0.128 4.502 4.480 -0.014 -0.158 0.348 148 M C 0.968 177.265 176.300 -0.005 0.000 1.239 148 M CA 1.806 57.094 55.300 -0.019 0.000 1.114 148 M CB 0.574 33.169 32.600 -0.007 0.000 1.641 148 M HN 0.126 8.370 8.290 -0.077 0.000 0.453 149 T N 2.417 116.969 114.554 -0.003 0.000 2.849 149 T HA 0.169 4.526 4.350 0.011 0.000 0.284 149 T C 0.874 175.568 174.700 -0.011 0.000 1.004 149 T CA -1.281 60.820 62.100 0.003 0.000 1.021 149 T CB 1.849 70.721 68.868 0.006 0.000 1.013 149 T HN 0.379 8.941 8.240 -0.003 -0.324 0.527 150 L N 0.093 121.318 121.223 0.003 0.000 2.083 150 L HA -0.379 3.925 4.340 -0.059 0.000 0.209 150 L C 1.894 178.754 176.870 -0.017 0.000 1.083 150 L CA 3.617 58.451 54.840 -0.010 0.000 0.752 150 L CB -0.482 41.606 42.059 0.049 0.000 0.899 150 L HN 0.230 8.472 8.230 0.020 0.000 0.433 151 D N -1.787 118.614 120.400 0.001 0.000 2.144 151 D HA -0.290 4.355 4.640 0.009 0.000 0.200 151 D C 1.988 178.288 176.300 -0.000 0.000 0.978 151 D CA 3.422 57.425 54.000 0.005 0.000 0.833 151 D CB -0.287 40.519 40.800 0.011 0.000 0.961 151 D HN -0.262 8.108 8.370 0.007 0.003 0.470 152 D N -0.131 120.266 120.400 -0.006 0.000 2.144 152 D HA -0.254 4.390 4.640 0.007 0.000 0.199 152 D C 2.585 178.880 176.300 -0.009 0.000 0.984 152 D CA 3.467 57.465 54.000 -0.003 0.000 0.834 152 D CB -0.178 40.618 40.800 -0.007 0.000 0.955 152 D HN -0.442 7.841 8.370 -0.007 0.083 0.465 153 I N -0.542 119.994 120.570 -0.055 0.000 2.252 153 I HA -0.423 3.709 4.170 -0.065 0.000 0.245 153 I C 1.634 177.742 176.117 -0.015 0.000 1.102 153 I CA 3.966 65.206 61.300 -0.100 0.000 1.385 153 I CB -0.188 37.589 38.000 -0.371 0.000 1.064 153 I HN -0.492 7.568 8.210 -0.071 0.108 0.414 154 A N -0.298 122.512 122.820 -0.017 0.000 1.902 154 A HA -0.373 3.957 4.320 0.016 0.000 0.217 154 A C 1.623 179.233 177.584 0.044 0.000 1.181 154 A CA 3.366 55.413 52.037 0.017 0.000 0.623 154 A CB -0.858 18.153 19.000 0.019 0.000 0.818 154 A HN -0.192 7.940 8.150 -0.029 0.000 0.443 155 R N -1.572 118.954 120.500 0.043 0.000 2.073 155 R HA -0.248 4.123 4.340 0.052 0.000 0.234 155 R C 2.220 178.579 176.300 0.098 0.000 1.134 155 R CA 2.387 58.521 56.100 0.056 0.000 0.952 155 R CB -0.610 29.712 30.300 0.038 0.000 0.850 155 R HN -0.349 7.938 8.270 0.029 0.000 0.433 156 V N -0.654 119.339 119.914 0.132 0.000 2.379 156 V HA -0.347 3.900 4.120 0.212 0.000 0.245 156 V C 2.081 178.385 176.094 0.350 0.000 1.044 156 V CA 2.836 65.279 62.300 0.238 0.000 1.036 156 V CB -0.684 31.280 31.823 0.235 0.000 0.664 156 V HN -0.135 8.120 8.190 0.108 0.000 0.453 157 K N -0.124 120.419 120.400 0.237 0.000 2.044 157 K HA -0.424 3.970 4.320 0.123 0.000 0.210 157 K C 2.572 179.268 176.600 0.160 0.000 1.049 157 K CA 3.851 60.218 56.287 0.133 0.000 0.927 157 K CB -0.489 32.001 32.500 -0.016 0.000 0.713 157 K HN -0.425 7.942 8.250 0.196 0.000 0.443 158 Q N -1.490 118.381 119.800 0.119 0.000 2.167 158 Q HA -0.259 4.133 4.340 0.087 0.000 0.202 158 Q C 1.967 178.034 176.000 0.112 0.000 0.970 158 Q CA 2.489 58.350 55.803 0.097 0.000 0.855 158 Q CB -0.721 28.058 28.738 0.069 0.000 0.911 158 Q HN -0.443 7.889 8.270 0.104 0.000 0.438 159 D N 0.593 121.069 120.400 0.127 0.000 2.144 159 D HA -0.225 4.452 4.640 0.061 0.000 0.199 159 D C 2.386 178.713 176.300 0.045 0.000 0.984 159 D CA 3.398 57.444 54.000 0.075 0.000 0.834 159 D CB -0.519 40.316 40.800 0.059 0.000 0.955 159 D HN -0.347 8.021 8.370 0.146 0.090 0.465 160 F N -0.331 119.654 119.950 0.058 0.000 2.134 160 F HA -0.426 4.118 4.527 0.029 0.000 0.299 160 F C 1.946 177.746 175.800 0.000 0.000 1.097 160 F CA 4.151 62.165 58.000 0.024 0.000 1.264 160 F CB -0.142 38.862 39.000 0.006 0.000 1.001 160 F HN -0.384 8.078 8.300 0.402 0.079 0.479 161 V N -0.354 119.670 119.914 0.184 0.000 2.255 161 V HA -0.586 3.600 4.120 0.110 0.000 0.247 161 V C 1.877 178.027 176.094 0.093 0.000 1.051 161 V CA 3.883 66.250 62.300 0.113 0.000 1.018 161 V CB -1.093 30.783 31.823 0.087 0.000 0.641 161 V HN -0.374 7.934 8.190 0.197 0.000 0.445 162 D N -0.572 119.876 120.400 0.080 0.000 2.117 162 D HA -0.305 4.378 4.640 0.072 0.000 0.197 162 D C 2.341 178.674 176.300 0.056 0.000 0.987 162 D CA 3.484 57.525 54.000 0.068 0.000 0.829 162 D CB -0.669 40.170 40.800 0.065 0.000 0.961 162 D HN -0.086 8.334 8.370 0.083 0.000 0.460 163 A N -0.127 122.706 122.820 0.022 0.000 1.933 163 A HA -0.191 4.120 4.320 -0.015 0.000 0.218 163 A C 1.670 179.254 177.584 -0.000 0.000 1.175 163 A CA 2.958 54.981 52.037 -0.024 0.000 0.628 163 A CB -0.466 18.460 19.000 -0.124 0.000 0.814 163 A HN -0.154 8.006 8.150 0.015 0.000 0.444 164 A N -1.473 121.370 122.820 0.038 0.000 1.930 164 A HA -0.255 4.078 4.320 0.022 0.000 0.217 164 A C 1.850 179.580 177.584 0.243 0.000 1.175 164 A CA 2.937 55.032 52.037 0.097 0.000 0.627 164 A CB -0.910 18.147 19.000 0.095 0.000 0.815 164 A HN -0.204 7.976 8.150 0.051 0.000 0.443 165 R N -1.560 119.043 120.500 0.172 0.000 2.096 165 R HA -0.276 4.166 4.340 0.170 0.000 0.235 165 R C 2.260 178.645 176.300 0.142 0.000 1.127 165 R CA 2.831 59.022 56.100 0.151 0.000 0.968 165 R CB -0.334 30.026 30.300 0.101 0.000 0.861 165 R HN -0.130 8.221 8.270 0.134 0.000 0.440 166 R N -2.214 118.360 120.500 0.123 0.000 2.075 166 R HA -0.275 4.135 4.340 0.117 0.000 0.232 166 R C 2.247 178.654 176.300 0.179 0.000 1.126 166 R CA 3.314 59.488 56.100 0.124 0.000 0.963 166 R CB -0.231 30.127 30.300 0.096 0.000 0.858 166 R HN -0.193 8.139 8.270 0.104 0.000 0.435 167 A N -0.499 122.434 122.820 0.188 0.000 1.877 167 A HA -0.371 4.170 4.320 0.369 0.000 0.216 167 A C 1.311 179.189 177.584 0.490 0.000 1.186 167 A CA 3.252 55.477 52.037 0.313 0.000 0.620 167 A CB -0.726 18.325 19.000 0.085 0.000 0.822 167 A HN 0.002 8.233 8.150 0.136 0.000 0.443 168 R N -1.254 119.515 120.500 0.448 0.000 2.094 168 R HA -0.331 4.087 4.340 0.131 0.000 0.239 168 R C 2.537 178.897 176.300 0.099 0.000 1.137 168 R CA 3.222 59.437 56.100 0.191 0.000 0.943 168 R CB -0.124 30.201 30.300 0.042 0.000 0.850 168 R HN -0.177 8.374 8.270 0.469 0.000 0.433 169 D N -0.465 119.999 120.400 0.106 0.000 2.269 169 D HA -0.104 4.554 4.640 0.029 0.000 0.208 169 D C 1.327 177.669 176.300 0.069 0.000 0.963 169 D CA 2.398 56.436 54.000 0.063 0.000 0.864 169 D CB -0.477 40.358 40.800 0.059 0.000 0.936 169 D HN -0.459 7.990 8.370 0.132 0.000 0.505 170 A N -3.092 119.801 122.820 0.122 0.000 2.206 170 A HA 0.052 4.411 4.320 0.065 0.000 0.211 170 A C 0.191 177.744 177.584 -0.052 0.000 1.158 170 A CA 0.449 52.535 52.037 0.082 0.000 0.761 170 A CB 0.263 19.376 19.000 0.189 0.000 0.801 170 A HN -0.194 8.043 8.150 0.182 0.021 0.473 171 G N -4.721 104.071 108.800 -0.014 0.000 2.159 171 G HA2 -0.317 3.624 3.960 -0.031 0.000 0.227 171 G HA3 -0.317 3.577 3.960 -0.109 0.000 0.227 171 G C -0.353 174.506 174.900 -0.068 0.000 0.986 171 G CA -0.324 44.736 45.100 -0.067 0.000 0.651 171 G HN -0.490 7.676 8.290 0.061 0.161 0.523 172 F N 0.944 120.965 119.950 0.119 0.000 2.563 172 F HA -0.326 4.292 4.527 0.150 0.000 0.363 172 F C -0.005 175.958 175.800 0.271 0.000 1.123 172 F CA 2.098 60.213 58.000 0.193 0.000 1.307 172 F CB 0.134 39.263 39.000 0.216 0.000 1.115 172 F HN -0.777 7.628 8.300 0.175 0.000 0.592 173 E N 0.115 120.605 120.200 0.485 0.000 2.538 173 E HA 0.085 4.602 4.350 0.278 0.000 0.207 173 E C -1.626 175.354 176.600 0.633 0.000 1.002 173 E CA -0.235 56.406 56.400 0.402 0.000 0.952 173 E CB 1.643 31.497 29.700 0.256 0.000 1.031 173 E HN 0.157 8.810 8.360 0.488 0.000 0.476 174 W N -2.021 119.582 121.300 0.506 0.000 3.827 174 W HA 0.119 5.120 4.660 0.335 -0.140 0.307 174 W C -3.001 173.514 176.519 -0.006 0.000 1.204 174 W CA -0.270 57.242 57.345 0.278 0.000 1.250 174 W CB 2.085 31.637 29.460 0.152 0.000 1.281 174 W HN -0.833 7.782 8.180 0.820 0.057 0.494 175 I N 5.790 126.147 120.570 -0.354 0.000 2.646 175 I HA 0.596 4.672 4.170 -0.410 -0.152 0.299 175 I C -2.919 172.915 176.117 -0.471 0.000 1.036 175 I CA -2.434 58.487 61.300 -0.633 0.000 1.074 175 I CB 4.260 41.369 38.000 -1.486 0.000 1.258 175 I HN 0.024 7.908 8.210 -0.543 0.000 0.430 176 E N 7.443 127.449 120.200 -0.323 0.000 2.244 176 E HA 0.437 4.682 4.350 -0.318 -0.085 0.260 176 E C -1.855 174.557 176.600 -0.313 0.000 0.884 176 E CA -2.083 54.158 56.400 -0.265 0.000 0.777 176 E CB 3.708 33.359 29.700 -0.082 0.000 1.197 176 E HN 0.190 8.362 8.360 -0.315 0.000 0.416 177 L N 5.954 126.907 121.223 -0.450 0.000 2.319 177 L HA 0.092 4.253 4.340 -0.298 0.000 0.280 177 L C -0.986 175.613 176.870 -0.452 0.000 1.099 177 L CA -0.526 53.983 54.840 -0.552 0.000 0.828 177 L CB 0.672 42.051 42.059 -1.133 0.000 1.150 177 L HN 0.275 8.192 8.230 -0.523 0.000 0.442 178 H N 5.784 124.740 119.070 -0.190 0.000 3.014 178 H HA 0.135 4.708 4.556 0.029 0.000 0.266 178 H C -1.194 174.339 175.328 0.340 0.000 1.455 178 H CA -1.469 54.622 56.048 0.073 0.000 1.402 178 H CB -0.494 29.374 29.762 0.177 0.000 1.626 178 H HN 0.116 8.490 8.280 0.156 0.000 0.520 179 F N 5.130 125.334 119.950 0.424 0.000 2.750 179 F HA 0.101 4.842 4.527 0.357 0.000 0.297 179 F C -1.467 174.625 175.800 0.487 0.000 1.138 179 F CA -2.831 55.392 58.000 0.373 0.000 1.346 179 F CB -1.683 37.442 39.000 0.208 0.000 0.965 179 F HN -0.258 8.276 8.300 0.389 0.000 0.514 180 A N -1.736 121.464 122.820 0.633 0.000 2.414 180 A HA 0.751 5.584 4.320 0.431 -0.255 0.278 180 A C -0.950 176.831 177.584 0.329 0.000 1.228 180 A CA -2.371 49.910 52.037 0.406 0.000 0.857 180 A CB 2.870 21.943 19.000 0.122 0.000 1.389 180 A HN -0.647 7.904 8.150 0.780 0.067 0.452 181 H N -4.716 114.562 119.070 0.347 0.000 2.862 181 H HA -0.447 4.473 4.556 0.467 -0.084 0.290 181 H C 0.034 175.121 175.328 -0.402 0.000 1.211 181 H CA 0.384 56.517 56.048 0.143 0.000 1.140 181 H CB -2.007 27.834 29.762 0.132 0.000 1.341 181 H HN 0.581 9.225 8.280 0.606 0.000 0.392 182 G N -5.765 103.056 108.800 0.035 0.000 2.179 182 G HA2 -0.498 3.561 3.960 0.166 0.000 0.260 182 G HA3 -0.498 3.603 3.960 0.009 -0.137 0.260 182 G C -0.653 174.245 174.900 -0.003 0.000 0.977 182 G CA 0.414 45.532 45.100 0.029 0.000 0.641 182 G HN -0.210 8.155 8.290 0.194 0.042 0.533 183 F N -1.976 118.094 119.950 0.200 0.000 2.239 183 F HA 0.092 4.864 4.527 0.157 -0.151 0.288 183 F C 1.128 177.066 175.800 0.231 0.000 1.225 183 F CA -1.430 56.667 58.000 0.163 0.000 1.162 183 F CB 0.003 39.025 39.000 0.037 0.000 1.484 183 F HN -0.898 7.303 8.300 -0.064 0.060 0.512 184 L N 0.513 122.047 121.223 0.517 0.000 1.971 184 L HA -0.228 4.266 4.340 0.255 0.000 0.215 184 L C 2.398 179.516 176.870 0.413 0.000 1.072 184 L CA 3.503 58.567 54.840 0.373 0.000 0.758 184 L CB -0.076 42.185 42.059 0.337 0.000 0.889 184 L HN -0.044 8.537 8.230 0.584 0.000 0.433 185 G N -5.378 103.742 108.800 0.534 0.000 2.421 185 G HA2 -0.499 3.761 3.960 0.501 0.000 0.216 185 G HA3 -0.499 3.693 3.960 0.388 0.000 0.216 185 G C 0.974 176.124 174.900 0.417 0.000 1.171 185 G CA 2.172 47.544 45.100 0.454 0.000 0.775 185 G HN 0.331 8.987 8.290 0.611 0.000 0.543 186 Q N 1.006 121.084 119.800 0.463 0.000 2.124 186 Q HA -0.299 4.395 4.340 0.589 0.000 0.202 186 Q C 2.028 178.267 176.000 0.399 0.000 0.977 186 Q CA 2.519 58.610 55.803 0.480 0.000 0.850 186 Q CB -0.350 28.631 28.738 0.404 0.000 0.901 186 Q HN 0.126 8.683 8.270 0.478 0.000 0.429 187 S N -1.526 114.350 115.700 0.293 0.000 2.481 187 S HA -0.094 4.478 4.470 0.171 0.000 0.231 187 S C 1.111 175.740 174.600 0.047 0.000 0.996 187 S CA 2.384 60.676 58.200 0.152 0.000 0.942 187 S CB -0.000 63.243 63.200 0.072 0.000 0.768 187 S HN -0.428 8.049 8.310 0.299 0.013 0.520 188 F N 0.225 120.232 119.950 0.095 0.000 2.163 188 F HA -0.303 4.231 4.527 0.012 0.000 0.297 188 F C 1.537 177.421 175.800 0.140 0.000 1.094 188 F CA 3.643 61.681 58.000 0.064 0.000 1.290 188 F CB 0.360 39.375 39.000 0.024 0.000 1.017 188 F HN -0.761 7.672 8.300 0.383 0.096 0.483 189 F N -1.239 118.866 119.950 0.259 0.000 2.206 189 F HA -0.255 4.498 4.527 0.158 -0.132 0.298 189 F C -0.136 175.767 175.800 0.171 0.000 1.090 189 F CA 1.381 59.507 58.000 0.209 0.000 1.323 189 F CB 1.065 40.247 39.000 0.304 0.000 1.028 189 F HN -0.949 7.693 8.300 0.570 0.000 0.492 190 S N -1.478 114.310 115.700 0.147 0.000 2.499 190 S HA -0.040 4.400 4.470 -0.050 0.000 0.275 190 S C 0.865 175.432 174.600 -0.055 0.000 1.257 190 S CA -1.042 57.180 58.200 0.037 0.000 1.050 190 S CB 0.701 64.016 63.200 0.191 0.000 0.937 190 S HN -0.590 7.878 8.310 0.263 0.000 0.490 191 E N 9.091 129.192 120.200 -0.165 0.000 2.265 191 E HA -0.308 3.961 4.350 -0.135 0.000 0.196 191 E C 1.997 178.511 176.600 -0.143 0.000 0.996 191 E CA 3.020 59.313 56.400 -0.177 0.000 0.832 191 E CB -0.322 29.238 29.700 -0.233 0.000 0.756 191 E HN 0.746 8.976 8.360 -0.216 0.000 0.491 192 H N -1.785 117.260 119.070 -0.043 0.000 2.389 192 H HA -0.146 4.383 4.556 -0.046 0.000 0.299 192 H C 1.771 177.075 175.328 -0.040 0.000 1.081 192 H CA 3.087 59.111 56.048 -0.040 0.000 1.345 192 H CB 0.142 29.884 29.762 -0.033 0.000 1.393 192 H HN -0.390 7.806 8.280 -0.077 0.037 0.520 193 S N -4.241 111.517 115.700 0.096 0.000 2.505 193 S HA -0.054 4.432 4.470 0.027 0.000 0.216 193 S C 0.116 174.683 174.600 -0.056 0.000 1.018 193 S CA 0.060 58.275 58.200 0.026 0.000 0.911 193 S CB 1.540 64.769 63.200 0.048 0.000 0.818 193 S HN -0.688 7.662 8.310 0.097 0.018 0.497 194 N N 1.902 120.564 118.700 -0.062 0.000 2.501 194 N HA 0.070 4.718 4.740 -0.154 0.000 0.245 194 N C -1.222 174.249 175.510 -0.066 0.000 0.974 194 N CA -0.612 52.377 53.050 -0.101 0.000 0.941 194 N CB 0.494 38.934 38.487 -0.079 0.000 1.122 194 N HN -0.593 7.763 8.380 -0.039 0.000 0.507 195 K N 4.483 124.847 120.400 -0.061 0.000 2.537 195 K HA 0.330 4.626 4.320 -0.039 0.000 0.206 195 K C 0.374 176.959 176.600 -0.025 0.000 1.041 195 K CA -2.161 54.102 56.287 -0.040 0.000 1.090 195 K CB -0.423 32.056 32.500 -0.035 0.000 0.833 195 K HN 0.292 8.497 8.250 -0.075 0.000 0.493 196 R N 0.350 120.842 120.500 -0.013 0.000 2.641 196 R HA -0.009 4.337 4.340 0.009 0.000 0.269 196 R C 0.601 176.916 176.300 0.025 0.000 1.074 196 R CA 0.740 56.851 56.100 0.018 0.000 1.133 196 R CB 0.493 30.833 30.300 0.067 0.000 1.029 196 R HN -0.346 8.236 8.270 -0.018 -0.322 0.488 197 T N -1.461 113.110 114.554 0.029 0.000 3.182 197 T HA 0.179 4.537 4.350 0.014 0.000 0.277 197 T C -0.800 173.919 174.700 0.031 0.000 1.013 197 T CA -0.856 61.256 62.100 0.021 0.000 0.900 197 T CB 0.191 69.065 68.868 0.010 0.000 1.098 197 T HN 0.415 8.674 8.240 0.032 0.000 0.543 198 D N 1.379 121.816 120.400 0.061 0.000 2.530 198 D HA 0.039 4.706 4.640 0.046 0.000 0.282 198 D C 0.586 176.913 176.300 0.045 0.000 1.204 198 D CA -1.489 52.553 54.000 0.071 0.000 1.093 198 D CB 0.486 41.360 40.800 0.123 0.000 1.154 198 D HN -0.767 7.650 8.370 0.080 0.000 0.593 199 A N -3.628 119.198 122.820 0.012 0.000 2.172 199 A HA -0.086 4.147 4.320 -0.145 0.000 0.216 199 A C 0.299 177.675 177.584 -0.346 0.000 1.154 199 A CA 2.026 53.954 52.037 -0.181 0.000 0.701 199 A CB -0.134 18.689 19.000 -0.295 0.000 0.789 199 A HN 0.374 8.559 8.150 0.059 0.000 0.465 200 Y N -3.778 116.559 120.300 0.062 0.000 2.571 200 Y HA 0.354 5.094 4.550 0.078 -0.143 0.275 200 Y C -0.785 175.201 175.900 0.143 0.000 1.179 200 Y CA -0.356 57.813 58.100 0.115 0.000 1.242 200 Y CB 0.174 38.750 38.460 0.194 0.000 1.126 200 Y HN -0.545 8.125 8.280 0.251 -0.239 0.524 201 G N -3.927 104.956 108.800 0.139 0.000 2.692 201 G HA2 0.212 4.222 3.960 0.083 0.000 0.291 201 G HA3 0.212 4.330 3.960 0.077 -0.112 0.291 201 G C -1.590 173.319 174.900 0.014 0.000 1.423 201 G CA -0.942 44.205 45.100 0.078 0.000 0.843 201 G HN -0.830 7.454 8.290 0.084 0.057 0.486 202 G N 0.221 109.015 108.800 -0.010 0.000 3.662 202 G HA2 -0.343 3.602 3.960 -0.026 0.000 0.251 202 G HA3 -0.343 3.608 3.960 -0.016 0.000 0.251 202 G C -0.799 174.085 174.900 -0.027 0.000 1.815 202 G CA -0.024 45.063 45.100 -0.021 0.000 1.373 202 G HN 0.246 8.526 8.290 -0.017 0.000 0.571 203 S N 2.239 117.929 115.700 -0.017 0.000 2.617 203 S HA 0.094 4.576 4.470 0.019 0.000 0.259 203 S C 0.714 175.324 174.600 0.018 0.000 1.301 203 S CA -1.192 57.014 58.200 0.010 0.000 0.984 203 S CB 1.693 64.904 63.200 0.018 0.000 0.954 203 S HN -0.407 7.891 8.310 -0.020 0.000 0.572 204 F N 2.083 121.994 119.950 -0.065 0.000 2.126 204 F HA -0.315 4.148 4.527 -0.107 0.000 0.299 204 F C 0.983 176.785 175.800 0.002 0.000 1.096 204 F CA 3.457 61.427 58.000 -0.050 0.000 1.255 204 F CB -0.159 38.830 39.000 -0.018 0.000 0.997 204 F HN 0.625 9.059 8.300 0.224 0.000 0.479 205 D N -2.848 117.471 120.400 -0.134 0.000 2.144 205 D HA -0.261 4.143 4.640 -0.392 0.000 0.200 205 D C 2.362 178.529 176.300 -0.221 0.000 0.978 205 D CA 3.665 57.526 54.000 -0.231 0.000 0.833 205 D CB -0.815 39.947 40.800 -0.064 0.000 0.961 205 D HN 0.229 8.641 8.370 0.069 0.000 0.470 206 N N -1.042 117.571 118.700 -0.146 0.000 2.250 206 N HA -0.109 4.605 4.740 -0.192 -0.089 0.181 206 N C 2.447 177.919 175.510 -0.063 0.000 1.017 206 N CA 1.848 54.818 53.050 -0.134 0.000 0.866 206 N CB 0.304 38.740 38.487 -0.086 0.000 0.985 206 N HN -0.451 7.780 8.380 -0.104 0.087 0.429 207 R N 0.391 120.853 120.500 -0.063 0.000 2.115 207 R HA -0.150 4.268 4.340 0.131 0.000 0.230 207 R C 2.095 178.459 176.300 0.106 0.000 1.111 207 R CA 2.883 58.993 56.100 0.017 0.000 0.976 207 R CB -0.031 30.182 30.300 -0.145 0.000 0.870 207 R HN 0.001 8.209 8.270 -0.103 0.000 0.445 208 S N -0.989 114.671 115.700 -0.067 0.000 2.453 208 S HA -0.258 4.252 4.470 0.066 0.000 0.231 208 S C 0.364 174.900 174.600 -0.106 0.000 1.005 208 S CA 2.648 60.785 58.200 -0.104 0.000 0.949 208 S CB -0.039 62.881 63.200 -0.468 0.000 0.774 208 S HN -0.184 7.978 8.310 -0.247 0.000 0.510 209 R N 2.098 122.544 120.500 -0.091 0.000 2.083 209 R HA -0.351 3.903 4.340 -0.143 0.000 0.237 209 R C 1.405 177.701 176.300 -0.008 0.000 1.137 209 R CA 3.319 59.356 56.100 -0.104 0.000 0.951 209 R CB -0.366 29.780 30.300 -0.257 0.000 0.851 209 R HN -0.757 7.299 8.270 -0.087 0.162 0.434 210 F N -1.371 118.529 119.950 -0.083 0.000 2.126 210 F HA -0.255 4.149 4.527 -0.205 0.000 0.299 210 F C 1.519 177.091 175.800 -0.380 0.000 1.096 210 F CA 3.384 61.190 58.000 -0.323 0.000 1.255 210 F CB -0.267 38.145 39.000 -0.979 0.000 0.997 210 F HN 0.001 8.443 8.300 0.237 0.000 0.479 211 L N -1.723 119.234 121.223 -0.444 0.000 2.027 211 L HA -0.368 3.217 4.340 -1.258 0.000 0.206 211 L C 1.833 178.500 176.870 -0.338 0.000 1.074 211 L CA 3.655 58.053 54.840 -0.737 0.000 0.745 211 L CB -0.438 41.234 42.059 -0.645 0.000 0.898 211 L HN -0.797 7.310 8.230 -0.204 0.000 0.433 212 L N -1.683 119.448 121.223 -0.154 0.000 2.056 212 L HA -0.488 3.893 4.340 0.068 0.000 0.207 212 L C 2.486 179.287 176.870 -0.114 0.000 1.078 212 L CA 3.553 58.362 54.840 -0.051 0.000 0.749 212 L CB -0.586 41.432 42.059 -0.068 0.000 0.901 212 L HN -0.188 7.943 8.230 -0.165 0.000 0.433 213 E N -1.509 118.588 120.200 -0.171 0.000 2.110 213 E HA -0.353 3.935 4.350 -0.103 0.000 0.193 213 E C 2.714 179.179 176.600 -0.225 0.000 0.988 213 E CA 3.220 59.526 56.400 -0.157 0.000 0.804 213 E CB -0.171 29.468 29.700 -0.102 0.000 0.745 213 E HN 0.221 8.472 8.360 -0.182 0.000 0.458 214 T N 2.552 116.859 114.554 -0.412 0.000 2.708 214 T HA -0.263 3.862 4.350 -0.375 0.000 0.266 214 T C 1.570 176.137 174.700 -0.222 0.000 1.037 214 T CA 4.841 66.679 62.100 -0.437 0.000 1.146 214 T CB -0.112 68.264 68.868 -0.821 0.000 0.865 214 T HN -0.382 7.532 8.240 -0.543 0.000 0.435 215 L N 1.289 122.420 121.223 -0.152 0.000 2.012 215 L HA -0.411 3.825 4.340 -0.173 0.000 0.210 215 L C 0.881 177.695 176.870 -0.093 0.000 1.073 215 L CA 3.262 58.024 54.840 -0.130 0.000 0.748 215 L CB -0.669 41.323 42.059 -0.111 0.000 0.891 215 L HN -0.238 7.908 8.230 -0.141 0.000 0.431 216 A N -2.095 120.683 122.820 -0.071 0.000 1.902 216 A HA -0.383 3.920 4.320 -0.028 0.000 0.217 216 A C 1.829 179.395 177.584 -0.031 0.000 1.181 216 A CA 2.828 54.840 52.037 -0.040 0.000 0.623 216 A CB -0.711 18.268 19.000 -0.035 0.000 0.818 216 A HN -0.369 7.733 8.150 -0.079 0.000 0.443 217 A N -1.519 121.273 122.820 -0.046 0.000 1.902 217 A HA -0.258 4.058 4.320 -0.007 0.000 0.217 217 A C 2.656 180.245 177.584 0.007 0.000 1.181 217 A CA 2.702 54.727 52.037 -0.019 0.000 0.623 217 A CB -0.663 18.321 19.000 -0.026 0.000 0.818 217 A HN -0.354 7.752 8.150 -0.073 0.000 0.443 218 V N -0.411 119.498 119.914 -0.008 0.000 2.392 218 V HA -0.562 3.591 4.120 0.055 0.000 0.249 218 V C 1.461 177.594 176.094 0.064 0.000 1.059 218 V CA 3.977 66.289 62.300 0.020 0.000 1.051 218 V CB -0.331 31.464 31.823 -0.046 0.000 0.658 218 V HN -0.136 8.028 8.190 -0.042 0.000 0.455 219 R N -2.917 117.602 120.500 0.032 0.000 2.193 219 R HA -0.320 4.092 4.340 0.119 0.000 0.229 219 R C 1.095 177.442 176.300 0.078 0.000 1.110 219 R CA 2.638 58.779 56.100 0.069 0.000 0.988 219 R CB -0.122 30.192 30.300 0.024 0.000 0.871 219 R HN -0.445 7.715 8.270 -0.002 0.108 0.458 220 E N -3.356 116.877 120.200 0.054 0.000 2.204 220 E HA -0.122 4.247 4.350 0.032 0.000 0.194 220 E C 1.321 177.953 176.600 0.053 0.000 0.989 220 E CA 1.690 58.116 56.400 0.042 0.000 0.824 220 E CB 0.318 30.036 29.700 0.030 0.000 0.756 220 E HN -0.539 7.718 8.360 0.043 0.129 0.477 221 V N -7.936 112.032 119.914 0.089 0.000 3.621 221 V HA 0.201 4.353 4.120 0.054 0.000 0.263 221 V C -0.943 175.228 176.094 0.129 0.000 1.272 221 V CA -1.157 61.198 62.300 0.093 0.000 1.080 221 V CB 0.883 32.767 31.823 0.102 0.000 0.816 221 V HN -0.553 7.682 8.190 0.108 0.020 0.451 222 W N 3.086 124.372 121.300 -0.023 0.000 2.272 222 W HA 0.255 4.904 4.660 -0.018 0.000 0.318 222 W C -2.465 174.035 176.519 -0.031 0.000 1.255 222 W CA -1.283 56.045 57.345 -0.030 0.000 1.200 222 W CB 1.073 30.502 29.460 -0.053 0.000 1.170 222 W HN -0.484 7.874 8.180 0.297 0.000 0.549 223 P HA 0.020 4.267 4.420 -0.287 0.000 0.268 223 P C -0.651 176.464 177.300 -0.309 0.000 1.205 223 P CA -0.233 62.583 63.100 -0.474 0.000 0.771 223 P CB 0.909 32.263 31.700 -0.577 0.000 0.858 224 E N 3.786 123.899 120.200 -0.145 0.000 2.153 224 E HA -0.389 3.948 4.350 -0.022 0.000 0.194 224 E C -0.159 176.400 176.600 -0.068 0.000 0.988 224 E CA 3.161 59.522 56.400 -0.065 0.000 0.811 224 E CB 0.172 29.845 29.700 -0.045 0.000 0.746 224 E HN 0.546 8.827 8.360 -0.132 0.000 0.466 225 N N -4.583 114.052 118.700 -0.109 0.000 2.383 225 N HA -0.119 4.586 4.740 -0.057 0.000 0.192 225 N C -1.424 174.042 175.510 -0.074 0.000 1.141 225 N CA -0.159 52.841 53.050 -0.083 0.000 0.851 225 N CB -0.850 37.590 38.487 -0.080 0.000 0.976 225 N HN -0.025 8.237 8.380 -0.145 0.031 0.465 226 L N -0.529 120.641 121.223 -0.089 0.000 2.386 226 L HA 0.476 4.846 4.340 0.049 0.000 0.271 226 L C -2.306 174.690 176.870 0.210 0.000 0.993 226 L CA -2.835 52.022 54.840 0.027 0.000 0.819 226 L CB 2.408 44.400 42.059 -0.112 0.000 1.294 226 L HN -0.746 7.341 8.230 -0.128 0.066 0.414 227 P HA -0.120 4.357 4.420 -0.199 -0.177 0.262 227 P C -1.814 175.354 177.300 -0.220 0.000 1.182 227 P CA 0.438 63.403 63.100 -0.227 0.000 0.761 227 P CB 0.167 31.393 31.700 -0.791 0.000 0.795 228 L N 6.178 127.247 121.223 -0.257 0.000 2.316 228 L HA 0.384 4.370 4.340 -0.589 0.000 0.280 228 L C -1.980 174.629 176.870 -0.435 0.000 1.006 228 L CA -1.019 53.593 54.840 -0.379 0.000 0.836 228 L CB 2.524 44.486 42.059 -0.162 0.000 1.221 228 L HN 0.391 8.809 8.230 -0.220 -0.320 0.418 229 T N 3.530 117.767 114.554 -0.528 0.000 2.888 229 T HA 0.857 5.119 4.350 -0.335 -0.113 0.288 229 T C -1.900 172.562 174.700 -0.397 0.000 1.063 229 T CA -2.829 59.030 62.100 -0.401 0.000 1.010 229 T CB 3.328 71.979 68.868 -0.362 0.000 1.214 229 T HN 0.447 8.323 8.240 -0.605 0.000 0.533 230 A N -2.216 120.420 122.820 -0.306 0.000 2.587 230 A HA 0.540 4.836 4.320 -0.418 -0.226 0.293 230 A C -2.862 174.657 177.584 -0.109 0.000 1.087 230 A CA -1.058 50.770 52.037 -0.348 0.000 0.692 230 A CB 3.596 22.247 19.000 -0.582 0.000 1.291 230 A HN -0.106 7.916 8.150 -0.215 0.000 0.407 231 R N 0.421 120.893 120.500 -0.046 0.000 2.514 231 R HA 1.007 5.638 4.340 0.128 -0.214 0.301 231 R C -2.141 174.358 176.300 0.331 0.000 0.962 231 R CA -1.923 54.240 56.100 0.105 0.000 0.882 231 R CB 3.427 33.716 30.300 -0.019 0.000 1.143 231 R HN 0.284 8.485 8.270 -0.114 0.000 0.452 232 F N 6.303 126.355 119.950 0.170 0.000 2.588 232 F HA 0.373 5.269 4.527 0.297 -0.190 0.318 232 F C -2.094 173.831 175.800 0.207 0.000 1.155 232 F CA -2.122 56.023 58.000 0.242 0.000 0.967 232 F CB 4.556 43.733 39.000 0.296 0.000 1.236 232 F HN 0.171 8.668 8.300 0.327 0.000 0.455 233 G N 6.489 115.190 108.800 -0.166 0.000 2.372 233 G HA2 0.043 4.040 3.960 -0.073 0.000 0.286 233 G HA3 0.043 4.124 3.960 -0.059 -0.157 0.286 233 G C -0.653 173.863 174.900 -0.639 0.000 1.153 233 G CA -0.188 44.779 45.100 -0.223 0.000 0.985 233 G HN 0.191 8.742 8.290 0.034 -0.241 0.429 234 V N 1.010 120.659 119.914 -0.442 0.000 3.506 234 V HA 0.131 3.878 4.120 -0.621 0.000 0.263 234 V C -1.064 174.891 176.094 -0.232 0.000 1.203 234 V CA -0.112 61.948 62.300 -0.401 0.000 1.133 234 V CB 0.386 32.086 31.823 -0.204 0.000 0.802 234 V HN -0.185 7.845 8.190 -0.265 0.000 0.459 235 L N -8.169 112.915 121.223 -0.233 0.000 2.630 235 L HA 0.483 4.718 4.340 -0.175 0.000 0.258 235 L C -1.458 175.260 176.870 -0.253 0.000 1.072 235 L CA -0.543 54.147 54.840 -0.251 0.000 0.885 235 L CB 2.003 43.819 42.059 -0.406 0.000 1.502 235 L HN -1.174 6.918 8.230 -0.228 0.000 0.406 236 E N -2.167 117.889 120.200 -0.240 0.000 2.485 236 E HA 0.147 4.400 4.350 -0.162 0.000 0.213 236 E C -0.429 176.107 176.600 -0.107 0.000 0.923 236 E CA -0.766 55.543 56.400 -0.153 0.000 1.054 236 E CB 1.452 31.129 29.700 -0.037 0.000 1.077 236 E HN 0.490 8.704 8.360 -0.244 0.000 0.509 237 Y N -5.582 114.633 120.300 -0.143 0.000 3.389 237 Y HA -0.372 4.396 4.550 -0.123 -0.292 0.213 237 Y C -1.555 174.274 175.900 -0.118 0.000 1.272 237 Y CA 0.679 58.688 58.100 -0.152 0.000 1.444 237 Y CB -2.787 35.529 38.460 -0.240 0.000 1.445 237 Y HN -0.338 7.800 8.280 -0.542 -0.183 0.583 238 D N -2.888 117.508 120.400 -0.007 0.000 2.571 238 D HA 0.171 4.806 4.640 -0.008 0.000 0.239 238 D C 0.951 177.261 176.300 0.016 0.000 1.267 238 D CA -1.490 52.513 54.000 0.005 0.000 0.823 238 D CB 0.311 41.132 40.800 0.035 0.000 1.056 238 D HN -0.649 7.833 8.370 -0.046 -0.140 0.494 239 G N -0.577 108.222 108.800 -0.000 0.000 2.179 239 G HA2 -0.433 3.523 3.960 -0.006 0.000 0.260 239 G HA3 -0.433 3.527 3.960 0.001 0.000 0.260 239 G C 0.185 175.075 174.900 -0.016 0.000 0.977 239 G CA 0.390 45.487 45.100 -0.005 0.000 0.641 239 G HN 0.274 8.561 8.290 -0.004 0.000 0.533 240 R N -1.388 119.098 120.500 -0.024 0.000 2.700 240 R HA 0.365 4.787 4.340 -0.037 -0.105 0.399 240 R C -1.192 175.071 176.300 -0.062 0.000 1.115 240 R CA -1.353 54.725 56.100 -0.036 0.000 1.058 240 R CB 0.782 31.064 30.300 -0.030 0.000 1.389 240 R HN -0.241 8.234 8.270 -0.024 -0.219 0.582 241 D N 1.238 121.585 120.400 -0.088 0.000 2.103 241 D HA -0.257 4.282 4.640 -0.167 0.000 0.199 241 D C 1.914 178.153 176.300 -0.103 0.000 0.978 241 D CA 3.698 57.612 54.000 -0.143 0.000 0.829 241 D CB -0.244 40.429 40.800 -0.212 0.000 0.981 241 D HN 0.370 8.693 8.370 -0.079 0.000 0.464 242 E N -0.466 119.691 120.200 -0.072 0.000 2.058 242 E HA -0.237 4.081 4.350 -0.055 0.000 0.194 242 E C 2.180 178.752 176.600 -0.047 0.000 0.997 242 E CA 3.072 59.440 56.400 -0.053 0.000 0.801 242 E CB -0.550 29.125 29.700 -0.041 0.000 0.746 242 E HN 0.054 8.375 8.360 -0.064 0.000 0.450 243 Q N -3.046 116.726 119.800 -0.046 0.000 2.230 243 Q HA -0.156 4.157 4.340 -0.045 0.000 0.202 243 Q C 2.290 178.276 176.000 -0.023 0.000 0.963 243 Q CA 2.490 58.267 55.803 -0.043 0.000 0.866 243 Q CB -0.758 27.950 28.738 -0.050 0.000 0.931 243 Q HN 0.165 8.406 8.270 -0.048 0.000 0.452 244 T N 4.024 118.566 114.554 -0.021 0.000 2.737 244 T HA -0.284 4.104 4.350 0.064 0.000 0.265 244 T C 1.676 176.405 174.700 0.048 0.000 1.038 244 T CA 5.186 67.302 62.100 0.026 0.000 1.144 244 T CB -0.178 68.688 68.868 -0.005 0.000 0.866 244 T HN -0.265 7.951 8.240 -0.040 0.000 0.434 245 L N 1.092 122.305 121.223 -0.017 0.000 2.083 245 L HA -0.236 4.243 4.340 -0.018 -0.151 0.209 245 L C 2.400 179.278 176.870 0.014 0.000 1.083 245 L CA 3.251 58.081 54.840 -0.017 0.000 0.752 245 L CB -0.174 41.854 42.059 -0.052 0.000 0.899 245 L HN 0.142 8.344 8.230 -0.047 0.000 0.433 246 E N -0.144 120.053 120.200 -0.004 0.000 2.051 246 E HA -0.465 3.871 4.350 -0.024 0.000 0.192 246 E C 2.325 178.915 176.600 -0.017 0.000 0.991 246 E CA 3.423 59.809 56.400 -0.024 0.000 0.799 246 E CB -0.133 29.534 29.700 -0.055 0.000 0.748 246 E HN -0.348 8.002 8.360 -0.016 0.000 0.449 247 E N -1.008 119.213 120.200 0.034 0.000 2.072 247 E HA -0.296 3.959 4.350 -0.158 0.000 0.191 247 E C 2.583 179.420 176.600 0.394 0.000 0.985 247 E CA 2.979 59.452 56.400 0.123 0.000 0.801 247 E CB -0.065 29.814 29.700 0.298 0.000 0.750 247 E HN -0.576 7.812 8.360 0.047 0.000 0.452 248 S N 0.511 116.426 115.700 0.359 0.000 2.368 248 S HA -0.344 4.349 4.470 0.371 0.000 0.225 248 S C 2.155 176.882 174.600 0.212 0.000 1.030 248 S CA 3.821 62.211 58.200 0.317 0.000 0.999 248 S CB 0.005 63.284 63.200 0.132 0.000 0.844 248 S HN -0.009 8.475 8.310 0.291 0.000 0.459 249 I N 1.312 121.952 120.570 0.118 0.000 2.439 249 I HA -0.443 3.779 4.170 0.088 0.000 0.251 249 I C 1.328 177.469 176.117 0.041 0.000 1.139 249 I CA 3.772 65.115 61.300 0.071 0.000 1.438 249 I CB -0.116 37.906 38.000 0.036 0.000 1.085 249 I HN -0.082 8.186 8.210 0.096 0.000 0.427 250 E N 0.639 120.859 120.200 0.034 0.000 2.072 250 E HA -0.350 3.999 4.350 -0.001 0.000 0.191 250 E C 1.985 178.643 176.600 0.097 0.000 0.985 250 E CA 2.985 59.398 56.400 0.022 0.000 0.801 250 E CB -0.356 29.243 29.700 -0.168 0.000 0.750 250 E HN -0.503 7.789 8.360 0.034 0.088 0.452 251 L N -0.755 120.536 121.223 0.114 0.000 2.083 251 L HA -0.293 3.904 4.340 -0.238 0.000 0.209 251 L C 1.581 178.069 176.870 -0.636 0.000 1.083 251 L CA 2.934 57.581 54.840 -0.322 0.000 0.752 251 L CB -0.541 41.111 42.059 -0.678 0.000 0.899 251 L HN -0.217 8.136 8.230 0.204 0.000 0.433 252 A N -1.207 121.446 122.820 -0.279 0.000 1.933 252 A HA -0.371 3.909 4.320 -0.067 0.000 0.218 252 A C 2.148 179.720 177.584 -0.020 0.000 1.175 252 A CA 3.190 55.180 52.037 -0.079 0.000 0.628 252 A CB -0.902 18.170 19.000 0.119 0.000 0.814 252 A HN -0.064 7.941 8.150 -0.109 0.080 0.444 253 R N -2.217 118.269 120.500 -0.024 0.000 2.081 253 R HA -0.336 4.022 4.340 0.030 0.000 0.235 253 R C 2.740 179.039 176.300 -0.000 0.000 1.131 253 R CA 3.538 59.642 56.100 0.007 0.000 0.960 253 R CB -0.102 30.204 30.300 0.010 0.000 0.856 253 R HN -0.329 7.926 8.270 -0.025 0.000 0.436 254 R N -1.077 119.387 120.500 -0.060 0.000 2.115 254 R HA -0.277 4.059 4.340 -0.005 0.000 0.230 254 R C 2.793 179.112 176.300 0.031 0.000 1.111 254 R CA 3.213 59.283 56.100 -0.050 0.000 0.976 254 R CB -0.356 29.878 30.300 -0.109 0.000 0.870 254 R HN -0.499 7.630 8.270 -0.103 0.079 0.445 255 F N -0.883 119.038 119.950 -0.048 0.000 2.146 255 F HA -0.250 4.233 4.527 -0.073 0.000 0.298 255 F C 2.045 177.821 175.800 -0.039 0.000 1.096 255 F CA 1.081 59.044 58.000 -0.061 0.000 1.275 255 F CB -0.812 38.143 39.000 -0.075 0.000 1.008 255 F HN 0.153 8.275 8.300 -0.146 0.090 0.480 256 K N 1.009 121.516 120.400 0.177 0.000 2.026 256 K HA -0.327 4.212 4.320 0.085 -0.168 0.208 256 K C 2.698 179.336 176.600 0.064 0.000 1.048 256 K CA 3.201 59.545 56.287 0.096 0.000 0.929 256 K CB -0.072 32.473 32.500 0.076 0.000 0.713 256 K HN -0.176 8.174 8.250 0.167 0.000 0.439 257 A N -2.555 120.299 122.820 0.057 0.000 2.019 257 A HA -0.106 4.232 4.320 0.030 0.000 0.219 257 A C 1.699 179.304 177.584 0.035 0.000 1.164 257 A CA 2.304 54.363 52.037 0.037 0.000 0.644 257 A CB -0.445 18.572 19.000 0.028 0.000 0.805 257 A HN -0.331 7.854 8.150 0.059 0.000 0.449 258 G N -6.005 102.827 108.800 0.052 0.000 3.371 258 G HA2 0.045 4.021 3.960 0.026 0.000 0.248 258 G HA3 0.045 4.038 3.960 0.054 0.000 0.248 258 G C -0.356 174.557 174.900 0.023 0.000 1.161 258 G CA -0.742 44.382 45.100 0.040 0.000 0.796 258 G HN -0.647 7.545 8.290 0.077 0.144 0.539 259 G N -1.098 107.714 108.800 0.020 0.000 2.159 259 G HA2 -0.351 3.610 3.960 0.002 0.000 0.227 259 G HA3 -0.351 3.608 3.960 -0.002 0.000 0.227 259 G C -0.509 174.375 174.900 -0.026 0.000 0.986 259 G CA -0.131 44.968 45.100 -0.000 0.000 0.651 259 G HN -0.450 7.687 8.290 0.029 0.170 0.523 260 L N -0.224 120.985 121.223 -0.024 0.000 2.410 260 L HA -0.072 4.321 4.340 -0.134 -0.134 0.273 260 L C 0.004 176.843 176.870 -0.052 0.000 1.152 260 L CA 0.901 55.696 54.840 -0.076 0.000 0.855 260 L CB 0.944 42.962 42.059 -0.067 0.000 1.129 260 L HN -0.518 7.720 8.230 0.013 0.000 0.463 261 D N 6.251 126.588 120.400 -0.105 0.000 2.327 261 D HA 0.104 4.717 4.640 -0.045 0.000 0.205 261 D C -0.557 175.716 176.300 -0.044 0.000 0.989 261 D CA 1.950 55.899 54.000 -0.085 0.000 0.873 261 D CB 1.602 42.311 40.800 -0.153 0.000 0.955 261 D HN 0.560 8.833 8.370 -0.161 0.000 0.515 262 L N -4.046 117.139 121.223 -0.064 0.000 2.672 262 L HA 0.272 4.816 4.340 0.065 -0.165 0.256 262 L C -3.153 173.727 176.870 0.017 0.000 0.946 262 L CA -0.317 54.536 54.840 0.021 0.000 0.889 262 L CB 3.825 45.935 42.059 0.085 0.000 1.441 262 L HN -0.869 7.293 8.230 -0.112 0.000 0.418 263 L N 2.792 124.062 121.223 0.079 0.000 2.349 263 L HA 0.632 5.153 4.340 0.068 -0.141 0.278 263 L C -2.138 174.805 176.870 0.122 0.000 0.996 263 L CA -1.423 53.481 54.840 0.105 0.000 0.825 263 L CB 3.666 45.830 42.059 0.175 0.000 1.243 263 L HN 0.230 8.518 8.230 0.096 0.000 0.412 264 S N 6.341 122.113 115.700 0.120 0.000 2.416 264 S HA 0.225 4.914 4.470 0.118 -0.148 0.287 264 S C -1.201 173.492 174.600 0.154 0.000 1.139 264 S CA -0.881 57.394 58.200 0.126 0.000 1.058 264 S CB 0.301 63.568 63.200 0.110 0.000 0.967 264 S HN 0.637 9.006 8.310 0.099 0.000 0.495 265 V N 8.608 128.607 119.914 0.142 0.000 2.432 265 V HA 0.334 4.544 4.120 0.150 0.000 0.275 265 V C -1.050 175.132 176.094 0.147 0.000 1.043 265 V CA -0.475 61.906 62.300 0.134 0.000 0.925 265 V CB -0.445 31.436 31.823 0.096 0.000 0.985 265 V HN 0.064 8.328 8.190 0.123 0.000 0.466 266 S N 4.286 120.077 115.700 0.151 0.000 2.840 266 S HA 0.325 4.943 4.470 0.246 0.000 0.307 266 S C -2.002 172.689 174.600 0.153 0.000 1.180 266 S CA -2.246 56.103 58.200 0.248 0.000 0.846 266 S CB 2.100 65.583 63.200 0.472 0.000 1.233 266 S HN 0.144 8.519 8.310 0.109 0.000 0.548 267 V N -0.642 119.397 119.914 0.209 0.000 2.617 267 V HA 0.279 4.463 4.120 -0.082 -0.113 0.298 267 V C 1.216 177.300 176.094 -0.017 0.000 1.048 267 V CA -1.373 60.894 62.300 -0.055 0.000 0.964 267 V CB 1.083 32.712 31.823 -0.324 0.000 1.004 267 V HN 0.322 8.734 8.190 0.370 0.000 0.466 268 G N 3.429 112.161 108.800 -0.114 0.000 2.418 268 G HA2 -0.246 3.989 3.960 0.154 0.000 0.217 268 G HA3 -0.246 4.059 3.960 0.029 -0.327 0.217 268 G C -0.342 174.674 174.900 0.195 0.000 1.158 268 G CA 1.545 46.680 45.100 0.058 0.000 0.771 268 G HN 0.047 8.234 8.290 -0.171 0.000 0.545 269 F N -5.219 114.826 119.950 0.160 0.000 3.100 269 F HA -0.401 4.230 4.527 0.172 0.000 0.284 269 F C 0.314 176.241 175.800 0.212 0.000 0.875 269 F CA 0.463 58.561 58.000 0.163 0.000 1.039 269 F CB -3.326 35.736 39.000 0.103 0.000 1.111 269 F HN -0.557 7.442 8.300 -0.503 0.000 0.575 270 T N -0.787 113.917 114.554 0.249 0.000 2.857 270 T HA -0.194 4.331 4.350 0.292 0.000 0.266 270 T C -0.190 174.638 174.700 0.213 0.000 1.048 270 T CA 4.446 66.694 62.100 0.247 0.000 1.139 270 T CB 0.797 69.773 68.868 0.181 0.000 0.874 270 T HN -0.067 8.575 8.240 0.151 -0.311 0.455 271 I N -6.763 113.781 120.570 -0.043 0.000 3.042 271 I HA 0.650 4.293 4.170 -0.878 0.000 0.310 271 I C -2.668 173.201 176.117 -0.414 0.000 1.117 271 I CA -3.576 57.426 61.300 -0.496 0.000 1.003 271 I CB 1.917 39.594 38.000 -0.539 0.000 1.228 271 I HN -0.928 7.264 8.210 -0.030 0.000 0.443 272 P HA 0.008 4.464 4.420 0.059 0.000 0.230 272 P C -1.014 176.221 177.300 -0.107 0.000 1.168 272 P CA 1.198 64.174 63.100 -0.206 0.000 0.793 272 P CB 0.397 31.963 31.700 -0.224 0.000 0.851 273 D N -0.162 120.132 120.400 -0.177 0.000 2.558 273 D HA 0.110 4.711 4.640 -0.066 0.000 0.221 273 D C -1.144 175.103 176.300 -0.088 0.000 1.143 273 D CA -0.579 53.357 54.000 -0.106 0.000 1.010 273 D CB -1.198 39.535 40.800 -0.111 0.000 1.068 273 D HN -0.164 8.052 8.370 -0.257 0.000 0.511 274 T N -0.957 113.568 114.554 -0.049 0.000 2.841 274 T HA 0.379 4.778 4.350 -0.043 -0.075 0.296 274 T C -0.965 173.708 174.700 -0.045 0.000 1.166 274 T CA -1.805 60.269 62.100 -0.044 0.000 1.007 274 T CB 2.797 71.636 68.868 -0.048 0.000 1.253 274 T HN -0.624 7.601 8.240 -0.026 0.000 0.511 275 N N 1.295 119.955 118.700 -0.066 0.000 2.762 275 N HA 0.249 4.915 4.740 -0.124 0.000 0.252 275 N C -1.197 174.114 175.510 -0.332 0.000 1.269 275 N CA 0.269 53.239 53.050 -0.134 0.000 0.799 275 N CB 1.334 39.771 38.487 -0.083 0.000 1.173 275 N HN 0.103 8.464 8.380 -0.031 0.000 0.516 276 I N 2.254 122.483 120.570 -0.568 0.000 2.396 276 I HA 0.112 3.399 4.170 -1.472 0.000 0.289 276 I C -0.607 174.674 176.117 -1.395 0.000 1.056 276 I CA -2.699 57.853 61.300 -1.246 0.000 1.365 276 I CB 0.872 37.938 38.000 -1.558 0.000 1.407 276 I HN 0.113 8.060 8.210 -0.440 0.000 0.509 277 P HA 0.078 4.106 4.420 -0.653 0.000 0.231 277 P C -1.460 175.143 177.300 -1.162 0.000 1.811 277 P CA -0.989 61.551 63.100 -0.934 0.000 1.051 277 P CB -1.741 29.596 31.700 -0.605 0.000 1.951 278 W N 1.752 122.450 121.300 -1.004 0.000 2.231 278 W HA -0.243 3.274 4.660 -1.905 0.000 0.341 278 W C 0.190 176.404 176.519 -0.508 0.000 1.298 278 W CA 0.722 57.415 57.345 -1.088 0.000 1.266 278 W CB 0.363 29.467 29.460 -0.594 0.000 1.172 278 W HN -0.611 6.888 8.180 -1.065 0.042 0.568 279 G N 1.421 110.235 108.800 0.025 0.000 2.356 279 G HA2 -0.033 4.094 3.960 0.279 0.000 0.294 279 G HA3 -0.033 4.024 3.960 0.162 0.000 0.294 279 G C -3.154 172.022 174.900 0.460 0.000 1.423 279 G CA -1.031 44.228 45.100 0.264 0.000 0.806 279 G HN -0.284 8.006 8.290 -0.000 0.000 0.527 280 P HA -0.216 4.308 4.420 0.173 0.000 0.266 280 P C -0.789 176.550 177.300 0.065 0.000 1.215 280 P CA 0.505 63.700 63.100 0.159 0.000 0.763 280 P CB -0.483 31.255 31.700 0.063 0.000 0.806 281 A N 3.093 125.821 122.820 -0.154 0.000 2.860 281 A HA -0.442 3.429 4.320 -0.859 -0.067 0.267 281 A C 0.146 177.736 177.584 0.010 0.000 1.421 281 A CA 1.181 52.968 52.037 -0.418 0.000 0.831 281 A CB -2.295 16.423 19.000 -0.470 0.000 1.041 281 A HN 0.282 8.327 8.150 -0.176 0.000 0.623 282 F N -3.937 116.050 119.950 0.061 0.000 2.269 282 F HA -0.287 4.267 4.527 0.045 0.000 0.301 282 F C 0.251 176.106 175.800 0.091 0.000 1.082 282 F CA 2.351 60.382 58.000 0.051 0.000 1.360 282 F CB -0.183 38.804 39.000 -0.022 0.000 1.041 282 F HN -0.614 7.980 8.300 0.514 0.014 0.512 283 M N -2.246 116.971 119.600 -0.639 0.000 2.595 283 M HA 0.046 4.276 4.480 -0.416 0.000 0.248 283 M C 1.822 178.107 176.300 -0.025 0.000 1.119 283 M CA 1.062 56.114 55.300 -0.414 0.000 1.079 283 M CB -0.685 31.639 32.600 -0.459 0.000 1.472 283 M HN -0.338 7.530 8.290 -0.664 0.023 0.501 284 G N 0.900 109.768 108.800 0.114 0.000 2.529 284 G HA2 -0.269 3.816 3.960 0.209 0.000 0.219 284 G HA3 -0.269 3.820 3.960 0.215 0.000 0.219 284 G C -1.680 173.280 174.900 0.100 0.000 1.177 284 G CA 3.463 48.668 45.100 0.175 0.000 0.773 284 G HN 0.232 8.457 8.290 0.125 0.140 0.573 285 P HA -0.175 4.286 4.420 0.069 0.000 0.216 285 P C 1.302 178.632 177.300 0.051 0.000 1.150 285 P CA 2.672 65.813 63.100 0.069 0.000 0.837 285 P CB -0.094 31.651 31.700 0.075 0.000 0.786 286 I N -3.529 117.065 120.570 0.040 0.000 2.233 286 I HA -0.428 3.753 4.170 0.017 0.000 0.243 286 I C 1.724 177.856 176.117 0.025 0.000 1.093 286 I CA 2.268 63.579 61.300 0.019 0.000 1.380 286 I CB -1.133 36.867 38.000 -0.000 0.000 1.067 286 I HN -0.873 7.360 8.210 0.039 0.000 0.413 287 A N -0.392 122.448 122.820 0.034 0.000 1.940 287 A HA -0.440 3.908 4.320 0.046 0.000 0.219 287 A C 1.523 179.134 177.584 0.046 0.000 1.176 287 A CA 3.561 55.625 52.037 0.045 0.000 0.631 287 A CB -0.943 18.088 19.000 0.052 0.000 0.814 287 A HN 0.022 8.192 8.150 0.033 0.000 0.446 288 E N -0.836 119.392 120.200 0.048 0.000 2.077 288 E HA -0.379 3.997 4.350 0.043 0.000 0.193 288 E C 1.929 178.553 176.600 0.040 0.000 0.989 288 E CA 2.894 59.321 56.400 0.045 0.000 0.800 288 E CB 0.014 29.743 29.700 0.049 0.000 0.746 288 E HN -0.235 8.156 8.360 0.052 0.000 0.452 289 R N -0.664 119.858 120.500 0.036 0.000 2.073 289 R HA -0.307 4.050 4.340 0.029 0.000 0.234 289 R C 2.326 178.647 176.300 0.034 0.000 1.134 289 R CA 3.378 59.496 56.100 0.030 0.000 0.952 289 R CB -0.222 30.091 30.300 0.022 0.000 0.850 289 R HN -0.706 7.585 8.270 0.036 0.000 0.433 290 V N -0.875 119.063 119.914 0.040 0.000 2.343 290 V HA -0.412 3.739 4.120 0.052 0.000 0.247 290 V C 1.711 177.841 176.094 0.059 0.000 1.051 290 V CA 3.449 65.782 62.300 0.054 0.000 1.036 290 V CB -0.835 31.031 31.823 0.071 0.000 0.654 290 V HN -0.397 7.816 8.190 0.039 0.000 0.451 291 R N 0.077 120.611 120.500 0.056 0.000 2.083 291 R HA -0.345 4.240 4.340 0.064 -0.207 0.237 291 R C 2.087 178.416 176.300 0.049 0.000 1.137 291 R CA 3.513 59.646 56.100 0.056 0.000 0.951 291 R CB -0.090 30.239 30.300 0.049 0.000 0.851 291 R HN -0.133 8.169 8.270 0.053 0.000 0.434 292 R N -2.439 118.086 120.500 0.042 0.000 2.062 292 R HA -0.304 4.058 4.340 0.036 0.000 0.229 292 R C 2.440 178.760 176.300 0.032 0.000 1.128 292 R CA 3.337 59.458 56.100 0.036 0.000 0.960 292 R CB 0.003 30.322 30.300 0.032 0.000 0.855 292 R HN -0.310 7.985 8.270 0.041 0.000 0.432 293 E N -1.945 118.274 120.200 0.031 0.000 2.216 293 E HA -0.170 4.193 4.350 0.021 0.000 0.192 293 E C 2.060 178.677 176.600 0.028 0.000 0.988 293 E CA 2.315 58.730 56.400 0.025 0.000 0.834 293 E CB 0.260 29.971 29.700 0.019 0.000 0.772 293 E HN -0.224 8.156 8.360 0.033 0.000 0.479 294 A N -3.283 119.561 122.820 0.040 0.000 2.303 294 A HA 0.105 4.447 4.320 0.037 0.000 0.217 294 A C -0.733 176.880 177.584 0.048 0.000 1.205 294 A CA -0.875 51.189 52.037 0.046 0.000 0.875 294 A CB 0.329 19.366 19.000 0.062 0.000 0.910 294 A HN -0.190 7.987 8.150 0.045 0.000 0.501 295 K N -4.024 116.403 120.400 0.045 0.000 3.278 295 K HA -0.372 4.081 4.320 0.046 -0.106 0.270 295 K C -1.795 174.838 176.600 0.055 0.000 0.955 295 K CA 0.524 56.839 56.287 0.046 0.000 0.723 295 K CB -2.360 30.163 32.500 0.037 0.000 1.382 295 K HN -0.459 7.706 8.250 0.043 0.110 0.461 296 L N -1.890 119.373 121.223 0.065 0.000 2.431 296 L HA 0.581 4.964 4.340 0.072 0.000 0.266 296 L C -3.154 173.766 176.870 0.084 0.000 0.978 296 L CA -3.451 51.434 54.840 0.076 0.000 0.822 296 L CB 3.292 45.404 42.059 0.088 0.000 1.310 296 L HN -0.781 7.488 8.230 0.065 0.000 0.409 297 P HA 0.195 4.831 4.420 0.098 -0.157 0.270 297 P C -1.328 176.030 177.300 0.096 0.000 1.223 297 P CA -0.148 63.020 63.100 0.113 0.000 0.785 297 P CB 0.468 32.283 31.700 0.191 0.000 0.923 298 V N -7.226 112.728 119.914 0.066 0.000 3.049 298 V HA 0.955 5.333 4.120 0.085 -0.207 0.309 298 V C -1.433 174.672 176.094 0.019 0.000 1.148 298 V CA -3.111 59.225 62.300 0.061 0.000 0.990 298 V CB 4.608 36.467 31.823 0.061 0.000 1.039 298 V HN 0.070 8.544 8.190 0.044 -0.258 0.430 299 T N 1.368 115.945 114.554 0.038 0.000 2.930 299 T HA 0.789 5.232 4.350 -0.067 -0.134 0.290 299 T C -1.574 173.138 174.700 0.019 0.000 1.052 299 T CA -2.405 59.689 62.100 -0.010 0.000 1.017 299 T CB 2.153 71.021 68.868 -0.000 0.000 1.137 299 T HN -0.089 8.194 8.240 0.071 0.000 0.511 300 S N 2.052 117.742 115.700 -0.016 0.000 2.752 300 S HA 0.387 4.934 4.470 0.128 0.000 0.284 300 S C -3.039 171.653 174.600 0.153 0.000 1.189 300 S CA -1.239 57.017 58.200 0.093 0.000 0.835 300 S CB 0.979 64.253 63.200 0.124 0.000 1.192 300 S HN 0.072 8.318 8.310 -0.107 0.000 0.506 301 A N -1.008 122.031 122.820 0.365 0.000 2.602 301 A HA 0.376 5.176 4.320 0.580 -0.132 0.290 301 A C -2.325 175.633 177.584 0.625 0.000 1.114 301 A CA -0.574 51.761 52.037 0.498 0.000 0.683 301 A CB 3.368 22.585 19.000 0.362 0.000 1.281 301 A HN 0.319 8.684 8.150 0.359 0.000 0.416 302 W N -1.060 120.433 121.300 0.323 0.000 3.071 302 W HA -0.228 4.564 4.660 0.220 0.000 0.458 302 W C -1.260 175.262 176.519 0.004 0.000 1.805 302 W CA 0.114 57.595 57.345 0.227 0.000 0.462 302 W CB -0.436 29.270 29.460 0.409 0.000 2.861 302 W HN 0.649 9.112 8.180 0.471 0.000 0.424 303 G N 1.693 110.318 108.800 -0.293 0.000 2.141 303 G HA2 -0.440 3.339 3.960 -0.302 0.000 0.242 303 G HA3 -0.440 3.404 3.960 -0.194 0.000 0.242 303 G C -0.696 174.056 174.900 -0.247 0.000 0.982 303 G CA 0.336 45.271 45.100 -0.275 0.000 0.662 303 G HN 0.236 8.307 8.290 -0.365 0.000 0.527 304 F N -1.311 118.638 119.950 -0.003 0.000 2.773 304 F HA 0.050 4.631 4.527 0.090 0.000 0.304 304 F C 0.359 176.155 175.800 -0.007 0.000 1.129 304 F CA -0.494 57.524 58.000 0.029 0.000 1.378 304 F CB -0.993 38.022 39.000 0.024 0.000 1.095 304 F HN 0.094 8.445 8.300 0.085 0.000 0.565 305 G N -2.497 106.309 108.800 0.010 0.000 2.708 305 G HA2 -0.166 3.567 3.960 -0.379 0.000 0.210 305 G HA3 -0.166 3.693 3.960 -0.169 0.000 0.210 305 G C -0.571 174.625 174.900 0.494 0.000 1.141 305 G CA 0.174 45.261 45.100 -0.021 0.000 0.788 305 G HN -0.096 8.101 8.290 -0.060 0.056 0.531 306 T N 4.569 119.339 114.554 0.358 0.000 2.739 306 T HA 0.340 4.935 4.350 0.408 0.000 0.298 306 T C -1.616 173.320 174.700 0.393 0.000 0.929 306 T CA -1.872 60.441 62.100 0.355 0.000 1.014 306 T CB 0.898 69.886 68.868 0.201 0.000 0.914 306 T HN -0.890 7.450 8.240 0.242 0.045 0.509 307 P HA -0.135 4.548 4.420 0.439 0.000 0.218 307 P C 0.977 178.386 177.300 0.182 0.000 1.149 307 P CA 2.055 65.310 63.100 0.258 0.000 0.817 307 P CB 0.469 32.112 31.700 -0.096 0.000 0.785 308 Q N -3.201 116.681 119.800 0.136 0.000 2.224 308 Q HA -0.249 4.147 4.340 0.092 0.000 0.203 308 Q C 2.317 178.412 176.000 0.158 0.000 0.970 308 Q CA 3.431 59.302 55.803 0.114 0.000 0.865 308 Q CB -1.086 27.701 28.738 0.081 0.000 0.922 308 Q HN 0.173 8.501 8.270 0.126 0.017 0.445 309 L N -0.381 120.968 121.223 0.210 0.000 2.072 309 L HA -0.230 4.233 4.340 0.205 0.000 0.205 309 L C 1.174 178.279 176.870 0.391 0.000 1.079 309 L CA 2.328 57.321 54.840 0.255 0.000 0.752 309 L CB -0.728 41.455 42.059 0.206 0.000 0.906 309 L HN -0.370 7.973 8.230 0.219 0.018 0.436 310 A N -1.279 121.793 122.820 0.421 0.000 1.902 310 A HA -0.383 4.116 4.320 0.300 0.000 0.217 310 A C 1.958 179.635 177.584 0.154 0.000 1.181 310 A CA 3.410 55.633 52.037 0.311 0.000 0.623 310 A CB -1.010 18.186 19.000 0.327 0.000 0.818 310 A HN -0.594 7.799 8.150 0.406 0.000 0.443 311 E N -0.786 119.502 120.200 0.147 0.000 2.051 311 E HA -0.367 4.024 4.350 0.067 0.000 0.192 311 E C 1.787 178.442 176.600 0.091 0.000 0.991 311 E CA 2.597 59.054 56.400 0.095 0.000 0.799 311 E CB -0.397 29.358 29.700 0.091 0.000 0.748 311 E HN -0.348 8.115 8.360 0.170 0.000 0.449 312 A N -1.376 121.515 122.820 0.119 0.000 1.902 312 A HA -0.261 4.112 4.320 0.088 0.000 0.217 312 A C 2.040 179.691 177.584 0.112 0.000 1.181 312 A CA 3.046 55.148 52.037 0.109 0.000 0.623 312 A CB -0.945 18.129 19.000 0.123 0.000 0.818 312 A HN -0.265 7.968 8.150 0.139 0.000 0.443 313 A N -0.994 121.916 122.820 0.150 0.000 1.902 313 A HA -0.212 4.362 4.320 0.137 -0.172 0.217 313 A C 2.012 179.621 177.584 0.041 0.000 1.181 313 A CA 2.821 54.932 52.037 0.124 0.000 0.623 313 A CB -0.579 18.519 19.000 0.163 0.000 0.818 313 A HN -0.435 7.833 8.150 0.197 0.000 0.443 314 L N -2.120 119.110 121.223 0.011 0.000 2.046 314 L HA -0.330 3.990 4.340 -0.033 0.000 0.208 314 L C 3.428 180.308 176.870 0.017 0.000 1.077 314 L CA 2.658 57.491 54.840 -0.011 0.000 0.747 314 L CB -0.259 41.783 42.059 -0.029 0.000 0.896 314 L HN -0.537 7.704 8.230 0.017 0.000 0.432 315 Q N -1.436 118.386 119.800 0.036 0.000 2.224 315 Q HA -0.266 4.095 4.340 0.036 0.000 0.203 315 Q C 1.665 177.690 176.000 0.042 0.000 0.970 315 Q CA 2.566 58.393 55.803 0.040 0.000 0.865 315 Q CB 0.150 28.916 28.738 0.046 0.000 0.922 315 Q HN -0.136 8.160 8.270 0.044 0.000 0.445 316 A N -3.519 119.329 122.820 0.048 0.000 2.238 316 A HA -0.029 4.319 4.320 0.046 0.000 0.208 316 A C -0.810 176.800 177.584 0.043 0.000 1.177 316 A CA -0.108 51.958 52.037 0.049 0.000 0.804 316 A CB -0.029 19.008 19.000 0.062 0.000 0.823 316 A HN -0.490 7.693 8.150 0.054 0.000 0.482 317 N N -4.394 114.327 118.700 0.034 0.000 2.721 317 N HA -0.430 4.321 4.740 0.019 0.000 0.249 317 N C -0.417 175.110 175.510 0.029 0.000 1.072 317 N CA 1.430 54.497 53.050 0.028 0.000 0.710 317 N CB -2.198 36.309 38.487 0.033 0.000 0.993 317 N HN -0.234 7.975 8.380 0.031 0.189 0.547 318 Q N -4.124 115.695 119.800 0.032 0.000 2.311 318 Q HA -0.227 4.139 4.340 0.043 0.000 0.203 318 Q C -0.573 175.436 176.000 0.014 0.000 0.954 318 Q CA 1.995 57.821 55.803 0.039 0.000 0.885 318 Q CB 1.249 30.030 28.738 0.072 0.000 0.963 318 Q HN -0.333 7.934 8.270 0.035 0.023 0.471 319 L N -5.710 115.499 121.223 -0.022 0.000 2.469 319 L HA 0.118 4.428 4.340 -0.051 0.000 0.256 319 L C -1.792 175.021 176.870 -0.095 0.000 1.006 319 L CA -0.834 53.964 54.840 -0.071 0.000 0.832 319 L CB 3.429 45.394 42.059 -0.158 0.000 1.421 319 L HN -0.856 7.320 8.230 -0.021 0.042 0.410 320 D N -0.768 119.549 120.400 -0.138 0.000 2.379 320 D HA 0.187 4.711 4.640 -0.194 0.000 0.218 320 D C -0.521 175.535 176.300 -0.407 0.000 1.006 320 D CA 2.450 56.298 54.000 -0.253 0.000 0.893 320 D CB 2.794 43.441 40.800 -0.254 0.000 1.019 320 D HN 0.096 8.392 8.370 -0.123 0.000 0.503 321 L N -2.497 118.536 121.223 -0.318 0.000 2.370 321 L HA 0.463 4.734 4.340 -0.296 -0.109 0.266 321 L C -2.060 174.661 176.870 -0.248 0.000 1.002 321 L CA -0.964 53.706 54.840 -0.283 0.000 0.818 321 L CB 4.130 46.048 42.059 -0.235 0.000 1.325 321 L HN -0.888 7.196 8.230 -0.243 0.000 0.418 322 V N 1.455 121.219 119.914 -0.251 0.000 2.370 322 V HA 0.208 4.051 4.120 -0.462 0.000 0.279 322 V C -1.074 174.890 176.094 -0.216 0.000 1.029 322 V CA -0.777 61.320 62.300 -0.338 0.000 0.870 322 V CB 0.990 32.603 31.823 -0.349 0.000 0.984 322 V HN 0.511 8.570 8.190 -0.218 0.000 0.451 323 S N 8.694 124.283 115.700 -0.185 0.000 2.475 323 S HA 0.584 5.255 4.470 -0.073 -0.245 0.281 323 S C -1.115 173.479 174.600 -0.010 0.000 1.198 323 S CA 0.092 58.255 58.200 -0.063 0.000 1.063 323 S CB 0.983 64.188 63.200 0.009 0.000 0.972 323 S HN -0.115 8.059 8.310 -0.227 0.000 0.486 324 V N 7.026 126.911 119.914 -0.048 0.000 2.380 324 V HA 0.227 4.266 4.120 -0.134 0.000 0.286 324 V C -0.776 175.310 176.094 -0.014 0.000 1.015 324 V CA -1.631 60.578 62.300 -0.153 0.000 0.834 324 V CB 0.674 32.166 31.823 -0.551 0.000 1.009 324 V HN 0.023 8.189 8.190 -0.040 0.000 0.428 325 G N 7.023 115.803 108.800 -0.034 0.000 2.548 325 G HA2 -0.032 3.968 3.960 0.067 0.000 0.221 325 G HA3 -0.032 3.946 3.960 0.029 0.000 0.221 325 G C 1.163 176.062 174.900 -0.003 0.000 1.796 325 G CA 1.153 46.268 45.100 0.024 0.000 0.889 325 G HN 0.275 8.527 8.290 -0.063 0.000 0.599 326 R N 0.891 121.349 120.500 -0.071 0.000 2.139 326 R HA -0.394 3.937 4.340 -0.015 0.000 0.243 326 R C 2.506 178.742 176.300 -0.106 0.000 1.145 326 R CA 3.401 59.454 56.100 -0.078 0.000 0.976 326 R CB -0.328 29.885 30.300 -0.146 0.000 0.866 326 R HN 0.303 8.513 8.270 -0.101 0.000 0.449 327 A N -2.577 120.110 122.820 -0.223 0.000 2.024 327 A HA -0.128 4.085 4.320 -0.179 0.000 0.220 327 A C 2.094 179.537 177.584 -0.235 0.000 1.164 327 A CA 2.569 54.432 52.037 -0.290 0.000 0.643 327 A CB -1.019 17.604 19.000 -0.628 0.000 0.806 327 A HN 0.367 8.351 8.150 -0.276 0.000 0.451 328 H N -2.434 116.569 119.070 -0.112 0.000 2.512 328 H HA 0.035 4.852 4.556 0.092 -0.206 0.279 328 H C 2.089 177.450 175.328 0.055 0.000 0.999 328 H CA 2.582 58.641 56.048 0.018 0.000 1.283 328 H CB 0.297 30.061 29.762 0.003 0.000 1.421 328 H HN -0.351 7.762 8.280 -0.074 0.122 0.554 329 L N -1.521 119.794 121.223 0.152 0.000 2.109 329 L HA -0.320 4.139 4.340 0.198 0.000 0.207 329 L C 1.314 178.230 176.870 0.077 0.000 1.086 329 L CA 2.000 56.926 54.840 0.143 0.000 0.760 329 L CB -0.280 41.853 42.059 0.123 0.000 0.910 329 L HN -0.644 7.556 8.230 0.115 0.098 0.437 330 A N -2.659 120.176 122.820 0.024 0.000 1.873 330 A HA -0.187 4.126 4.320 -0.011 0.000 0.215 330 A C 0.053 177.637 177.584 -0.000 0.000 1.186 330 A CA 1.955 53.987 52.037 -0.008 0.000 0.616 330 A CB 0.567 19.542 19.000 -0.041 0.000 0.823 330 A HN -0.530 7.624 8.150 0.007 0.000 0.442 331 D N -4.964 115.455 120.400 0.031 0.000 2.386 331 D HA 0.441 5.083 4.640 0.004 0.000 0.247 331 D C -2.161 174.227 176.300 0.146 0.000 1.336 331 D CA -2.280 51.750 54.000 0.051 0.000 0.976 331 D CB 1.711 42.544 40.800 0.055 0.000 1.257 331 D HN -0.579 7.815 8.370 0.040 0.000 0.570 332 P HA -0.062 4.680 4.420 0.319 -0.130 0.225 332 P C -0.356 177.230 177.300 0.478 0.000 1.148 332 P CA 1.009 64.253 63.100 0.241 0.000 0.779 332 P CB 0.456 32.196 31.700 0.065 0.000 0.780 333 H N -3.234 115.988 119.070 0.254 0.000 2.568 333 H HA 0.181 4.924 4.556 0.313 0.000 0.302 333 H C 0.464 176.003 175.328 0.351 0.000 1.065 333 H CA -1.706 54.518 56.048 0.294 0.000 1.140 333 H CB -0.921 28.975 29.762 0.224 0.000 1.474 333 H HN -0.118 8.566 8.280 0.253 -0.253 0.545 334 W N 2.423 123.854 121.300 0.218 0.000 2.321 334 W HA -0.416 4.347 4.660 0.171 0.000 0.306 334 W C -0.054 176.613 176.519 0.247 0.000 1.217 334 W CA 4.975 62.378 57.345 0.097 0.000 1.257 334 W CB 0.026 29.271 29.460 -0.358 0.000 1.145 334 W HN -0.116 8.290 8.180 0.501 0.075 0.509 335 A N -2.443 120.689 122.820 0.520 0.000 1.940 335 A HA -0.474 3.964 4.320 0.197 0.000 0.219 335 A C 1.719 179.421 177.584 0.197 0.000 1.176 335 A CA 2.901 55.143 52.037 0.341 0.000 0.631 335 A CB -1.401 17.889 19.000 0.483 0.000 0.814 335 A HN 0.160 8.731 8.150 0.702 0.000 0.446 336 Y N 0.443 120.800 120.300 0.095 0.000 2.181 336 Y HA -0.330 4.193 4.550 -0.045 0.000 0.288 336 Y C 1.292 177.154 175.900 -0.064 0.000 1.146 336 Y CA 1.927 60.028 58.100 0.001 0.000 1.164 336 Y CB -0.235 38.242 38.460 0.029 0.000 0.982 336 Y HN -0.599 7.919 8.280 0.398 0.000 0.515 337 F N 0.523 120.221 119.950 -0.421 0.000 2.095 337 F HA -0.513 3.630 4.527 -0.640 0.000 0.298 337 F C 0.402 175.862 175.800 -0.566 0.000 1.104 337 F CA 2.982 60.652 58.000 -0.551 0.000 1.232 337 F CB -0.169 38.584 39.000 -0.412 0.000 0.987 337 F HN -0.665 7.692 8.300 0.095 0.000 0.475 338 A N -1.617 120.672 122.820 -0.886 0.000 1.902 338 A HA -0.421 3.291 4.320 -1.013 0.000 0.217 338 A C 1.688 179.008 177.584 -0.440 0.000 1.181 338 A CA 3.072 54.602 52.037 -0.844 0.000 0.623 338 A CB -1.118 17.305 19.000 -0.962 0.000 0.818 338 A HN 0.085 7.757 8.150 -0.796 0.000 0.443 339 A N -1.803 120.798 122.820 -0.364 0.000 1.902 339 A HA -0.435 3.430 4.320 -0.759 0.000 0.217 339 A C 1.854 179.153 177.584 -0.474 0.000 1.181 339 A CA 3.064 54.731 52.037 -0.617 0.000 0.623 339 A CB -0.748 17.796 19.000 -0.760 0.000 0.818 339 A HN -0.062 7.922 8.150 -0.277 0.000 0.443 340 K N -1.851 118.237 120.400 -0.520 0.000 2.025 340 K HA -0.311 3.810 4.320 -0.333 0.000 0.207 340 K C 3.284 179.643 176.600 -0.401 0.000 1.049 340 K CA 3.394 59.419 56.287 -0.437 0.000 0.933 340 K CB -0.147 32.049 32.500 -0.505 0.000 0.714 340 K HN -0.404 7.480 8.250 -0.610 0.000 0.438 341 E N -0.109 119.751 120.200 -0.566 0.000 2.097 341 E HA -0.285 3.829 4.350 -0.394 0.000 0.196 341 E C 1.986 178.424 176.600 -0.270 0.000 1.000 341 E CA 2.653 58.769 56.400 -0.473 0.000 0.804 341 E CB -0.242 29.041 29.700 -0.694 0.000 0.740 341 E HN -0.354 7.545 8.360 -0.769 0.000 0.454 342 L N -5.266 115.815 121.223 -0.236 0.000 2.592 342 L HA 0.091 4.378 4.340 -0.088 0.000 0.227 342 L C 0.323 177.129 176.870 -0.107 0.000 1.127 342 L CA -0.197 54.576 54.840 -0.112 0.000 0.884 342 L CB 0.345 42.397 42.059 -0.011 0.000 1.065 342 L HN -0.569 7.469 8.230 -0.284 0.021 0.457 343 G N -0.942 107.766 108.800 -0.153 0.000 2.176 343 G HA2 -0.357 3.526 3.960 -0.128 0.000 0.252 343 G HA3 -0.357 3.549 3.960 -0.091 0.000 0.252 343 G C 0.378 175.203 174.900 -0.126 0.000 1.024 343 G CA 0.379 45.405 45.100 -0.123 0.000 0.755 343 G HN -0.638 7.358 8.290 -0.194 0.177 0.507 344 V N 1.129 120.925 119.914 -0.197 0.000 2.673 344 V HA -0.170 3.856 4.120 -0.156 0.000 0.303 344 V C 0.076 176.085 176.094 -0.143 0.000 1.046 344 V CA -0.459 61.711 62.300 -0.216 0.000 1.126 344 V CB 0.519 32.059 31.823 -0.471 0.000 0.934 344 V HN -0.641 7.397 8.190 -0.253 0.000 0.487 345 E N 7.254 127.400 120.200 -0.090 0.000 2.384 345 E HA -0.126 4.198 4.350 -0.044 0.000 0.266 345 E C -0.294 176.289 176.600 -0.028 0.000 1.012 345 E CA 0.446 56.816 56.400 -0.050 0.000 0.901 345 E CB 0.012 29.690 29.700 -0.037 0.000 0.967 345 E HN 0.023 8.335 8.360 -0.081 0.000 0.435 346 K N -0.961 119.448 120.400 0.015 0.000 3.257 346 K HA -0.316 4.090 4.320 0.143 0.000 0.270 346 K C -0.012 176.665 176.600 0.130 0.000 0.984 346 K CA 0.321 56.674 56.287 0.110 0.000 0.739 346 K CB -2.019 30.541 32.500 0.099 0.000 1.351 346 K HN 0.430 8.686 8.250 0.010 0.000 0.463 347 A N -0.777 122.073 122.820 0.050 0.000 1.940 347 A HA -0.368 3.891 4.320 -0.101 0.000 0.219 347 A C 1.340 179.029 177.584 0.176 0.000 1.176 347 A CA 2.808 54.850 52.037 0.008 0.000 0.631 347 A CB -0.129 18.823 19.000 -0.080 0.000 0.814 347 A HN 0.152 8.318 8.150 0.027 0.000 0.446 348 S N -1.815 114.008 115.700 0.205 0.000 2.442 348 S HA -0.239 4.219 4.470 -0.021 0.000 0.236 348 S C 1.454 175.905 174.600 -0.248 0.000 1.007 348 S CA 2.066 60.250 58.200 -0.026 0.000 0.965 348 S CB -0.430 62.680 63.200 -0.150 0.000 0.773 348 S HN -0.076 8.333 8.310 0.192 0.016 0.504 349 W N -0.579 120.706 121.300 -0.026 0.000 3.377 349 W HA 0.270 5.020 4.660 -0.048 -0.119 0.277 349 W C 0.601 177.109 176.519 -0.018 0.000 1.311 349 W CA 0.277 57.600 57.345 -0.037 0.000 1.703 349 W CB -0.618 28.819 29.460 -0.038 0.000 1.095 349 W HN -0.523 7.802 8.180 0.292 0.031 0.715 350 T N 0.080 114.701 114.554 0.111 0.000 2.915 350 T HA -0.247 4.189 4.350 0.143 0.000 0.269 350 T C -0.311 174.412 174.700 0.038 0.000 1.071 350 T CA 3.739 65.906 62.100 0.111 0.000 1.132 350 T CB 0.190 69.147 68.868 0.147 0.000 0.878 350 T HN -0.413 7.715 8.240 0.099 0.171 0.479 351 L N -0.797 120.364 121.223 -0.104 0.000 2.387 351 L HA 0.510 4.756 4.340 -0.156 0.000 0.266 351 L C -1.966 174.772 176.870 -0.220 0.000 1.059 351 L CA -2.521 52.200 54.840 -0.199 0.000 0.801 351 L CB 0.098 41.972 42.059 -0.308 0.000 1.223 351 L HN -0.714 7.286 8.230 -0.160 0.133 0.456 352 P HA 0.057 4.401 4.420 -0.126 0.000 0.272 352 P C 0.110 177.179 177.300 -0.385 0.000 1.230 352 P CA -0.381 62.567 63.100 -0.252 0.000 0.788 352 P CB 0.474 31.992 31.700 -0.305 0.000 0.949 353 A N 2.032 124.690 122.820 -0.270 0.000 1.927 353 A HA -0.205 3.634 4.320 -0.802 0.000 0.220 353 A C 0.020 177.453 177.584 -0.252 0.000 1.185 353 A CA 4.521 56.358 52.037 -0.334 0.000 0.639 353 A CB -2.319 16.718 19.000 0.061 0.000 0.820 353 A HN 0.639 8.731 8.150 -0.097 0.000 0.451 354 P HA -0.098 4.430 4.420 0.180 0.000 0.230 354 P C -0.463 177.002 177.300 0.275 0.000 1.158 354 P CA 2.063 65.184 63.100 0.035 0.000 0.769 354 P CB -0.189 31.460 31.700 -0.086 0.000 0.807 355 Y N -4.217 116.057 120.300 -0.043 0.000 2.382 355 Y HA 0.010 4.607 4.550 0.079 0.000 0.292 355 Y C 1.950 177.692 175.900 -0.263 0.000 1.151 355 Y CA -0.621 57.434 58.100 -0.076 0.000 1.198 355 Y CB -0.357 37.988 38.460 -0.192 0.000 1.195 355 Y HN -0.435 7.675 8.280 -0.225 0.035 0.530 356 A N 0.789 123.338 122.820 -0.453 0.000 1.917 356 A HA -0.382 3.570 4.320 -0.764 -0.090 0.219 356 A C 1.455 178.550 177.584 -0.814 0.000 1.182 356 A CA 2.778 54.247 52.037 -0.946 0.000 0.633 356 A CB -0.715 17.111 19.000 -1.956 0.000 0.819 356 A HN 0.074 7.923 8.150 -0.501 0.000 0.448 357 H N -1.810 116.800 119.070 -0.767 0.000 2.421 357 H HA -0.224 4.169 4.556 -0.272 0.000 0.298 357 H C 1.813 176.798 175.328 -0.571 0.000 1.087 357 H CA 3.043 58.738 56.048 -0.589 0.000 1.330 357 H CB 0.104 29.403 29.762 -0.772 0.000 1.388 357 H HN -0.554 7.398 8.280 -0.548 0.000 0.526 358 W N -4.151 117.058 121.300 -0.151 0.000 2.942 358 W HA 0.035 4.599 4.660 -0.160 0.000 0.263 358 W C 0.483 176.926 176.519 -0.126 0.000 1.296 358 W CA 1.634 58.907 57.345 -0.121 0.000 1.504 358 W CB 0.374 29.825 29.460 -0.016 0.000 1.096 358 W HN -0.596 7.422 8.180 -0.221 0.030 0.639 359 L N -2.279 118.934 121.223 -0.017 0.000 2.616 359 L HA 0.041 4.410 4.340 0.048 0.000 0.229 359 L C 0.769 177.636 176.870 -0.006 0.000 1.110 359 L CA -0.462 54.369 54.840 -0.015 0.000 0.884 359 L CB 0.226 42.208 42.059 -0.128 0.000 1.115 359 L HN -0.780 7.379 8.230 -0.118 0.000 0.481 360 E N 0.000 120.163 120.200 -0.062 0.000 2.725 360 E HA 0.000 4.377 4.350 0.045 0.000 0.291 360 E CA 0.000 56.399 56.400 -0.002 0.000 0.976 360 E CB 0.000 29.685 29.700 -0.026 0.000 0.812 360 E HN 0.000 8.279 8.360 -0.136 0.000 0.440