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 3is4_1_B DATA FIRST_RESID 1 DATA SEQUENCE SQLAHNLTLS IFDPVANYRA ARIICTIGPS TQSVEALKGL IQSGMSVARM DATA SEQUENCE NFSHGSHEYH QTTINNVRQA AAELGVNIAI ALDTKGPEIR TGQFVGGDAV DATA SEQUENCE MERGATCYVT TDPAFADKGT KDKFYIDYQN LSKVVRPGNY IYIDDGILIL DATA SEQUENCE QVQSHEDEQT LECTVTNSHT ISDRRGVNLP GCDVDLPAVS AKDRVDLQFG DATA SEQUENCE VEQGVDMIFA SFIRSAEQVG DVRKALGPKG RDIMIICKIE NHQGVQNIDS DATA SEQUENCE IIEESDGIMV ARGDLGVEIP AEKVVVAQKI LISKCNVAGK PVICATQMLE DATA SEQUENCE SMTYNPRPTR AEVSDVANAV FNGADCVMLS GETAKGKYPN EVVQYMARIC DATA SEQUENCE LEAQSALNEY VFFNSIKKLQ HIPMSADEAV CSSAVNSVYE TKAKAMVVLS DATA SEQUENCE NTGRSARLVA KYRPNCPIVC VTTRLQTCRQ LNITQGVESV FFDADKLGHD DATA SEQUENCE EGKEHRVAAG VEFAKSKGYV QTGDYCVVIH AXXXXXXYAN QTRILLVE VARS RESID RESNAME ATOMNAME SS_SHIFT SHIFT RC_SHIFT HM_SHIFT EF_SHIFT SIGMA FORMAT %4d %4s %4s %9.3f %9.3f %9.3f %9.3f %9.3f %9.3f 1 S HA 0.000 4.470 4.470 -0.000 0.000 0.327 1 S C 0.000 174.639 174.600 0.065 0.000 1.055 1 S CA 0.000 58.225 58.200 0.042 0.000 1.107 1 S CB 0.000 63.240 63.200 0.066 0.000 0.593 2 Q N 1.578 121.401 119.800 0.039 0.000 2.170 2 Q HA 0.088 4.423 4.340 -0.008 0.000 0.203 2 Q C 1.765 177.798 176.000 0.056 0.000 0.976 2 Q CA 2.078 57.914 55.803 0.056 0.000 0.858 2 Q CB -0.459 28.279 28.738 0.001 0.000 0.907 2 Q HN 0.741 9.011 8.270 -0.000 0.000 0.433 3 L N -0.476 120.760 121.223 0.021 0.000 1.989 3 L HA -0.190 4.145 4.340 -0.008 0.000 0.211 3 L C 2.114 179.000 176.870 0.026 0.000 1.071 3 L CA 1.745 56.590 54.840 0.007 0.000 0.749 3 L CB -0.611 41.446 42.059 -0.005 0.000 0.890 3 L HN 0.330 8.560 8.230 -0.000 0.000 0.431 4 A N -1.237 121.610 122.820 0.044 0.000 1.908 4 A HA -0.333 3.982 4.320 -0.008 0.000 0.218 4 A C 2.065 179.692 177.584 0.073 0.000 1.181 4 A CA 2.008 54.074 52.037 0.048 0.000 0.627 4 A CB -1.024 18.008 19.000 0.052 0.000 0.818 4 A HN 0.705 8.855 8.150 -0.000 0.000 0.445 5 H N 0.549 119.626 119.070 0.012 0.000 2.353 5 H HA -0.091 4.460 4.556 -0.008 0.000 0.300 5 H C 1.973 177.306 175.328 0.008 0.000 1.090 5 H CA 1.925 57.986 56.048 0.022 0.000 1.327 5 H CB -0.102 29.689 29.762 0.049 0.000 1.383 5 H HN 0.422 8.702 8.280 -0.000 0.000 0.508 6 N N 0.359 119.069 118.700 0.017 0.000 2.137 6 N HA -0.157 4.578 4.740 -0.008 0.000 0.190 6 N C 2.005 177.467 175.510 -0.079 0.000 1.017 6 N CA 1.300 54.319 53.050 -0.053 0.000 0.859 6 N CB -0.367 38.094 38.487 -0.042 0.000 1.002 6 N HN 0.424 8.804 8.380 -0.000 0.000 0.428 7 L N 0.382 121.570 121.223 -0.057 0.000 2.131 7 L HA -0.107 4.228 4.340 -0.008 0.000 0.210 7 L C 2.110 178.942 176.870 -0.064 0.000 1.092 7 L CA 1.512 56.324 54.840 -0.047 0.000 0.759 7 L CB -0.908 41.136 42.059 -0.025 0.000 0.903 7 L HN 0.317 8.547 8.230 -0.000 0.000 0.435 8 T N -2.818 111.672 114.554 -0.108 0.000 3.129 8 T HA 0.194 4.539 4.350 -0.008 0.000 0.251 8 T C 0.688 175.310 174.700 -0.130 0.000 1.117 8 T CA -0.136 61.897 62.100 -0.113 0.000 1.034 8 T CB -0.252 68.534 68.868 -0.137 0.000 0.968 8 T HN 0.038 8.278 8.240 -0.000 0.000 0.526 9 L N 1.570 122.706 121.223 -0.146 0.000 2.399 9 L HA 0.593 4.928 4.340 -0.008 0.000 0.266 9 L C 0.305 177.128 176.870 -0.078 0.000 1.114 9 L CA -0.717 54.048 54.840 -0.125 0.000 0.804 9 L CB 1.451 43.434 42.059 -0.127 0.000 1.146 9 L HN 0.131 8.361 8.230 -0.000 0.000 0.451 10 S N 1.182 116.841 115.700 -0.069 0.000 2.614 10 S HA 0.385 4.850 4.470 -0.008 0.000 0.288 10 S C 0.555 175.054 174.600 -0.169 0.000 1.137 10 S CA -0.819 57.331 58.200 -0.084 0.000 0.992 10 S CB 1.242 64.460 63.200 0.029 0.000 1.026 10 S HN 0.549 8.859 8.310 -0.000 0.000 0.486 11 I N 1.323 121.657 120.570 -0.394 0.000 3.176 11 I HA 0.171 4.336 4.170 -0.008 0.000 0.275 11 I C 0.375 176.219 176.117 -0.455 0.000 1.298 11 I CA 1.004 62.033 61.300 -0.451 0.000 1.445 11 I CB -0.418 37.258 38.000 -0.540 0.000 1.075 11 I HN 0.462 8.672 8.210 -0.000 0.000 0.482 12 F N 0.763 120.723 119.950 0.017 0.000 2.727 12 F HA 0.303 4.825 4.527 -0.008 0.000 0.302 12 F C 0.631 176.440 175.800 0.016 0.000 1.097 12 F CA -0.743 57.266 58.000 0.016 0.000 1.330 12 F CB -0.730 38.277 39.000 0.012 0.000 1.084 12 F HN -0.004 8.296 8.300 -0.000 0.000 0.578 13 D N 1.631 122.093 120.400 0.104 0.000 2.339 13 D HA 0.206 4.841 4.640 -0.008 0.000 0.245 13 D C -2.022 174.313 176.300 0.059 0.000 1.115 13 D CA -1.345 52.700 54.000 0.074 0.000 0.917 13 D CB 0.435 41.260 40.800 0.042 0.000 1.192 13 D HN -0.036 8.334 8.370 -0.000 0.000 0.428 14 P HA 0.063 4.483 4.420 -0.000 0.000 0.271 14 P C -0.347 176.975 177.300 0.037 0.000 1.218 14 P CA -0.558 62.572 63.100 0.049 0.000 0.780 14 P CB 0.453 32.182 31.700 0.050 0.000 0.901 15 V N -0.269 119.663 119.914 0.029 0.000 3.237 15 V HA 0.474 4.589 4.120 -0.008 0.000 0.305 15 V C 0.570 176.671 176.094 0.012 0.000 1.096 15 V CA -1.032 61.275 62.300 0.012 0.000 1.130 15 V CB -0.597 31.227 31.823 0.001 0.000 1.048 15 V HN 0.720 8.910 8.190 -0.000 0.000 0.484 16 A N 2.168 124.974 122.820 -0.024 0.000 2.492 16 A HA 0.143 4.458 4.320 -0.008 0.000 0.236 16 A C 1.095 178.688 177.584 0.016 0.000 1.078 16 A CA 0.382 52.398 52.037 -0.035 0.000 0.773 16 A CB -0.667 18.210 19.000 -0.205 0.000 1.023 16 A HN 1.234 9.384 8.150 -0.000 0.000 0.504 17 N N -0.511 118.268 118.700 0.132 0.000 2.434 17 N HA 0.223 4.958 4.740 -0.008 0.000 0.196 17 N C -0.383 175.341 175.510 0.357 0.000 1.183 17 N CA 0.220 53.403 53.050 0.221 0.000 0.849 17 N CB -0.139 38.497 38.487 0.249 0.000 0.992 17 N HN 0.747 9.127 8.380 -0.000 0.000 0.460 18 Y N -2.289 118.050 120.300 0.065 0.000 2.581 18 Y HA 0.479 5.024 4.550 -0.009 0.000 0.337 18 Y C -1.277 174.634 175.900 0.018 0.000 1.108 18 Y CA -1.701 56.435 58.100 0.060 0.000 1.033 18 Y CB 1.087 39.506 38.460 -0.067 0.000 1.318 18 Y HN -0.194 8.086 8.280 -0.000 0.000 0.459 19 R N 2.073 122.580 120.500 0.012 0.000 2.338 19 R HA 0.759 5.094 4.340 -0.008 0.000 0.317 19 R C -0.149 176.152 176.300 0.001 0.000 0.968 19 R CA 0.170 56.213 56.100 -0.094 0.000 0.849 19 R CB 1.655 31.941 30.300 -0.023 0.000 1.128 19 R HN 1.044 9.314 8.270 -0.000 0.000 0.448 20 A N 4.311 127.076 122.820 -0.092 0.000 1.878 20 A HA 0.220 4.535 4.320 -0.008 0.000 0.213 20 A C 0.892 178.475 177.584 -0.002 0.000 1.192 20 A CA 0.833 52.886 52.037 0.026 0.000 0.619 20 A CB -0.292 18.704 19.000 -0.007 0.000 0.837 20 A HN 0.780 8.930 8.150 -0.000 0.000 0.446 21 A N 0.463 123.250 122.820 -0.056 0.000 2.425 21 A HA 0.501 4.816 4.320 -0.008 0.000 0.242 21 A C 0.221 177.794 177.584 -0.018 0.000 1.077 21 A CA -0.157 51.849 52.037 -0.052 0.000 0.781 21 A CB 0.147 19.094 19.000 -0.089 0.000 1.020 21 A HN 0.392 8.542 8.150 -0.000 0.000 0.494 22 R N 0.604 121.099 120.500 -0.010 0.000 2.589 22 R HA 0.564 4.899 4.340 -0.008 0.000 0.293 22 R C -1.178 175.128 176.300 0.011 0.000 0.963 22 R CA -0.484 55.624 56.100 0.013 0.000 0.905 22 R CB 1.338 31.655 30.300 0.028 0.000 1.144 22 R HN 0.673 8.943 8.270 -0.000 0.000 0.459 23 I N 3.751 124.336 120.570 0.024 0.000 2.354 23 I HA 0.386 4.551 4.170 -0.008 0.000 0.292 23 I C 0.164 176.311 176.117 0.049 0.000 0.989 23 I CA -0.492 60.824 61.300 0.026 0.000 1.188 23 I CB 1.293 39.307 38.000 0.024 0.000 1.342 23 I HN 0.302 8.512 8.210 -0.000 0.000 0.457 24 I N 5.603 126.208 120.570 0.059 0.000 2.359 24 I HA 0.372 4.537 4.170 -0.008 0.000 0.294 24 I C -0.661 175.510 176.117 0.090 0.000 0.987 24 I CA -0.379 60.979 61.300 0.097 0.000 1.225 24 I CB 1.377 39.464 38.000 0.145 0.000 1.366 24 I HN 0.526 8.736 8.210 -0.000 0.000 0.466 25 C N 3.676 123.032 119.300 0.093 0.000 2.408 25 C HA 0.447 4.902 4.460 -0.008 0.000 0.321 25 C C 0.484 175.535 174.990 0.102 0.000 1.245 25 C CA -0.646 58.424 59.018 0.085 0.000 1.523 25 C CB 1.250 29.031 27.740 0.068 0.000 2.178 25 C HN 0.682 8.912 8.230 -0.000 0.000 0.488 26 T N 4.867 119.486 114.554 0.108 0.000 2.794 26 T HA 0.325 4.670 4.350 -0.008 0.000 0.296 26 T C 0.301 175.073 174.700 0.120 0.000 0.949 26 T CA -0.108 62.069 62.100 0.129 0.000 1.101 26 T CB 0.104 69.054 68.868 0.137 0.000 0.905 26 T HN 0.356 8.597 8.240 -0.000 0.000 0.516 27 I N 3.005 123.657 120.570 0.137 0.000 2.472 27 I HA 0.633 4.798 4.170 -0.008 0.000 0.290 27 I C 0.965 177.193 176.117 0.186 0.000 1.016 27 I CA -0.203 61.176 61.300 0.131 0.000 1.348 27 I CB 0.650 38.713 38.000 0.105 0.000 1.417 27 I HN 0.812 9.022 8.210 -0.000 0.000 0.521 28 G N 5.765 114.663 108.800 0.165 0.000 2.731 28 G HA2 0.483 4.438 3.960 -0.008 0.000 0.309 28 G HA3 0.483 4.438 3.960 -0.008 0.000 0.309 28 G C -2.624 172.387 174.900 0.186 0.000 1.273 28 G CA -0.415 44.815 45.100 0.217 0.000 0.798 28 G HN 0.274 8.564 8.290 -0.000 0.000 0.509 29 P HA -0.010 4.410 4.420 -0.000 0.000 0.218 29 P C 1.997 179.341 177.300 0.073 0.000 1.148 29 P CA 1.665 64.838 63.100 0.123 0.000 0.822 29 P CB 0.219 31.963 31.700 0.074 0.000 0.784 30 S N -1.344 114.391 115.700 0.059 0.000 2.419 30 S HA -0.084 4.381 4.470 -0.008 0.000 0.233 30 S C 1.473 176.094 174.600 0.035 0.000 1.016 30 S CA 1.856 60.078 58.200 0.037 0.000 0.974 30 S CB -0.851 62.364 63.200 0.026 0.000 0.786 30 S HN 0.381 8.691 8.310 -0.000 0.000 0.492 31 T N -2.144 112.438 114.554 0.048 0.000 3.111 31 T HA 0.294 4.639 4.350 -0.008 0.000 0.284 31 T C 1.003 175.720 174.700 0.028 0.000 0.983 31 T CA -0.359 61.764 62.100 0.039 0.000 0.900 31 T CB 0.178 69.074 68.868 0.048 0.000 1.132 31 T HN 0.197 8.437 8.240 -0.000 0.000 0.531 32 Q N 2.213 122.026 119.800 0.021 0.000 2.311 32 Q HA 0.073 4.408 4.340 -0.008 0.000 0.203 32 Q C 1.014 176.996 176.000 -0.031 0.000 0.954 32 Q CA 0.420 56.209 55.803 -0.024 0.000 0.885 32 Q CB 0.111 28.802 28.738 -0.078 0.000 0.963 32 Q HN 0.677 8.947 8.270 -0.000 0.000 0.471 33 S N -0.774 114.919 115.700 -0.011 0.000 2.585 33 S HA 0.045 4.510 4.470 -0.008 0.000 0.273 33 S C 1.415 176.010 174.600 -0.008 0.000 1.339 33 S CA -0.122 58.072 58.200 -0.011 0.000 1.028 33 S CB 1.370 64.569 63.200 -0.002 0.000 0.906 33 S HN 0.243 8.553 8.310 -0.000 0.000 0.528 34 V N -0.286 119.623 119.914 -0.009 0.000 2.332 34 V HA -0.131 3.984 4.120 -0.008 0.000 0.248 34 V C 2.220 178.315 176.094 0.002 0.000 1.055 34 V CA 1.922 64.219 62.300 -0.005 0.000 1.038 34 V CB -1.156 30.663 31.823 -0.007 0.000 0.651 34 V HN 0.837 9.027 8.190 -0.000 0.000 0.450 35 E N 1.251 121.453 120.200 0.003 0.000 2.072 35 E HA -0.069 4.276 4.350 -0.008 0.000 0.191 35 E C 2.423 179.030 176.600 0.011 0.000 0.985 35 E CA 1.749 58.153 56.400 0.007 0.000 0.801 35 E CB -0.690 29.014 29.700 0.007 0.000 0.750 35 E HN 0.745 9.105 8.360 -0.000 0.000 0.452 36 A N 0.926 123.753 122.820 0.011 0.000 1.930 36 A HA -0.081 4.234 4.320 -0.008 0.000 0.217 36 A C 2.367 179.963 177.584 0.020 0.000 1.175 36 A CA 0.811 52.858 52.037 0.017 0.000 0.627 36 A CB -0.575 18.435 19.000 0.017 0.000 0.815 36 A HN 0.164 8.314 8.150 -0.000 0.000 0.443 37 L N -0.623 120.610 121.223 0.015 0.000 2.093 37 L HA -0.170 4.165 4.340 -0.008 0.000 0.208 37 L C 2.563 179.444 176.870 0.019 0.000 1.085 37 L CA 1.373 56.223 54.840 0.017 0.000 0.755 37 L CB -0.358 41.706 42.059 0.009 0.000 0.904 37 L HN 0.326 8.556 8.230 -0.000 0.000 0.435 38 K N -0.020 120.390 120.400 0.016 0.000 2.057 38 K HA -0.127 4.188 4.320 -0.008 0.000 0.207 38 K C 2.133 178.748 176.600 0.024 0.000 1.049 38 K CA 1.403 57.701 56.287 0.018 0.000 0.931 38 K CB -0.519 31.990 32.500 0.015 0.000 0.714 38 K HN 0.406 8.656 8.250 -0.000 0.000 0.440 39 G N 1.625 110.439 108.800 0.025 0.000 2.440 39 G HA2 -0.239 3.716 3.960 -0.008 0.000 0.218 39 G HA3 -0.239 3.716 3.960 -0.008 0.000 0.218 39 G C 1.439 176.360 174.900 0.036 0.000 1.154 39 G CA 0.491 45.609 45.100 0.030 0.000 0.767 39 G HN 0.052 8.342 8.290 -0.000 0.000 0.552 40 L N 0.695 121.940 121.223 0.036 0.000 2.017 40 L HA 0.036 4.371 4.340 -0.008 0.000 0.208 40 L C 2.890 179.784 176.870 0.041 0.000 1.073 40 L CA 1.102 55.967 54.840 0.041 0.000 0.745 40 L CB -0.749 41.334 42.059 0.040 0.000 0.894 40 L HN 0.244 8.474 8.230 -0.000 0.000 0.432 41 I N -1.146 119.446 120.570 0.036 0.000 2.127 41 I HA -0.371 3.794 4.170 -0.008 0.000 0.241 41 I C 2.472 178.614 176.117 0.042 0.000 1.075 41 I CA 1.289 62.612 61.300 0.038 0.000 1.334 41 I CB -0.361 37.658 38.000 0.032 0.000 1.040 41 I HN 0.356 8.566 8.210 -0.000 0.000 0.405 42 Q N 0.119 119.942 119.800 0.038 0.000 2.170 42 Q HA -0.157 4.178 4.340 -0.008 0.000 0.203 42 Q C 2.299 178.326 176.000 0.043 0.000 0.976 42 Q CA 1.648 57.475 55.803 0.039 0.000 0.858 42 Q CB -0.114 28.645 28.738 0.034 0.000 0.907 42 Q HN 0.426 8.696 8.270 -0.000 0.000 0.433 43 S N -1.162 114.565 115.700 0.045 0.000 2.461 43 S HA 0.049 4.514 4.470 -0.008 0.000 0.228 43 S C 1.219 175.850 174.600 0.051 0.000 1.005 43 S CA 0.874 59.103 58.200 0.050 0.000 0.942 43 S CB 0.485 63.717 63.200 0.053 0.000 0.776 43 S HN 0.651 8.961 8.310 -0.000 0.000 0.514 44 G N 0.882 109.712 108.800 0.050 0.000 2.276 44 G HA2 -0.147 3.808 3.960 -0.008 0.000 0.177 44 G HA3 -0.147 3.808 3.960 -0.008 0.000 0.177 44 G C -0.021 174.907 174.900 0.048 0.000 1.017 44 G CA -0.284 44.845 45.100 0.049 0.000 0.750 44 G HN 0.382 8.672 8.290 -0.000 0.000 0.506 45 M N 1.576 121.205 119.600 0.047 0.000 2.217 45 M HA 0.550 5.025 4.480 -0.008 0.000 0.352 45 M C 0.975 177.303 176.300 0.048 0.000 1.376 45 M CA 0.619 55.947 55.300 0.048 0.000 1.107 45 M CB 0.913 33.541 32.600 0.047 0.000 1.723 45 M HN -0.034 8.256 8.290 -0.000 0.000 0.461 46 S N 3.259 118.989 115.700 0.050 0.000 2.506 46 S HA 0.240 4.705 4.470 -0.008 0.000 0.219 46 S C -0.240 174.388 174.600 0.046 0.000 1.031 46 S CA -0.314 57.915 58.200 0.049 0.000 0.911 46 S CB 0.590 63.822 63.200 0.052 0.000 0.812 46 S HN 0.639 8.949 8.310 -0.000 0.000 0.497 47 V N 1.630 121.577 119.914 0.056 0.000 2.623 47 V HA 0.732 4.847 4.120 -0.008 0.000 0.304 47 V C -0.715 175.413 176.094 0.057 0.000 1.054 47 V CA -1.189 61.146 62.300 0.059 0.000 0.882 47 V CB 1.453 33.339 31.823 0.104 0.000 1.002 47 V HN 0.229 8.419 8.190 -0.000 0.000 0.424 48 A N 4.660 127.498 122.820 0.029 0.000 2.252 48 A HA 0.696 5.011 4.320 -0.008 0.000 0.309 48 A C 0.071 177.664 177.584 0.015 0.000 1.285 48 A CA -0.459 51.598 52.037 0.033 0.000 0.900 48 A CB 0.297 19.311 19.000 0.022 0.000 1.157 48 A HN 0.857 9.007 8.150 -0.000 0.000 0.536 49 R N 3.604 124.139 120.500 0.059 0.000 2.265 49 R HA 0.543 4.878 4.340 -0.008 0.000 0.319 49 R C -0.884 175.475 176.300 0.097 0.000 1.006 49 R CA -0.304 55.825 56.100 0.048 0.000 0.880 49 R CB 0.520 30.925 30.300 0.174 0.000 1.077 49 R HN 0.769 9.039 8.270 -0.000 0.000 0.454 50 M N 3.916 123.564 119.600 0.080 0.000 2.088 50 M HA 0.172 4.647 4.480 -0.008 0.000 0.346 50 M C -0.200 176.236 176.300 0.226 0.000 1.111 50 M CA -0.685 54.739 55.300 0.207 0.000 1.017 50 M CB 1.364 34.123 32.600 0.266 0.000 1.568 50 M HN 0.429 8.719 8.290 -0.000 0.000 0.445 51 N N 2.651 121.514 118.700 0.272 0.000 2.439 51 N HA 0.141 4.876 4.740 -0.008 0.000 0.243 51 N C -0.453 175.204 175.510 0.245 0.000 1.088 51 N CA -0.070 53.122 53.050 0.237 0.000 0.940 51 N CB 0.210 38.820 38.487 0.206 0.000 1.180 51 N HN 0.463 8.843 8.380 -0.000 0.000 0.505 52 F N 1.296 121.196 119.950 -0.083 0.000 2.795 52 F HA 0.095 4.617 4.527 -0.008 0.000 0.303 52 F C 2.006 177.804 175.800 -0.003 0.000 1.186 52 F CA 0.140 58.100 58.000 -0.067 0.000 1.415 52 F CB -0.132 38.799 39.000 -0.115 0.000 1.106 52 F HN 0.449 8.749 8.300 -0.000 0.000 0.558 53 S N -1.757 113.953 115.700 0.018 0.000 2.461 53 S HA -0.028 4.437 4.470 -0.008 0.000 0.228 53 S C 0.275 174.692 174.600 -0.306 0.000 1.005 53 S CA 0.631 58.711 58.200 -0.200 0.000 0.942 53 S CB -0.309 62.660 63.200 -0.385 0.000 0.776 53 S HN 0.426 8.736 8.310 -0.000 0.000 0.514 54 H N -0.985 118.138 119.070 0.089 0.000 2.797 54 H HA 0.595 5.146 4.556 -0.008 0.000 0.372 54 H C 0.364 175.663 175.328 -0.048 0.000 1.168 54 H CA -0.288 55.758 56.048 -0.003 0.000 1.163 54 H CB 1.534 31.273 29.762 -0.040 0.000 1.778 54 H HN 0.253 8.533 8.280 -0.000 0.000 0.551 55 G N 0.628 109.369 108.800 -0.097 0.000 2.733 55 G HA2 -0.113 3.843 3.960 -0.008 0.000 0.686 55 G HA3 -0.113 3.843 3.960 -0.008 0.000 0.686 55 G C -0.166 174.590 174.900 -0.241 0.000 1.373 55 G CA -0.371 44.499 45.100 -0.383 0.000 0.838 55 G HN 0.892 9.181 8.290 -0.000 0.000 0.588 56 S N -0.559 115.005 115.700 -0.227 0.000 2.693 56 S HA 0.542 5.007 4.470 -0.008 0.000 0.276 56 S C 1.164 175.719 174.600 -0.074 0.000 1.192 56 S CA 0.330 58.455 58.200 -0.124 0.000 0.994 56 S CB 1.317 64.460 63.200 -0.094 0.000 1.012 56 S HN 0.762 9.072 8.310 -0.000 0.000 0.550 57 H N 0.082 118.992 119.070 -0.267 0.000 2.387 57 H HA -0.131 4.420 4.556 -0.008 0.000 0.299 57 H C 2.128 177.332 175.328 -0.207 0.000 1.099 57 H CA 1.790 57.552 56.048 -0.477 0.000 1.315 57 H CB 0.101 29.394 29.762 -0.781 0.000 1.380 57 H HN 0.858 9.138 8.280 -0.000 0.000 0.513 58 E N 0.545 120.759 120.200 0.022 0.000 2.110 58 E HA -0.222 4.123 4.350 -0.008 0.000 0.193 58 E C 1.970 178.593 176.600 0.039 0.000 0.988 58 E CA 0.864 57.296 56.400 0.054 0.000 0.804 58 E CB -0.116 29.604 29.700 0.035 0.000 0.745 58 E HN 0.474 8.834 8.360 -0.000 0.000 0.458 59 Y N 0.839 121.053 120.300 -0.144 0.000 2.145 59 Y HA -0.261 4.284 4.550 -0.008 0.000 0.286 59 Y C 2.211 177.990 175.900 -0.201 0.000 1.145 59 Y CA 2.218 60.185 58.100 -0.222 0.000 1.148 59 Y CB -0.208 38.025 38.460 -0.377 0.000 0.981 59 Y HN 0.204 8.484 8.280 -0.000 0.000 0.507 60 H N -0.866 118.212 119.070 0.014 0.000 2.428 60 H HA -0.105 4.446 4.556 -0.008 0.000 0.296 60 H C 2.078 177.479 175.328 0.121 0.000 1.062 60 H CA 1.440 57.503 56.048 0.025 0.000 1.350 60 H CB -0.288 29.483 29.762 0.014 0.000 1.403 60 H HN 0.380 8.660 8.280 -0.000 0.000 0.533 61 Q N 0.810 120.786 119.800 0.293 0.000 2.096 61 Q HA -0.111 4.224 4.340 -0.008 0.000 0.204 61 Q C 2.101 178.141 176.000 0.067 0.000 0.982 61 Q CA 2.184 58.133 55.803 0.243 0.000 0.850 61 Q CB -0.314 28.585 28.738 0.269 0.000 0.901 61 Q HN 0.311 8.581 8.270 -0.000 0.000 0.422 62 T N -0.388 114.148 114.554 -0.029 0.000 2.746 62 T HA -0.130 4.215 4.350 -0.008 0.000 0.267 62 T C 1.719 176.350 174.700 -0.115 0.000 1.039 62 T CA 1.670 63.714 62.100 -0.094 0.000 1.142 62 T CB -0.580 68.190 68.868 -0.164 0.000 0.866 62 T HN 0.396 8.636 8.240 -0.000 0.000 0.444 63 T N 2.217 116.675 114.554 -0.161 0.000 2.684 63 T HA -0.020 4.325 4.350 -0.008 0.000 0.267 63 T C 1.975 176.664 174.700 -0.018 0.000 1.036 63 T CA 1.049 63.094 62.100 -0.092 0.000 1.148 63 T CB -0.470 68.376 68.868 -0.038 0.000 0.863 63 T HN 0.312 8.552 8.240 -0.000 0.000 0.436 64 I N 1.520 122.103 120.570 0.021 0.000 2.163 64 I HA -0.241 3.924 4.170 -0.008 0.000 0.243 64 I C 2.429 178.536 176.117 -0.015 0.000 1.085 64 I CA 1.140 62.445 61.300 0.008 0.000 1.347 64 I CB -0.389 37.618 38.000 0.012 0.000 1.044 64 I HN 0.189 8.399 8.210 -0.000 0.000 0.408 65 N N 0.924 119.616 118.700 -0.013 0.000 2.120 65 N HA -0.149 4.586 4.740 -0.008 0.000 0.188 65 N C 1.575 177.071 175.510 -0.023 0.000 1.024 65 N CA 1.262 54.301 53.050 -0.019 0.000 0.852 65 N CB -0.623 37.857 38.487 -0.012 0.000 1.003 65 N HN 0.333 8.713 8.380 -0.000 0.000 0.424 66 N N 0.403 119.086 118.700 -0.029 0.000 2.216 66 N HA -0.043 4.692 4.740 -0.008 0.000 0.183 66 N C 1.848 177.346 175.510 -0.020 0.000 1.017 66 N CA 0.355 53.389 53.050 -0.027 0.000 0.861 66 N CB -0.490 37.974 38.487 -0.038 0.000 0.986 66 N HN 0.012 8.392 8.380 -0.000 0.000 0.428 67 V N 1.479 121.382 119.914 -0.019 0.000 2.255 67 V HA -0.226 3.889 4.120 -0.008 0.000 0.247 67 V C 2.293 178.376 176.094 -0.019 0.000 1.051 67 V CA 1.615 63.907 62.300 -0.014 0.000 1.018 67 V CB -0.382 31.435 31.823 -0.011 0.000 0.641 67 V HN 0.259 8.449 8.190 -0.000 0.000 0.445 68 R N -0.401 120.083 120.500 -0.026 0.000 2.091 68 R HA -0.247 4.088 4.340 -0.008 0.000 0.238 68 R C 2.399 178.683 176.300 -0.027 0.000 1.136 68 R CA 1.902 57.982 56.100 -0.033 0.000 0.959 68 R CB -0.347 29.929 30.300 -0.041 0.000 0.856 68 R HN 0.509 8.779 8.270 -0.000 0.000 0.437 69 Q N 0.486 120.273 119.800 -0.022 0.000 2.079 69 Q HA -0.060 4.275 4.340 -0.008 0.000 0.200 69 Q C 1.939 177.932 176.000 -0.012 0.000 0.974 69 Q CA 1.899 57.692 55.803 -0.017 0.000 0.840 69 Q CB -0.197 28.532 28.738 -0.015 0.000 0.898 69 Q HN 0.322 8.592 8.270 -0.000 0.000 0.430 70 A N 0.453 123.267 122.820 -0.009 0.000 1.877 70 A HA -0.062 4.253 4.320 -0.008 0.000 0.216 70 A C 2.316 179.899 177.584 -0.001 0.000 1.186 70 A CA 1.934 53.969 52.037 -0.003 0.000 0.620 70 A CB -1.276 17.725 19.000 0.000 0.000 0.822 70 A HN 0.538 8.688 8.150 -0.000 0.000 0.443 71 A N -0.165 122.651 122.820 -0.006 0.000 1.902 71 A HA 0.145 4.460 4.320 -0.008 0.000 0.217 71 A C 2.508 180.087 177.584 -0.008 0.000 1.181 71 A CA 2.167 54.201 52.037 -0.006 0.000 0.623 71 A CB -1.025 17.965 19.000 -0.015 0.000 0.818 71 A HN 1.085 9.235 8.150 -0.000 0.000 0.443 72 A N -0.339 122.471 122.820 -0.016 0.000 1.933 72 A HA -0.165 4.150 4.320 -0.008 0.000 0.218 72 A C 1.907 179.487 177.584 -0.006 0.000 1.175 72 A CA 1.633 53.660 52.037 -0.017 0.000 0.628 72 A CB -0.497 18.489 19.000 -0.023 0.000 0.814 72 A HN 0.637 8.787 8.150 -0.000 0.000 0.444 73 E N -0.525 119.673 120.200 -0.003 0.000 2.204 73 E HA -0.044 4.301 4.350 -0.008 0.000 0.194 73 E C 1.360 177.965 176.600 0.008 0.000 0.989 73 E CA 0.759 57.160 56.400 0.002 0.000 0.824 73 E CB -0.130 29.571 29.700 0.002 0.000 0.756 73 E HN 0.622 8.982 8.360 -0.000 0.000 0.477 74 L N -0.636 120.593 121.223 0.010 0.000 2.607 74 L HA 0.214 4.549 4.340 -0.008 0.000 0.228 74 L C 1.086 177.970 176.870 0.024 0.000 1.123 74 L CA 0.097 54.948 54.840 0.018 0.000 0.890 74 L CB 0.285 42.357 42.059 0.022 0.000 1.103 74 L HN 0.166 8.396 8.230 -0.000 0.000 0.468 75 G N 1.576 110.387 108.800 0.019 0.000 2.273 75 G HA2 -0.225 3.730 3.960 -0.008 0.000 0.280 75 G HA3 -0.225 3.730 3.960 -0.008 0.000 0.280 75 G C 0.046 174.966 174.900 0.035 0.000 1.047 75 G CA 0.444 45.560 45.100 0.026 0.000 0.869 75 G HN 0.298 8.588 8.290 -0.000 0.000 0.502 76 V N -4.013 115.915 119.914 0.023 0.000 3.126 76 V HA 0.860 4.975 4.120 -0.008 0.000 0.314 76 V C -0.296 175.797 176.094 -0.001 0.000 1.138 76 V CA -1.887 60.429 62.300 0.027 0.000 1.034 76 V CB 2.239 34.086 31.823 0.040 0.000 1.075 76 V HN 0.150 8.340 8.190 -0.000 0.000 0.442 77 N N 2.154 120.852 118.700 -0.003 0.000 2.417 77 N HA 0.596 5.331 4.740 -0.008 0.000 0.274 77 N C -1.319 174.184 175.510 -0.012 0.000 0.987 77 N CA -0.298 52.735 53.050 -0.028 0.000 0.912 77 N CB 1.914 40.373 38.487 -0.047 0.000 1.177 77 N HN 0.594 8.974 8.380 -0.000 0.000 0.490 78 I N 1.345 121.904 120.570 -0.018 0.000 2.433 78 I HA 0.367 4.532 4.170 -0.008 0.000 0.292 78 I C 0.517 176.623 176.117 -0.019 0.000 1.001 78 I CA -1.013 60.283 61.300 -0.007 0.000 1.119 78 I CB 1.322 39.321 38.000 -0.001 0.000 1.289 78 I HN 0.374 8.584 8.210 -0.000 0.000 0.438 79 A N 7.408 130.223 122.820 -0.009 0.000 2.407 79 A HA 0.643 4.958 4.320 -0.008 0.000 0.248 79 A C -0.179 177.379 177.584 -0.042 0.000 1.082 79 A CA -0.135 51.887 52.037 -0.024 0.000 0.785 79 A CB 0.260 19.258 19.000 -0.004 0.000 1.020 79 A HN 0.637 8.787 8.150 -0.000 0.000 0.489 80 I N 1.576 122.100 120.570 -0.077 0.000 2.382 80 I HA 0.497 4.662 4.170 -0.008 0.000 0.286 80 I C 0.368 176.371 176.117 -0.190 0.000 1.002 80 I CA -0.119 61.119 61.300 -0.103 0.000 1.135 80 I CB 1.791 39.739 38.000 -0.085 0.000 1.288 80 I HN 0.682 8.892 8.210 -0.000 0.000 0.448 81 A N 7.378 130.032 122.820 -0.277 0.000 2.318 81 A HA 0.686 5.001 4.320 -0.008 0.000 0.324 81 A C -0.942 176.350 177.584 -0.488 0.000 1.170 81 A CA -0.514 51.183 52.037 -0.568 0.000 0.810 81 A CB 1.179 19.488 19.000 -1.151 0.000 1.198 81 A HN 0.767 8.918 8.150 -0.000 0.000 0.484 82 L N 2.855 123.778 121.223 -0.500 0.000 2.262 82 L HA 0.341 4.677 4.340 -0.008 0.000 0.288 82 L C -0.810 175.825 176.870 -0.392 0.000 1.035 82 L CA -0.520 54.035 54.840 -0.475 0.000 0.820 82 L CB 0.750 42.443 42.059 -0.611 0.000 1.204 82 L HN 0.702 8.932 8.230 -0.000 0.000 0.424 83 D N 4.062 124.340 120.400 -0.203 0.000 2.359 83 D HA 0.126 4.761 4.640 -0.008 0.000 0.230 83 D C -0.117 176.193 176.300 0.016 0.000 1.118 83 D CA -0.183 53.826 54.000 0.014 0.000 0.844 83 D CB 1.325 42.229 40.800 0.173 0.000 1.059 83 D HN 0.573 8.943 8.370 -0.000 0.000 0.493 84 T N 1.003 115.559 114.554 0.004 0.000 2.926 84 T HA 0.076 4.421 4.350 -0.008 0.000 0.307 84 T C 1.337 176.079 174.700 0.069 0.000 1.059 84 T CA -0.476 61.635 62.100 0.018 0.000 1.122 84 T CB 1.876 70.751 68.868 0.012 0.000 0.972 84 T HN 0.405 8.645 8.240 -0.000 0.000 0.545 85 K N 2.321 122.775 120.400 0.089 0.000 2.063 85 K HA 0.109 4.424 4.320 -0.008 0.000 0.208 85 K C 1.158 177.773 176.600 0.025 0.000 1.048 85 K CA 1.269 57.586 56.287 0.050 0.000 0.928 85 K CB -0.983 31.553 32.500 0.061 0.000 0.713 85 K HN 1.226 9.476 8.250 -0.000 0.000 0.442 86 G N 0.310 109.136 108.800 0.043 0.000 2.781 86 G HA2 -0.178 3.777 3.960 -0.008 0.000 0.683 86 G HA3 -0.178 3.777 3.960 -0.008 0.000 0.683 86 G C -2.729 172.183 174.900 0.020 0.000 1.390 86 G CA -0.563 44.565 45.100 0.046 0.000 0.850 86 G HN 0.180 8.470 8.290 -0.000 0.000 0.557 87 P HA 0.420 4.840 4.420 -0.000 0.000 0.271 87 P C -0.219 177.022 177.300 -0.098 0.000 1.218 87 P CA 0.244 63.353 63.100 0.016 0.000 0.780 87 P CB 0.832 32.584 31.700 0.087 0.000 0.901 88 E N 1.187 121.332 120.200 -0.091 0.000 2.340 88 E HA 0.482 4.827 4.350 -0.008 0.000 0.273 88 E C -0.762 175.773 176.600 -0.107 0.000 0.891 88 E CA -0.702 55.607 56.400 -0.152 0.000 0.757 88 E CB 1.932 31.573 29.700 -0.098 0.000 1.231 88 E HN 0.318 8.678 8.360 -0.000 0.000 0.439 89 I N 2.858 123.343 120.570 -0.143 0.000 2.330 89 I HA 0.415 4.580 4.170 -0.008 0.000 0.289 89 I C -0.056 176.046 176.117 -0.025 0.000 1.001 89 I CA -0.491 60.763 61.300 -0.076 0.000 1.193 89 I CB 0.822 38.753 38.000 -0.116 0.000 1.345 89 I HN 0.229 8.439 8.210 -0.000 0.000 0.461 90 R N 3.139 123.646 120.500 0.011 0.000 2.854 90 R HA 0.558 4.893 4.340 -0.008 0.000 0.271 90 R C -0.231 176.105 176.300 0.060 0.000 0.994 90 R CA -0.850 55.278 56.100 0.046 0.000 0.945 90 R CB 2.197 32.530 30.300 0.056 0.000 1.194 90 R HN 0.656 8.926 8.270 -0.000 0.000 0.476 91 T N -1.365 113.263 114.554 0.123 0.000 2.788 91 T HA 0.342 4.687 4.350 -0.008 0.000 0.287 91 T C 0.923 175.700 174.700 0.129 0.000 1.007 91 T CA -0.456 61.747 62.100 0.172 0.000 1.005 91 T CB 1.107 70.149 68.868 0.289 0.000 1.012 91 T HN 0.621 8.861 8.240 -0.000 0.000 0.530 92 G N -0.270 108.618 108.800 0.147 0.000 2.504 92 G HA2 0.453 4.408 3.960 -0.008 0.000 0.257 92 G HA3 0.453 4.408 3.960 -0.008 0.000 0.257 92 G C -0.418 174.388 174.900 -0.158 0.000 1.451 92 G CA -0.812 44.378 45.100 0.150 0.000 1.059 92 G HN 0.835 9.125 8.290 -0.000 0.000 0.550 93 Q N -1.300 118.399 119.800 -0.168 0.000 2.212 93 Q HA 0.530 4.865 4.340 -0.008 0.000 0.238 93 Q C -1.381 174.374 176.000 -0.409 0.000 0.955 93 Q CA -0.173 55.519 55.803 -0.184 0.000 0.906 93 Q CB 1.683 30.398 28.738 -0.038 0.000 1.215 93 Q HN 0.362 8.632 8.270 -0.000 0.000 0.478 94 F N -0.541 119.443 119.950 0.057 0.000 2.561 94 F HA 0.334 4.856 4.527 -0.008 0.000 0.321 94 F C -0.319 175.503 175.800 0.037 0.000 1.065 94 F CA -1.155 56.874 58.000 0.048 0.000 0.934 94 F CB 1.271 40.268 39.000 -0.005 0.000 1.215 94 F HN 0.145 8.445 8.300 -0.000 0.000 0.471 95 V N 2.418 122.475 119.914 0.238 0.000 2.450 95 V HA 0.340 4.455 4.120 -0.008 0.000 0.281 95 V C 0.846 177.009 176.094 0.116 0.000 1.019 95 V CA 0.944 63.327 62.300 0.138 0.000 1.062 95 V CB 0.056 31.949 31.823 0.117 0.000 0.979 95 V HN 1.082 9.272 8.190 -0.000 0.000 0.477 96 G N 4.105 112.954 108.800 0.081 0.000 2.159 96 G HA2 -0.042 3.913 3.960 -0.008 0.000 0.256 96 G HA3 -0.042 3.913 3.960 -0.008 0.000 0.256 96 G C 1.037 175.971 174.900 0.056 0.000 0.977 96 G CA 0.162 45.293 45.100 0.053 0.000 0.652 96 G HN 2.214 10.505 8.290 -0.000 0.000 0.531 97 G N -1.034 107.827 108.800 0.102 0.000 2.203 97 G HA2 -0.002 3.953 3.960 -0.008 0.000 0.263 97 G HA3 -0.002 3.953 3.960 -0.008 0.000 0.263 97 G C -0.040 174.902 174.900 0.071 0.000 1.012 97 G CA 1.273 46.441 45.100 0.114 0.000 0.749 97 G HN 1.705 9.995 8.290 -0.000 0.000 0.512 98 D N -1.245 119.165 120.400 0.018 0.000 2.654 98 D HA 0.736 5.371 4.640 -0.008 0.000 0.231 98 D C -0.527 175.581 176.300 -0.321 0.000 1.239 98 D CA 0.564 54.462 54.000 -0.169 0.000 0.790 98 D CB 1.395 42.126 40.800 -0.114 0.000 1.480 98 D HN 1.010 9.380 8.370 -0.000 0.000 0.442 99 A N 1.804 124.303 122.820 -0.535 0.000 2.476 99 A HA 0.515 4.830 4.320 -0.008 0.000 0.280 99 A C -1.376 175.979 177.584 -0.381 0.000 1.081 99 A CA -0.616 51.108 52.037 -0.522 0.000 0.753 99 A CB 1.196 19.607 19.000 -0.982 0.000 1.248 99 A HN 0.353 8.503 8.150 -0.000 0.000 0.424 100 V N 4.726 124.507 119.914 -0.222 0.000 2.356 100 V HA 0.243 4.359 4.120 -0.008 0.000 0.258 100 V C 0.004 176.026 176.094 -0.119 0.000 1.065 100 V CA -0.099 62.101 62.300 -0.166 0.000 0.935 100 V CB 0.361 32.120 31.823 -0.107 0.000 1.061 100 V HN 0.817 9.007 8.190 -0.000 0.000 0.484 101 M N 4.512 124.037 119.600 -0.126 0.000 2.188 101 M HA 0.521 4.996 4.480 -0.008 0.000 0.357 101 M C -0.018 176.268 176.300 -0.023 0.000 1.204 101 M CA -0.099 55.169 55.300 -0.054 0.000 1.095 101 M CB 0.835 33.412 32.600 -0.038 0.000 1.604 101 M HN 0.573 8.863 8.290 -0.000 0.000 0.464 102 E N 1.048 121.247 120.200 -0.001 0.000 2.238 102 E HA 0.450 4.795 4.350 -0.008 0.000 0.267 102 E C -0.724 175.884 176.600 0.013 0.000 0.887 102 E CA -0.970 55.432 56.400 0.004 0.000 0.769 102 E CB 2.692 32.393 29.700 0.001 0.000 1.187 102 E HN 0.465 8.825 8.360 -0.000 0.000 0.416 103 R N 0.980 121.488 120.500 0.013 0.000 2.538 103 R HA 0.125 4.460 4.340 -0.008 0.000 0.282 103 R C 0.836 177.144 176.300 0.013 0.000 1.009 103 R CA 1.688 57.797 56.100 0.015 0.000 1.063 103 R CB -0.151 30.156 30.300 0.011 0.000 0.945 103 R HN 0.818 9.088 8.270 -0.000 0.000 0.414 104 G N 2.201 111.010 108.800 0.014 0.000 2.284 104 G HA2 -0.311 3.644 3.960 -0.008 0.000 0.230 104 G HA3 -0.311 3.644 3.960 -0.008 0.000 0.230 104 G C 0.170 175.074 174.900 0.007 0.000 1.021 104 G CA -0.031 45.075 45.100 0.010 0.000 0.619 104 G HN 0.978 9.268 8.290 -0.000 0.000 0.510 105 A N 0.559 123.386 122.820 0.012 0.000 2.445 105 A HA 0.602 4.917 4.320 -0.008 0.000 0.242 105 A C 0.653 178.236 177.584 -0.002 0.000 1.075 105 A CA 1.468 53.513 52.037 0.014 0.000 0.777 105 A CB 0.246 19.261 19.000 0.025 0.000 1.013 105 A HN 0.843 8.993 8.150 -0.000 0.000 0.493 106 T N 1.324 115.871 114.554 -0.011 0.000 2.837 106 T HA 0.509 4.854 4.350 -0.008 0.000 0.285 106 T C 0.078 174.733 174.700 -0.074 0.000 0.984 106 T CA 0.033 62.084 62.100 -0.082 0.000 1.049 106 T CB 0.261 69.069 68.868 -0.101 0.000 0.947 106 T HN 1.160 9.400 8.240 -0.000 0.000 0.472 107 C N 2.337 121.537 119.300 -0.166 0.000 3.044 107 C HA 0.858 5.314 4.460 -0.008 0.000 0.315 107 C C -1.717 173.059 174.990 -0.357 0.000 1.320 107 C CA -1.234 57.744 59.018 -0.067 0.000 1.582 107 C CB 0.296 28.121 27.740 0.141 0.000 2.039 107 C HN 0.806 9.036 8.230 -0.000 0.000 0.466 108 Y N 1.248 121.514 120.300 -0.057 0.000 2.326 108 Y HA 0.550 5.095 4.550 -0.008 0.000 0.329 108 Y C 0.359 176.046 175.900 -0.355 0.000 0.973 108 Y CA -0.750 57.249 58.100 -0.169 0.000 1.162 108 Y CB 1.816 40.184 38.460 -0.153 0.000 1.147 108 Y HN 0.800 9.080 8.280 -0.000 0.000 0.456 109 V N 0.551 120.279 119.914 -0.309 0.000 2.407 109 V HA 0.765 4.880 4.120 -0.008 0.000 0.278 109 V C -0.173 175.752 176.094 -0.281 0.000 1.037 109 V CA -0.245 61.744 62.300 -0.519 0.000 0.900 109 V CB 1.282 32.808 31.823 -0.495 0.000 0.983 109 V HN 0.769 8.959 8.190 -0.000 0.000 0.459 110 T N 2.663 117.061 114.554 -0.260 0.000 2.893 110 T HA 0.556 4.901 4.350 -0.008 0.000 0.291 110 T C 0.820 175.512 174.700 -0.012 0.000 1.028 110 T CA 0.283 62.312 62.100 -0.118 0.000 0.995 110 T CB 1.821 70.591 68.868 -0.163 0.000 1.051 110 T HN 1.103 9.343 8.240 -0.000 0.000 0.470 111 T N 0.215 114.787 114.554 0.030 0.000 3.105 111 T HA 0.214 4.559 4.350 -0.008 0.000 0.253 111 T C 0.347 175.231 174.700 0.306 0.000 1.047 111 T CA -0.350 61.803 62.100 0.087 0.000 0.944 111 T CB -0.193 68.668 68.868 -0.011 0.000 1.016 111 T HN 0.556 8.796 8.240 -0.000 0.000 0.544 112 D N 2.784 123.349 120.400 0.275 0.000 2.358 112 D HA 0.186 4.821 4.640 -0.008 0.000 0.258 112 D C -1.580 174.856 176.300 0.227 0.000 1.223 112 D CA -2.329 51.819 54.000 0.246 0.000 0.886 112 D CB 1.499 42.438 40.800 0.231 0.000 1.120 112 D HN 0.008 8.378 8.370 -0.000 0.000 0.482 113 P HA -0.077 4.343 4.420 -0.000 0.000 0.222 113 P C 0.923 178.045 177.300 -0.298 0.000 1.147 113 P CA 1.049 63.985 63.100 -0.273 0.000 0.790 113 P CB 0.122 31.760 31.700 -0.103 0.000 0.780 114 A N -1.250 121.501 122.820 -0.116 0.000 1.978 114 A HA -0.153 4.162 4.320 -0.008 0.000 0.220 114 A C 1.567 178.966 177.584 -0.309 0.000 1.170 114 A CA 1.319 53.240 52.037 -0.194 0.000 0.636 114 A CB -1.675 17.217 19.000 -0.180 0.000 0.810 114 A HN 0.170 8.320 8.150 -0.000 0.000 0.448 115 F N -0.619 119.236 119.950 -0.159 0.000 2.692 115 F HA 0.308 4.830 4.527 -0.008 0.000 0.303 115 F C 2.207 177.912 175.800 -0.159 0.000 1.114 115 F CA 0.190 58.136 58.000 -0.090 0.000 1.361 115 F CB 0.003 39.021 39.000 0.031 0.000 1.063 115 F HN 0.249 8.549 8.300 -0.000 0.000 0.550 116 A N 0.564 123.190 122.820 -0.324 0.000 1.933 116 A HA -0.211 4.104 4.320 -0.008 0.000 0.218 116 A C 1.954 179.462 177.584 -0.128 0.000 1.175 116 A CA 2.159 53.961 52.037 -0.392 0.000 0.628 116 A CB -0.487 18.135 19.000 -0.630 0.000 0.814 116 A HN 0.424 8.574 8.150 -0.000 0.000 0.444 117 D N -0.354 119.970 120.400 -0.127 0.000 2.355 117 D HA -0.027 4.608 4.640 -0.008 0.000 0.206 117 D C 0.842 177.113 176.300 -0.049 0.000 1.010 117 D CA 0.918 54.869 54.000 -0.081 0.000 0.875 117 D CB -0.326 40.422 40.800 -0.087 0.000 0.966 117 D HN 0.619 8.989 8.370 -0.000 0.000 0.512 118 K N 0.661 121.038 120.400 -0.038 0.000 3.205 118 K HA 0.544 4.859 4.320 -0.008 0.000 0.202 118 K C 0.487 177.180 176.600 0.156 0.000 1.160 118 K CA -0.803 55.495 56.287 0.018 0.000 0.995 118 K CB 0.939 33.400 32.500 -0.065 0.000 1.041 118 K HN -0.023 8.227 8.250 -0.000 0.000 0.507 119 G N 0.944 109.815 108.800 0.119 0.000 2.503 119 G HA2 0.372 4.327 3.960 -0.008 0.000 0.257 119 G HA3 0.372 4.327 3.960 -0.008 0.000 0.257 119 G C -0.232 174.911 174.900 0.406 0.000 1.214 119 G CA -0.101 45.128 45.100 0.215 0.000 0.839 119 G HN 0.432 8.722 8.290 -0.000 0.000 0.559 120 T N -2.167 112.687 114.554 0.500 0.000 2.804 120 T HA 0.416 4.761 4.350 -0.008 0.000 0.290 120 T C 1.237 176.183 174.700 0.410 0.000 1.099 120 T CA -0.380 61.965 62.100 0.409 0.000 1.011 120 T CB 1.770 70.798 68.868 0.266 0.000 1.291 120 T HN 0.578 8.818 8.240 -0.000 0.000 0.523 121 K N 0.115 120.642 120.400 0.211 0.000 2.280 121 K HA -0.113 4.202 4.320 -0.008 0.000 0.202 121 K C 0.822 177.576 176.600 0.257 0.000 1.047 121 K CA 1.655 58.033 56.287 0.151 0.000 0.942 121 K CB -0.272 32.254 32.500 0.043 0.000 0.739 121 K HN 0.480 8.730 8.250 -0.000 0.000 0.457 122 D N 0.757 121.314 120.400 0.263 0.000 2.162 122 D HA -0.005 4.630 4.640 -0.008 0.000 0.205 122 D C 0.203 176.699 176.300 0.326 0.000 0.964 122 D CA 0.967 55.126 54.000 0.266 0.000 0.847 122 D CB 0.327 41.251 40.800 0.206 0.000 0.988 122 D HN 0.191 8.561 8.370 -0.000 0.000 0.480 123 K N -0.141 120.449 120.400 0.316 0.000 2.535 123 K HA 0.364 4.679 4.320 -0.008 0.000 0.251 123 K C -1.693 175.095 176.600 0.313 0.000 0.942 123 K CA -0.555 55.842 56.287 0.183 0.000 0.798 123 K CB 1.560 34.023 32.500 -0.063 0.000 1.267 123 K HN -0.079 8.171 8.250 -0.000 0.000 0.434 124 F N 0.850 120.861 119.950 0.102 0.000 2.711 124 F HA 0.483 5.005 4.527 -0.008 0.000 0.313 124 F C -1.855 174.014 175.800 0.115 0.000 1.141 124 F CA -1.300 56.774 58.000 0.123 0.000 0.941 124 F CB 0.570 39.689 39.000 0.197 0.000 1.349 124 F HN 0.387 8.687 8.300 -0.000 0.000 0.464 125 Y N 2.307 122.702 120.300 0.158 0.000 2.310 125 Y HA 0.758 5.303 4.550 -0.008 0.000 0.326 125 Y C -0.981 174.994 175.900 0.126 0.000 1.151 125 Y CA -1.530 56.615 58.100 0.075 0.000 1.195 125 Y CB 1.054 39.570 38.460 0.093 0.000 1.210 125 Y HN 0.609 8.889 8.280 -0.000 0.000 0.483 126 I N 5.555 125.774 120.570 -0.585 0.000 2.478 126 I HA 0.169 4.334 4.170 -0.008 0.000 0.287 126 I C -0.326 175.294 176.117 -0.828 0.000 1.042 126 I CA -0.732 60.284 61.300 -0.472 0.000 1.067 126 I CB 1.970 39.877 38.000 -0.156 0.000 1.233 126 I HN 0.691 8.901 8.210 -0.000 0.000 0.431 127 D N 4.303 124.345 120.400 -0.597 0.000 2.363 127 D HA -0.192 4.443 4.640 -0.008 0.000 0.226 127 D C 0.284 176.572 176.300 -0.020 0.000 1.020 127 D CA 0.387 54.177 54.000 -0.349 0.000 0.892 127 D CB -0.076 40.728 40.800 0.006 0.000 0.900 127 D HN 0.318 8.688 8.370 -0.000 0.000 0.531 128 Y N 2.062 122.274 120.300 -0.147 0.000 2.556 128 Y HA 0.216 4.761 4.550 -0.009 0.000 0.352 128 Y C 1.064 176.942 175.900 -0.037 0.000 1.006 128 Y CA -0.806 57.263 58.100 -0.051 0.000 1.277 128 Y CB 0.327 38.771 38.460 -0.027 0.000 1.136 128 Y HN -0.129 8.151 8.280 -0.000 0.000 0.523 129 Q N 2.689 122.400 119.800 -0.148 0.000 2.291 129 Q HA -0.145 4.190 4.340 -0.008 0.000 0.205 129 Q C 0.758 176.554 176.000 -0.341 0.000 0.970 129 Q CA 1.023 56.721 55.803 -0.174 0.000 0.876 129 Q CB 0.186 28.897 28.738 -0.046 0.000 0.935 129 Q HN 0.604 8.874 8.270 -0.000 0.000 0.455 130 N N 0.145 118.398 118.700 -0.746 0.000 2.314 130 N HA -0.004 4.731 4.740 -0.008 0.000 0.200 130 N C 1.090 176.205 175.510 -0.659 0.000 1.135 130 N CA 0.036 52.685 53.050 -0.668 0.000 0.835 130 N CB 0.298 38.448 38.487 -0.562 0.000 0.989 130 N HN 0.161 8.541 8.380 -0.000 0.000 0.478 131 L N 0.467 121.315 121.223 -0.625 0.000 2.013 131 L HA -0.158 4.177 4.340 -0.008 0.000 0.212 131 L C 1.878 178.716 176.870 -0.052 0.000 1.073 131 L CA 1.809 56.536 54.840 -0.188 0.000 0.753 131 L CB -0.773 41.254 42.059 -0.053 0.000 0.890 131 L HN 0.023 8.253 8.230 -0.000 0.000 0.432 132 S N -0.111 115.564 115.700 -0.041 0.000 2.368 132 S HA -0.167 4.298 4.470 -0.008 0.000 0.224 132 S C 1.688 176.395 174.600 0.178 0.000 1.029 132 S CA 1.531 59.790 58.200 0.098 0.000 0.988 132 S CB -0.344 62.937 63.200 0.136 0.000 0.838 132 S HN 0.654 8.964 8.310 -0.000 0.000 0.462 133 K N 0.803 121.228 120.400 0.041 0.000 2.432 133 K HA 0.158 4.473 4.320 -0.008 0.000 0.196 133 K C 1.424 178.047 176.600 0.040 0.000 1.038 133 K CA 0.592 56.891 56.287 0.021 0.000 0.986 133 K CB -0.110 32.373 32.500 -0.028 0.000 0.782 133 K HN 0.191 8.441 8.250 -0.000 0.000 0.485 134 V N 1.399 121.343 119.914 0.050 0.000 2.825 134 V HA 0.021 4.136 4.120 -0.008 0.000 0.246 134 V C 0.842 176.990 176.094 0.089 0.000 1.068 134 V CA 0.280 62.630 62.300 0.085 0.000 1.088 134 V CB 0.804 32.718 31.823 0.153 0.000 0.733 134 V HN 0.056 8.246 8.190 -0.000 0.000 0.468 135 V N 2.071 122.036 119.914 0.085 0.000 2.539 135 V HA 0.458 4.573 4.120 -0.008 0.000 0.292 135 V C 0.135 176.266 176.094 0.062 0.000 1.045 135 V CA -0.697 61.634 62.300 0.051 0.000 0.945 135 V CB 1.471 33.298 31.823 0.007 0.000 0.993 135 V HN 0.318 8.508 8.190 -0.000 0.000 0.464 136 R N 3.443 123.958 120.500 0.026 0.000 2.828 136 R HA 0.520 4.856 4.340 -0.008 0.000 0.264 136 R C -2.779 173.497 176.300 -0.039 0.000 1.022 136 R CA -2.584 53.537 56.100 0.034 0.000 1.021 136 R CB 0.689 31.004 30.300 0.025 0.000 1.163 136 R HN 0.350 8.620 8.270 -0.000 0.000 0.494 137 P HA 0.099 4.519 4.420 -0.000 0.000 0.267 137 P C 0.646 177.885 177.300 -0.100 0.000 1.205 137 P CA 0.851 63.902 63.100 -0.081 0.000 0.765 137 P CB 0.488 32.163 31.700 -0.041 0.000 0.828 138 G N 2.248 110.950 108.800 -0.163 0.000 2.284 138 G HA2 -0.206 3.749 3.960 -0.008 0.000 0.216 138 G HA3 -0.206 3.749 3.960 -0.008 0.000 0.216 138 G C 0.434 175.120 174.900 -0.357 0.000 1.009 138 G CA -0.489 44.477 45.100 -0.224 0.000 0.625 138 G HN 0.512 8.802 8.290 -0.000 0.000 0.501 139 N N 0.436 118.993 118.700 -0.238 0.000 2.381 139 N HA 0.448 5.183 4.740 -0.008 0.000 0.241 139 N C -0.463 174.878 175.510 -0.281 0.000 1.279 139 N CA 0.389 53.323 53.050 -0.192 0.000 0.896 139 N CB 0.115 38.560 38.487 -0.071 0.000 1.118 139 N HN 0.336 8.716 8.380 -0.000 0.000 0.438 140 Y N 0.213 120.522 120.300 0.014 0.000 2.387 140 Y HA 0.496 5.041 4.550 -0.009 0.000 0.336 140 Y C 0.389 176.339 175.900 0.084 0.000 1.067 140 Y CA -0.578 57.577 58.100 0.091 0.000 1.114 140 Y CB 1.161 39.752 38.460 0.219 0.000 1.208 140 Y HN 0.239 8.519 8.280 -0.000 0.000 0.458 141 I N 3.894 124.661 120.570 0.328 0.000 2.355 141 I HA 0.218 4.383 4.170 -0.008 0.000 0.288 141 I C -1.176 175.222 176.117 0.468 0.000 0.999 141 I CA -0.881 60.588 61.300 0.281 0.000 1.163 141 I CB 0.653 38.762 38.000 0.181 0.000 1.316 141 I HN 0.423 8.633 8.210 -0.000 0.000 0.454 142 Y N 6.710 127.079 120.300 0.114 0.000 2.308 142 Y HA 0.601 5.147 4.550 -0.008 0.000 0.329 142 Y C 0.206 176.159 175.900 0.088 0.000 1.111 142 Y CA -1.247 56.901 58.100 0.081 0.000 1.179 142 Y CB 1.069 39.559 38.460 0.050 0.000 1.201 142 Y HN 0.316 8.596 8.280 -0.000 0.000 0.483 143 I N 2.040 122.733 120.570 0.205 0.000 2.686 143 I HA 0.210 4.375 4.170 -0.008 0.000 0.295 143 I C -0.960 175.223 176.117 0.110 0.000 1.114 143 I CA -1.101 60.301 61.300 0.169 0.000 1.038 143 I CB 2.130 40.251 38.000 0.202 0.000 1.238 143 I HN 0.522 8.732 8.210 -0.000 0.000 0.420 144 D N 4.983 125.448 120.400 0.109 0.000 3.437 144 D HA -0.180 4.455 4.640 -0.008 0.000 0.243 144 D C -0.193 176.126 176.300 0.031 0.000 1.104 144 D CA 0.749 54.806 54.000 0.094 0.000 1.009 144 D CB -0.542 40.370 40.800 0.186 0.000 0.937 144 D HN 0.746 9.116 8.370 -0.000 0.000 0.417 145 D N 1.033 121.458 120.400 0.041 0.000 2.737 145 D HA -0.184 4.451 4.640 -0.008 0.000 0.233 145 D C 1.299 177.600 176.300 0.001 0.000 1.155 145 D CA 2.168 56.184 54.000 0.026 0.000 0.667 145 D CB -1.427 39.383 40.800 0.016 0.000 1.060 145 D HN 1.230 9.600 8.370 -0.000 0.000 0.427 146 G N -0.829 107.985 108.800 0.023 0.000 2.166 146 G HA2 -0.393 3.562 3.960 -0.008 0.000 0.260 146 G HA3 -0.393 3.562 3.960 -0.008 0.000 0.260 146 G C 1.209 175.946 174.900 -0.271 0.000 0.986 146 G CA 0.611 45.675 45.100 -0.059 0.000 0.683 146 G HN 0.549 8.839 8.290 -0.000 0.000 0.527 147 I N -0.787 119.625 120.570 -0.262 0.000 2.235 147 I HA 0.115 4.280 4.170 -0.008 0.000 0.241 147 I C 1.540 177.409 176.117 -0.413 0.000 1.085 147 I CA 0.438 61.486 61.300 -0.421 0.000 1.378 147 I CB -0.123 37.471 38.000 -0.678 0.000 1.076 147 I HN 0.257 8.467 8.210 -0.000 0.000 0.415 148 L N 2.270 123.322 121.223 -0.285 0.000 2.319 148 L HA 0.374 4.709 4.340 -0.008 0.000 0.280 148 L C -0.509 176.316 176.870 -0.075 0.000 1.099 148 L CA 0.361 55.164 54.840 -0.061 0.000 0.828 148 L CB 0.282 42.435 42.059 0.157 0.000 1.150 148 L HN -0.009 8.221 8.230 -0.000 0.000 0.442 149 I N 6.365 126.890 120.570 -0.075 0.000 2.406 149 I HA 0.370 4.535 4.170 -0.008 0.000 0.290 149 I C -0.740 175.456 176.117 0.132 0.000 0.999 149 I CA -0.524 60.761 61.300 -0.025 0.000 1.124 149 I CB 1.489 39.369 38.000 -0.201 0.000 1.289 149 I HN 0.491 8.701 8.210 -0.000 0.000 0.441 150 L N 5.782 127.142 121.223 0.227 0.000 2.342 150 L HA 0.558 4.893 4.340 -0.008 0.000 0.271 150 L C -0.462 176.528 176.870 0.201 0.000 1.008 150 L CA -0.669 54.282 54.840 0.184 0.000 0.818 150 L CB 1.871 44.023 42.059 0.155 0.000 1.296 150 L HN 0.562 8.792 8.230 -0.000 0.000 0.427 151 Q N 1.404 121.245 119.800 0.069 0.000 2.322 151 Q HA 0.437 4.772 4.340 -0.008 0.000 0.265 151 Q C -1.236 174.677 176.000 -0.145 0.000 0.985 151 Q CA -0.698 55.029 55.803 -0.128 0.000 0.849 151 Q CB 2.290 30.891 28.738 -0.229 0.000 1.274 151 Q HN 0.468 8.738 8.270 -0.000 0.000 0.449 152 V N 4.905 124.710 119.914 -0.181 0.000 2.521 152 V HA -0.036 4.079 4.120 -0.008 0.000 0.286 152 V C 0.656 176.645 176.094 -0.175 0.000 1.034 152 V CA 0.211 62.405 62.300 -0.175 0.000 1.045 152 V CB 1.227 32.943 31.823 -0.180 0.000 0.974 152 V HN 0.899 9.089 8.190 -0.000 0.000 0.480 153 Q N 2.759 122.463 119.800 -0.161 0.000 2.274 153 Q HA 0.196 4.531 4.340 -0.008 0.000 0.198 153 Q C 0.751 176.689 176.000 -0.103 0.000 0.955 153 Q CA 0.937 56.666 55.803 -0.124 0.000 0.859 153 Q CB 0.639 29.309 28.738 -0.113 0.000 0.956 153 Q HN 0.922 9.192 8.270 -0.000 0.000 0.516 154 S N -1.110 114.518 115.700 -0.120 0.000 2.643 154 S HA 0.435 4.900 4.470 -0.008 0.000 0.270 154 S C -1.238 173.284 174.600 -0.131 0.000 1.166 154 S CA -0.912 57.245 58.200 -0.072 0.000 0.815 154 S CB 0.879 64.079 63.200 -0.000 0.000 1.139 154 S HN 0.202 8.512 8.310 -0.000 0.000 0.472 155 H N 1.005 120.067 119.070 -0.012 0.000 2.846 155 H HA 0.403 4.954 4.556 -0.008 0.000 0.278 155 H C 0.944 176.283 175.328 0.018 0.000 1.117 155 H CA -0.150 55.896 56.048 -0.003 0.000 1.406 155 H CB 1.231 30.987 29.762 -0.010 0.000 1.445 155 H HN 0.805 9.085 8.280 -0.000 0.000 0.469 156 E N 2.443 122.713 120.200 0.118 0.000 2.072 156 E HA -0.107 4.238 4.350 -0.008 0.000 0.191 156 E C -0.045 176.604 176.600 0.081 0.000 0.985 156 E CA 1.676 58.149 56.400 0.122 0.000 0.801 156 E CB 0.351 30.166 29.700 0.192 0.000 0.750 156 E HN 0.912 9.272 8.360 -0.000 0.000 0.452 157 D N -3.159 117.291 120.400 0.083 0.000 3.057 157 D HA 0.093 4.728 4.640 -0.008 0.000 0.328 157 D C 0.505 176.849 176.300 0.074 0.000 1.317 157 D CA -0.515 53.519 54.000 0.058 0.000 0.973 157 D CB -0.304 40.510 40.800 0.023 0.000 1.424 157 D HN -0.090 8.280 8.370 -0.000 0.000 0.569 158 E N -1.120 119.101 120.200 0.035 0.000 2.204 158 E HA -0.175 4.170 4.350 -0.008 0.000 0.195 158 E C 1.219 177.843 176.600 0.041 0.000 0.990 158 E CA 1.307 57.721 56.400 0.024 0.000 0.821 158 E CB 0.130 29.831 29.700 0.001 0.000 0.750 158 E HN 0.410 8.770 8.360 -0.000 0.000 0.477 159 Q N -0.918 118.904 119.800 0.036 0.000 2.246 159 Q HA 0.112 4.447 4.340 -0.008 0.000 0.222 159 Q C -0.525 175.480 176.000 0.007 0.000 0.851 159 Q CA 0.226 56.044 55.803 0.024 0.000 0.945 159 Q CB 1.694 30.451 28.738 0.032 0.000 1.122 159 Q HN 0.006 8.276 8.270 -0.000 0.000 0.508 160 T N 0.784 115.348 114.554 0.017 0.000 2.841 160 T HA 0.568 4.913 4.350 -0.008 0.000 0.283 160 T C -0.692 174.014 174.700 0.010 0.000 1.000 160 T CA -0.511 61.585 62.100 -0.006 0.000 0.977 160 T CB 1.574 70.432 68.868 -0.016 0.000 0.979 160 T HN -0.003 8.237 8.240 -0.000 0.000 0.446 161 L N 2.136 123.330 121.223 -0.049 0.000 2.329 161 L HA 0.511 4.846 4.340 -0.008 0.000 0.279 161 L C 0.442 177.237 176.870 -0.125 0.000 1.014 161 L CA -0.855 53.909 54.840 -0.127 0.000 0.814 161 L CB 1.756 43.690 42.059 -0.208 0.000 1.257 161 L HN 0.631 8.861 8.230 -0.000 0.000 0.424 162 E N 2.286 122.387 120.200 -0.165 0.000 2.194 162 E HA 0.322 4.667 4.350 -0.008 0.000 0.284 162 E C -1.485 174.921 176.600 -0.323 0.000 1.035 162 E CA -0.455 55.717 56.400 -0.380 0.000 0.836 162 E CB 1.020 30.575 29.700 -0.243 0.000 1.070 162 E HN 0.595 8.955 8.360 -0.000 0.000 0.401 163 C N 3.286 122.364 119.300 -0.369 0.000 2.634 163 C HA 0.456 4.911 4.460 -0.008 0.000 0.313 163 C C -0.091 174.802 174.990 -0.163 0.000 1.198 163 C CA -0.686 58.207 59.018 -0.208 0.000 1.605 163 C CB 1.692 29.353 27.740 -0.132 0.000 2.196 163 C HN 0.695 8.925 8.230 -0.000 0.000 0.486 164 T N 2.003 116.501 114.554 -0.094 0.000 2.845 164 T HA 0.377 4.722 4.350 -0.008 0.000 0.288 164 T C -0.080 174.624 174.700 0.007 0.000 0.980 164 T CA -0.300 61.773 62.100 -0.046 0.000 1.071 164 T CB 0.914 69.762 68.868 -0.033 0.000 0.941 164 T HN 0.450 8.690 8.240 -0.000 0.000 0.487 165 V N 4.418 124.345 119.914 0.021 0.000 2.405 165 V HA 0.132 4.247 4.120 -0.008 0.000 0.264 165 V C 1.831 177.953 176.094 0.046 0.000 1.048 165 V CA -0.132 62.197 62.300 0.049 0.000 0.966 165 V CB 0.261 32.112 31.823 0.047 0.000 1.015 165 V HN 1.184 9.374 8.190 -0.000 0.000 0.477 166 T N 0.817 115.410 114.554 0.066 0.000 3.043 166 T HA 0.020 4.365 4.350 -0.008 0.000 0.263 166 T C 0.642 175.359 174.700 0.028 0.000 1.094 166 T CA 0.460 62.597 62.100 0.063 0.000 1.127 166 T CB -0.119 68.818 68.868 0.115 0.000 0.905 166 T HN 0.712 8.952 8.240 -0.000 0.000 0.490 167 N N 0.023 118.734 118.700 0.019 0.000 2.396 167 N HA 0.197 4.932 4.740 -0.008 0.000 0.275 167 N C -1.848 173.676 175.510 0.024 0.000 1.218 167 N CA -0.664 52.389 53.050 0.005 0.000 0.812 167 N CB 1.671 40.140 38.487 -0.029 0.000 1.592 167 N HN -0.016 8.364 8.380 -0.000 0.000 0.480 168 S N 0.763 116.477 115.700 0.023 0.000 2.481 168 S HA 0.220 4.685 4.470 -0.008 0.000 0.276 168 S C -0.715 173.936 174.600 0.086 0.000 1.247 168 S CA 0.007 58.227 58.200 0.032 0.000 1.053 168 S CB -0.634 62.574 63.200 0.013 0.000 0.925 168 S HN 0.701 9.011 8.310 -0.000 0.000 0.491 169 H N 1.196 120.233 119.070 -0.054 0.000 3.086 169 H HA 0.351 4.902 4.556 -0.008 0.000 0.353 169 H C -1.092 174.179 175.328 -0.094 0.000 1.134 169 H CA -0.337 55.670 56.048 -0.068 0.000 1.248 169 H CB 0.982 30.704 29.762 -0.067 0.000 1.878 169 H HN 0.444 8.724 8.280 -0.000 0.000 0.527 170 T N 6.436 120.592 114.554 -0.664 0.000 2.744 170 T HA 0.439 4.784 4.350 -0.008 0.000 0.291 170 T C 0.365 174.613 174.700 -0.752 0.000 0.957 170 T CA -0.546 61.218 62.100 -0.559 0.000 1.002 170 T CB -0.242 68.418 68.868 -0.346 0.000 0.919 170 T HN 0.497 8.737 8.240 -0.000 0.000 0.468 171 I N 0.613 120.853 120.570 -0.549 0.000 2.562 171 I HA 0.795 4.960 4.170 -0.008 0.000 0.301 171 I C 0.407 176.286 176.117 -0.397 0.000 1.003 171 I CA -0.920 60.132 61.300 -0.414 0.000 1.127 171 I CB 1.942 39.753 38.000 -0.315 0.000 1.304 171 I HN 0.584 8.794 8.210 -0.000 0.000 0.446 172 S N 2.243 117.839 115.700 -0.173 0.000 2.748 172 S HA 0.452 4.917 4.470 -0.008 0.000 0.299 172 S C -0.367 174.341 174.600 0.180 0.000 1.119 172 S CA -0.781 57.391 58.200 -0.046 0.000 0.997 172 S CB 0.970 64.163 63.200 -0.011 0.000 1.223 172 S HN 0.655 8.965 8.310 -0.000 0.000 0.541 173 D N 0.412 120.956 120.400 0.240 0.000 2.399 173 D HA 0.338 4.973 4.640 -0.008 0.000 0.241 173 D C 0.154 176.559 176.300 0.174 0.000 1.133 173 D CA 0.556 54.715 54.000 0.264 0.000 0.890 173 D CB -0.062 40.834 40.800 0.159 0.000 1.201 173 D HN 0.586 8.956 8.370 -0.000 0.000 0.432 174 R N 0.052 120.640 120.500 0.147 0.000 3.333 174 R HA -0.229 4.106 4.340 -0.008 0.000 0.256 174 R C -0.614 175.754 176.300 0.114 0.000 1.010 174 R CA 0.448 56.616 56.100 0.113 0.000 0.680 174 R CB -1.306 29.046 30.300 0.087 0.000 1.102 174 R HN 0.228 8.498 8.270 -0.000 0.000 0.440 175 R N -0.229 120.358 120.500 0.144 0.000 2.441 175 R HA 0.447 4.782 4.340 -0.008 0.000 0.284 175 R C 0.878 177.241 176.300 0.105 0.000 1.070 175 R CA 0.473 56.646 56.100 0.121 0.000 1.047 175 R CB 0.938 31.317 30.300 0.131 0.000 1.016 175 R HN 0.324 8.594 8.270 -0.000 0.000 0.477 176 G N 1.309 110.154 108.800 0.075 0.000 2.406 176 G HA2 0.388 4.343 3.960 -0.008 0.000 0.251 176 G HA3 0.388 4.343 3.960 -0.008 0.000 0.251 176 G C -0.677 174.263 174.900 0.068 0.000 1.271 176 G CA -0.305 44.822 45.100 0.044 0.000 0.859 176 G HN 0.489 8.779 8.290 -0.000 0.000 0.540 177 V N 1.015 120.962 119.914 0.054 0.000 2.815 177 V HA 0.711 4.826 4.120 -0.008 0.000 0.314 177 V C -0.524 175.601 176.094 0.053 0.000 1.064 177 V CA -1.378 60.978 62.300 0.093 0.000 0.952 177 V CB 2.095 33.995 31.823 0.127 0.000 1.020 177 V HN 0.713 8.903 8.190 -0.000 0.000 0.439 178 N N 3.218 121.979 118.700 0.101 0.000 2.240 178 N HA 0.573 5.308 4.740 -0.008 0.000 0.302 178 N C -1.828 173.687 175.510 0.009 0.000 1.106 178 N CA -0.468 52.613 53.050 0.052 0.000 0.778 178 N CB 2.189 40.718 38.487 0.069 0.000 1.431 178 N HN 0.521 8.901 8.380 -0.000 0.000 0.479 179 L N 3.269 124.491 121.223 -0.000 0.000 2.445 179 L HA 0.380 4.716 4.340 -0.008 0.000 0.252 179 L C -1.711 175.139 176.870 -0.033 0.000 1.105 179 L CA -1.781 53.055 54.840 -0.008 0.000 0.943 179 L CB 1.131 43.231 42.059 0.068 0.000 1.277 179 L HN 0.365 8.595 8.230 -0.000 0.000 0.465 180 P HA -0.062 4.358 4.420 -0.000 0.000 0.218 180 P C 1.233 178.385 177.300 -0.246 0.000 1.149 180 P CA 0.892 63.850 63.100 -0.236 0.000 0.817 180 P CB 0.485 31.876 31.700 -0.515 0.000 0.785 181 G N -2.607 106.094 108.800 -0.164 0.000 3.393 181 G HA2 0.149 4.104 3.960 -0.008 0.000 0.255 181 G HA3 0.149 4.104 3.960 -0.008 0.000 0.255 181 G C -0.229 174.633 174.900 -0.063 0.000 1.097 181 G CA 0.042 45.032 45.100 -0.183 0.000 0.780 181 G HN 0.247 8.537 8.290 -0.000 0.000 0.540 182 C N 0.611 119.949 119.300 0.064 0.000 2.507 182 C HA 0.471 4.926 4.460 -0.008 0.000 0.319 182 C C -0.900 174.221 174.990 0.217 0.000 1.208 182 C CA -1.277 57.820 59.018 0.132 0.000 1.619 182 C CB 1.801 29.609 27.740 0.114 0.000 2.230 182 C HN 0.296 8.526 8.230 -0.000 0.000 0.492 183 D N 2.087 122.578 120.400 0.152 0.000 2.336 183 D HA 0.251 4.886 4.640 -0.008 0.000 0.249 183 D C -0.073 176.275 176.300 0.080 0.000 1.213 183 D CA 0.169 54.214 54.000 0.075 0.000 0.870 183 D CB 0.882 41.711 40.800 0.049 0.000 1.076 183 D HN 0.236 8.606 8.370 -0.000 0.000 0.483 184 V N 3.569 123.497 119.914 0.023 0.000 2.470 184 V HA 0.026 4.142 4.120 -0.008 0.000 0.276 184 V C 1.037 177.152 176.094 0.035 0.000 1.040 184 V CA -0.220 62.090 62.300 0.016 0.000 1.008 184 V CB 1.027 32.833 31.823 -0.030 0.000 0.990 184 V HN 0.495 8.685 8.190 -0.000 0.000 0.477 185 D N 4.093 124.597 120.400 0.173 0.000 2.388 185 D HA 0.094 4.729 4.640 -0.008 0.000 0.221 185 D C 0.398 176.797 176.300 0.165 0.000 1.133 185 D CA -0.369 53.718 54.000 0.144 0.000 0.831 185 D CB -0.009 40.880 40.800 0.147 0.000 0.962 185 D HN 0.416 8.786 8.370 -0.000 0.000 0.502 186 L N 1.256 122.569 121.223 0.150 0.000 2.529 186 L HA 0.100 4.435 4.340 -0.008 0.000 0.287 186 L C -1.467 175.463 176.870 0.100 0.000 1.241 186 L CA -1.024 53.900 54.840 0.141 0.000 0.857 186 L CB -0.141 41.967 42.059 0.081 0.000 1.113 186 L HN -0.028 8.202 8.230 -0.000 0.000 0.504 187 P HA -0.031 4.389 4.420 -0.000 0.000 0.269 187 P C 0.079 177.417 177.300 0.064 0.000 1.217 187 P CA -0.133 63.008 63.100 0.068 0.000 0.783 187 P CB 0.639 32.379 31.700 0.066 0.000 0.898 188 A N 2.407 125.252 122.820 0.043 0.000 1.892 188 A HA -0.070 4.245 4.320 -0.008 0.000 0.218 188 A C 1.099 178.718 177.584 0.058 0.000 1.188 188 A CA 2.277 54.337 52.037 0.038 0.000 0.631 188 A CB -1.124 17.888 19.000 0.020 0.000 0.822 188 A HN 0.557 8.707 8.150 -0.000 0.000 0.447 189 V N -2.555 117.391 119.914 0.054 0.000 2.735 189 V HA 0.672 4.787 4.120 -0.008 0.000 0.310 189 V C -0.005 176.124 176.094 0.058 0.000 1.061 189 V CA -0.507 61.826 62.300 0.055 0.000 0.913 189 V CB 1.252 33.100 31.823 0.042 0.000 1.005 189 V HN 0.611 8.801 8.190 -0.000 0.000 0.428 190 S N 3.279 119.016 115.700 0.061 0.000 2.641 190 S HA 0.661 5.126 4.470 -0.008 0.000 0.261 190 S C 1.461 176.096 174.600 0.059 0.000 1.257 190 S CA 0.083 58.319 58.200 0.060 0.000 0.983 190 S CB 1.293 64.527 63.200 0.057 0.000 0.990 190 S HN 1.885 10.195 8.310 -0.000 0.000 0.572 191 A N 0.882 123.736 122.820 0.057 0.000 1.877 191 A HA -0.083 4.232 4.320 -0.008 0.000 0.216 191 A C 2.191 179.815 177.584 0.067 0.000 1.186 191 A CA 1.781 53.852 52.037 0.056 0.000 0.620 191 A CB -1.062 17.968 19.000 0.049 0.000 0.822 191 A HN 0.930 9.080 8.150 -0.000 0.000 0.443 192 K N -0.473 119.969 120.400 0.070 0.000 2.044 192 K HA -0.238 4.077 4.320 -0.008 0.000 0.210 192 K C 1.460 178.133 176.600 0.122 0.000 1.049 192 K CA 1.861 58.203 56.287 0.092 0.000 0.927 192 K CB -0.268 32.284 32.500 0.087 0.000 0.713 192 K HN 0.426 8.676 8.250 -0.000 0.000 0.443 193 D N 0.254 120.711 120.400 0.095 0.000 2.092 193 D HA -0.166 4.469 4.640 -0.008 0.000 0.193 193 D C 2.068 178.411 176.300 0.071 0.000 0.994 193 D CA 1.226 55.273 54.000 0.078 0.000 0.828 193 D CB -0.179 40.655 40.800 0.056 0.000 0.963 193 D HN 0.254 8.624 8.370 -0.000 0.000 0.450 194 R N 0.366 120.907 120.500 0.068 0.000 2.105 194 R HA -0.083 4.252 4.340 -0.008 0.000 0.239 194 R C 2.432 178.787 176.300 0.091 0.000 1.135 194 R CA 0.672 56.810 56.100 0.064 0.000 0.967 194 R CB -0.406 29.927 30.300 0.056 0.000 0.861 194 R HN 0.110 8.380 8.270 -0.000 0.000 0.442 195 V N 1.498 121.483 119.914 0.119 0.000 2.307 195 V HA -0.229 3.886 4.120 -0.008 0.000 0.245 195 V C 1.624 177.880 176.094 0.269 0.000 1.045 195 V CA 1.932 64.338 62.300 0.176 0.000 1.024 195 V CB -0.410 31.505 31.823 0.153 0.000 0.651 195 V HN 0.249 8.439 8.190 -0.000 0.000 0.449 196 D N 0.114 120.678 120.400 0.274 0.000 2.117 196 D HA -0.127 4.508 4.640 -0.008 0.000 0.197 196 D C 2.130 178.480 176.300 0.084 0.000 0.987 196 D CA 1.201 55.374 54.000 0.287 0.000 0.829 196 D CB -0.243 40.727 40.800 0.283 0.000 0.961 196 D HN 0.338 8.708 8.370 -0.000 0.000 0.460 197 L N 0.243 121.481 121.223 0.025 0.000 2.093 197 L HA -0.185 4.150 4.340 -0.008 0.000 0.208 197 L C 2.464 179.330 176.870 -0.008 0.000 1.085 197 L CA 0.841 55.657 54.840 -0.040 0.000 0.755 197 L CB -0.251 41.791 42.059 -0.029 0.000 0.904 197 L HN -0.039 8.191 8.230 -0.000 0.000 0.435 198 Q N -0.231 119.604 119.800 0.058 0.000 2.167 198 Q HA -0.218 4.117 4.340 -0.008 0.000 0.202 198 Q C 1.960 178.011 176.000 0.084 0.000 0.970 198 Q CA 1.620 57.462 55.803 0.065 0.000 0.855 198 Q CB -0.374 28.420 28.738 0.093 0.000 0.911 198 Q HN 0.430 8.700 8.270 -0.000 0.000 0.438 199 F N -0.310 119.626 119.950 -0.024 0.000 2.134 199 F HA -0.020 4.502 4.527 -0.008 0.000 0.299 199 F C 1.856 177.593 175.800 -0.105 0.000 1.097 199 F CA 1.886 59.840 58.000 -0.076 0.000 1.264 199 F CB -0.756 38.087 39.000 -0.261 0.000 1.001 199 F HN 0.134 8.434 8.300 -0.000 0.000 0.479 200 G N 0.195 108.874 108.800 -0.201 0.000 2.446 200 G HA2 -0.246 3.709 3.960 -0.008 0.000 0.217 200 G HA3 -0.246 3.709 3.960 -0.008 0.000 0.217 200 G C 1.758 176.495 174.900 -0.271 0.000 1.168 200 G CA 1.452 46.365 45.100 -0.312 0.000 0.771 200 G HN 0.355 8.645 8.290 -0.000 0.000 0.551 201 V N 0.665 120.474 119.914 -0.174 0.000 2.295 201 V HA -0.184 3.931 4.120 -0.008 0.000 0.246 201 V C 2.637 178.644 176.094 -0.145 0.000 1.049 201 V CA 2.317 64.540 62.300 -0.130 0.000 1.024 201 V CB -0.692 31.087 31.823 -0.073 0.000 0.648 201 V HN 0.453 8.643 8.190 -0.000 0.000 0.447 202 E N -0.243 119.865 120.200 -0.152 0.000 2.097 202 E HA -0.256 4.089 4.350 -0.008 0.000 0.196 202 E C 2.189 178.659 176.600 -0.218 0.000 1.000 202 E CA 1.366 57.677 56.400 -0.148 0.000 0.804 202 E CB -0.106 29.532 29.700 -0.104 0.000 0.740 202 E HN 0.509 8.869 8.360 -0.000 0.000 0.454 203 Q N -0.939 118.637 119.800 -0.373 0.000 2.403 203 Q HA 0.093 4.428 4.340 -0.008 0.000 0.203 203 Q C 0.655 176.509 176.000 -0.243 0.000 0.932 203 Q CA 0.723 56.304 55.803 -0.369 0.000 0.945 203 Q CB 1.015 29.372 28.738 -0.634 0.000 1.045 203 Q HN 0.366 8.636 8.270 -0.000 0.000 0.511 204 G N 1.536 110.212 108.800 -0.205 0.000 2.324 204 G HA2 -0.243 3.713 3.960 -0.008 0.000 0.292 204 G HA3 -0.243 3.713 3.960 -0.008 0.000 0.292 204 G C 0.304 175.114 174.900 -0.149 0.000 1.079 204 G CA 0.312 45.323 45.100 -0.149 0.000 1.026 204 G HN 0.316 8.606 8.290 -0.000 0.000 0.506 205 V N -2.619 117.190 119.914 -0.176 0.000 2.924 205 V HA 0.463 4.578 4.120 -0.008 0.000 0.305 205 V C 1.150 177.162 176.094 -0.138 0.000 1.073 205 V CA 0.438 62.636 62.300 -0.170 0.000 1.098 205 V CB 1.257 32.950 31.823 -0.217 0.000 1.000 205 V HN 0.203 8.393 8.190 -0.000 0.000 0.484 206 D N 2.749 123.071 120.400 -0.129 0.000 2.240 206 D HA 0.143 4.778 4.640 -0.008 0.000 0.206 206 D C 0.660 176.906 176.300 -0.089 0.000 0.963 206 D CA 1.566 55.509 54.000 -0.094 0.000 0.863 206 D CB 0.360 41.115 40.800 -0.075 0.000 0.973 206 D HN 0.826 9.196 8.370 -0.000 0.000 0.501 207 M N -0.713 118.804 119.600 -0.137 0.000 2.534 207 M HA 0.406 4.881 4.480 -0.008 0.000 0.280 207 M C -1.887 174.285 176.300 -0.213 0.000 1.217 207 M CA -0.886 54.343 55.300 -0.117 0.000 0.893 207 M CB 2.647 35.226 32.600 -0.036 0.000 1.730 207 M HN -0.413 7.877 8.290 -0.000 0.000 0.483 208 I N 2.689 123.196 120.570 -0.106 0.000 2.377 208 I HA 0.438 4.603 4.170 -0.008 0.000 0.293 208 I C -1.160 175.034 176.117 0.129 0.000 0.987 208 I CA -0.573 60.664 61.300 -0.105 0.000 1.185 208 I CB 1.186 39.148 38.000 -0.063 0.000 1.341 208 I HN 0.597 8.807 8.210 -0.000 0.000 0.455 209 F N 4.688 124.604 119.950 -0.057 0.000 2.334 209 F HA 0.475 4.997 4.527 -0.008 0.000 0.365 209 F C 0.834 176.618 175.800 -0.027 0.000 1.124 209 F CA -1.557 56.425 58.000 -0.030 0.000 1.166 209 F CB 0.454 39.445 39.000 -0.015 0.000 1.355 209 F HN 0.454 8.754 8.300 -0.000 0.000 0.532 210 A N 2.686 125.601 122.820 0.159 0.000 2.302 210 A HA 0.502 4.817 4.320 -0.008 0.000 0.295 210 A C 0.537 178.176 177.584 0.091 0.000 1.235 210 A CA -0.324 51.765 52.037 0.088 0.000 0.876 210 A CB 0.051 19.083 19.000 0.054 0.000 1.133 210 A HN 0.566 8.716 8.150 -0.000 0.000 0.533 211 S N 1.335 117.096 115.700 0.102 0.000 2.572 211 S HA 0.345 4.810 4.470 -0.008 0.000 0.279 211 S C 0.265 174.986 174.600 0.202 0.000 1.341 211 S CA 0.169 58.448 58.200 0.133 0.000 1.043 211 S CB -0.190 63.076 63.200 0.110 0.000 0.887 211 S HN 1.273 9.583 8.310 -0.000 0.000 0.516 212 F N 1.005 120.946 119.950 -0.014 0.000 3.080 212 F HA -0.165 4.358 4.527 -0.007 0.000 0.292 212 F C -0.387 175.389 175.800 -0.039 0.000 0.891 212 F CA -0.227 57.755 58.000 -0.031 0.000 1.086 212 F CB -1.319 37.661 39.000 -0.033 0.000 1.095 212 F HN 0.394 8.694 8.300 -0.000 0.000 0.633 213 I N 1.570 122.101 120.570 -0.066 0.000 2.517 213 I HA 0.039 4.204 4.170 -0.008 0.000 0.285 213 I C 1.452 177.427 176.117 -0.236 0.000 1.106 213 I CA 0.546 61.770 61.300 -0.127 0.000 1.402 213 I CB 0.988 38.952 38.000 -0.061 0.000 1.399 213 I HN 0.310 8.520 8.210 -0.000 0.000 0.535 214 R N 3.027 123.365 120.500 -0.270 0.000 2.369 214 R HA 0.132 4.467 4.340 -0.008 0.000 0.210 214 R C 0.182 176.366 176.300 -0.193 0.000 0.881 214 R CA 0.137 56.053 56.100 -0.306 0.000 1.031 214 R CB 0.563 30.614 30.300 -0.414 0.000 1.184 214 R HN 0.787 9.057 8.270 -0.000 0.000 0.581 215 S N -1.815 113.803 115.700 -0.138 0.000 2.607 215 S HA 0.589 5.054 4.470 -0.008 0.000 0.273 215 S C 0.455 175.015 174.600 -0.067 0.000 1.148 215 S CA -0.445 57.699 58.200 -0.093 0.000 0.833 215 S CB 1.740 64.892 63.200 -0.080 0.000 1.130 215 S HN -0.006 8.304 8.310 -0.000 0.000 0.470 216 A N 0.805 123.594 122.820 -0.051 0.000 1.898 216 A HA -0.019 4.296 4.320 -0.008 0.000 0.216 216 A C 1.940 179.506 177.584 -0.030 0.000 1.181 216 A CA 1.723 53.737 52.037 -0.038 0.000 0.620 216 A CB -1.222 17.758 19.000 -0.033 0.000 0.819 216 A HN 0.998 9.148 8.150 -0.000 0.000 0.442 217 E N -0.072 120.111 120.200 -0.029 0.000 2.097 217 E HA -0.309 4.036 4.350 -0.008 0.000 0.196 217 E C 2.053 178.643 176.600 -0.018 0.000 1.000 217 E CA 1.695 58.083 56.400 -0.020 0.000 0.804 217 E CB -0.202 29.487 29.700 -0.018 0.000 0.740 217 E HN 0.778 9.138 8.360 -0.000 0.000 0.454 218 Q N -0.206 119.579 119.800 -0.026 0.000 2.226 218 Q HA -0.124 4.211 4.340 -0.008 0.000 0.204 218 Q C 2.306 178.297 176.000 -0.014 0.000 0.975 218 Q CA 1.363 57.153 55.803 -0.021 0.000 0.866 218 Q CB 0.150 28.866 28.738 -0.037 0.000 0.915 218 Q HN 0.244 8.514 8.270 -0.000 0.000 0.440 219 V N 0.320 120.223 119.914 -0.018 0.000 2.407 219 V HA -0.203 3.913 4.120 -0.008 0.000 0.248 219 V C 2.226 178.316 176.094 -0.006 0.000 1.055 219 V CA 1.908 64.202 62.300 -0.011 0.000 1.049 219 V CB -1.171 30.643 31.823 -0.014 0.000 0.662 219 V HN 0.503 8.693 8.190 -0.000 0.000 0.455 220 G N -0.060 108.736 108.800 -0.007 0.000 2.418 220 G HA2 -0.249 3.706 3.960 -0.008 0.000 0.217 220 G HA3 -0.249 3.706 3.960 -0.008 0.000 0.217 220 G C 1.228 176.128 174.900 0.000 0.000 1.158 220 G CA 1.017 46.114 45.100 -0.004 0.000 0.771 220 G HN 0.507 8.797 8.290 -0.000 0.000 0.545 221 D N 0.328 120.729 120.400 0.002 0.000 2.149 221 D HA -0.100 4.535 4.640 -0.008 0.000 0.198 221 D C 2.751 179.057 176.300 0.009 0.000 0.990 221 D CA 0.813 54.817 54.000 0.008 0.000 0.839 221 D CB -0.408 40.399 40.800 0.011 0.000 0.948 221 D HN 0.230 8.600 8.370 -0.000 0.000 0.460 222 V N 0.939 120.857 119.914 0.006 0.000 2.295 222 V HA -0.240 3.875 4.120 -0.008 0.000 0.246 222 V C 2.555 178.649 176.094 -0.001 0.000 1.049 222 V CA 1.608 63.910 62.300 0.004 0.000 1.024 222 V CB -0.429 31.397 31.823 0.004 0.000 0.648 222 V HN 0.052 8.242 8.190 -0.000 0.000 0.447 223 R N 0.734 121.233 120.500 -0.001 0.000 2.091 223 R HA -0.174 4.161 4.340 -0.008 0.000 0.238 223 R C 2.231 178.530 176.300 -0.002 0.000 1.136 223 R CA 1.803 57.901 56.100 -0.003 0.000 0.959 223 R CB -0.351 29.948 30.300 -0.003 0.000 0.856 223 R HN 0.471 8.741 8.270 -0.000 0.000 0.437 224 K N -0.532 119.870 120.400 0.002 0.000 2.097 224 K HA -0.015 4.300 4.320 -0.008 0.000 0.205 224 K C 2.019 178.623 176.600 0.007 0.000 1.050 224 K CA 1.229 57.519 56.287 0.005 0.000 0.938 224 K CB -0.105 32.400 32.500 0.007 0.000 0.718 224 K HN 0.273 8.523 8.250 -0.000 0.000 0.442 225 A N 1.095 123.920 122.820 0.008 0.000 2.015 225 A HA -0.068 4.247 4.320 -0.008 0.000 0.219 225 A C 1.990 179.577 177.584 0.005 0.000 1.163 225 A CA 1.042 53.086 52.037 0.012 0.000 0.646 225 A CB -0.418 18.591 19.000 0.015 0.000 0.806 225 A HN 0.151 8.301 8.150 -0.000 0.000 0.448 226 L N -1.234 119.987 121.223 -0.005 0.000 2.240 226 L HA 0.179 4.514 4.340 -0.008 0.000 0.211 226 L C 1.518 178.382 176.870 -0.011 0.000 1.106 226 L CA 0.475 55.305 54.840 -0.015 0.000 0.793 226 L CB -0.858 41.186 42.059 -0.025 0.000 0.927 226 L HN 0.619 8.849 8.230 -0.000 0.000 0.446 227 G N -0.143 108.655 108.800 -0.004 0.000 2.855 227 G HA2 -0.231 3.724 3.960 -0.008 0.000 0.352 227 G HA3 -0.231 3.724 3.960 -0.008 0.000 0.352 227 G C -2.013 172.885 174.900 -0.004 0.000 1.415 227 G CA -0.357 44.743 45.100 -0.001 0.000 0.871 227 G HN 0.051 8.341 8.290 -0.000 0.000 0.543 228 P HA -0.032 4.388 4.420 -0.000 0.000 0.218 228 P C 1.647 178.944 177.300 -0.005 0.000 1.148 228 P CA 1.817 64.916 63.100 -0.002 0.000 0.822 228 P CB -0.011 31.690 31.700 0.001 0.000 0.784 229 K N -1.484 118.911 120.400 -0.008 0.000 2.418 229 K HA 0.129 4.444 4.320 -0.008 0.000 0.195 229 K C 1.719 178.305 176.600 -0.024 0.000 1.035 229 K CA 0.883 57.161 56.287 -0.015 0.000 1.003 229 K CB -0.245 32.246 32.500 -0.016 0.000 0.793 229 K HN 0.129 8.379 8.250 -0.000 0.000 0.494 230 G N 1.827 110.613 108.800 -0.024 0.000 3.605 230 G HA2 -0.050 3.905 3.960 -0.008 0.000 0.277 230 G HA3 -0.050 3.905 3.960 -0.008 0.000 0.277 230 G C 1.067 175.953 174.900 -0.025 0.000 1.093 230 G CA -0.446 44.634 45.100 -0.032 0.000 0.821 230 G HN 0.210 8.500 8.290 -0.000 0.000 0.532 231 R N -0.283 120.207 120.500 -0.016 0.000 2.148 231 R HA 0.014 4.349 4.340 -0.008 0.000 0.227 231 R C 0.475 176.770 176.300 -0.009 0.000 1.103 231 R CA 1.254 57.348 56.100 -0.010 0.000 0.983 231 R CB -0.097 30.201 30.300 -0.004 0.000 0.874 231 R HN -0.001 8.269 8.270 -0.000 0.000 0.451 232 D N 0.914 121.307 120.400 -0.012 0.000 2.340 232 D HA 0.187 4.822 4.640 -0.008 0.000 0.220 232 D C 0.323 176.613 176.300 -0.016 0.000 1.039 232 D CA 0.251 54.245 54.000 -0.009 0.000 0.866 232 D CB 0.186 40.981 40.800 -0.008 0.000 0.913 232 D HN 0.261 8.631 8.370 -0.000 0.000 0.523 233 I N 1.306 121.860 120.570 -0.025 0.000 2.371 233 I HA 0.094 4.259 4.170 -0.008 0.000 0.290 233 I C 0.694 176.799 176.117 -0.020 0.000 1.028 233 I CA -0.367 60.912 61.300 -0.035 0.000 1.345 233 I CB 0.844 38.810 38.000 -0.056 0.000 1.407 233 I HN -0.342 7.868 8.210 -0.000 0.000 0.501 234 M N 6.758 126.352 119.600 -0.010 0.000 2.228 234 M HA 0.308 4.783 4.480 -0.008 0.000 0.351 234 M C -0.448 175.866 176.300 0.023 0.000 1.233 234 M CA 0.301 55.609 55.300 0.014 0.000 1.129 234 M CB 0.584 33.205 32.600 0.034 0.000 1.604 234 M HN 0.395 8.685 8.290 -0.000 0.000 0.457 235 I N 4.431 125.019 120.570 0.030 0.000 2.330 235 I HA 0.292 4.457 4.170 -0.008 0.000 0.289 235 I C -0.589 175.565 176.117 0.062 0.000 1.001 235 I CA -0.533 60.792 61.300 0.042 0.000 1.193 235 I CB 0.879 38.890 38.000 0.019 0.000 1.345 235 I HN 0.470 8.680 8.210 -0.000 0.000 0.461 236 I N 5.892 126.533 120.570 0.118 0.000 2.328 236 I HA 0.210 4.375 4.170 -0.008 0.000 0.287 236 I C -0.008 176.137 176.117 0.047 0.000 1.012 236 I CA -0.533 60.818 61.300 0.086 0.000 1.195 236 I CB 0.985 39.058 38.000 0.122 0.000 1.350 236 I HN 0.527 8.737 8.210 -0.000 0.000 0.464 237 C N 6.386 125.687 119.300 0.002 0.000 2.499 237 C HA 0.226 4.681 4.460 -0.008 0.000 0.386 237 C C 1.005 175.976 174.990 -0.031 0.000 1.293 237 C CA -0.822 58.192 59.018 -0.007 0.000 1.884 237 C CB -0.577 27.150 27.740 -0.021 0.000 2.509 237 C HN 0.588 8.818 8.230 -0.000 0.000 0.566 238 K N 3.704 124.098 120.400 -0.010 0.000 2.285 238 K HA 0.378 4.693 4.320 -0.008 0.000 0.286 238 K C -0.287 176.308 176.600 -0.008 0.000 1.072 238 K CA -0.108 56.170 56.287 -0.015 0.000 0.913 238 K CB 0.444 32.959 32.500 0.025 0.000 1.067 238 K HN 0.509 8.759 8.250 -0.000 0.000 0.479 239 I N 3.897 124.452 120.570 -0.026 0.000 2.301 239 I HA 0.065 4.230 4.170 -0.008 0.000 0.292 239 I C 0.744 176.861 176.117 0.001 0.000 1.046 239 I CA 0.382 61.662 61.300 -0.033 0.000 1.282 239 I CB 0.793 38.767 38.000 -0.043 0.000 1.409 239 I HN 0.775 8.985 8.210 -0.000 0.000 0.484 240 E N 4.096 124.309 120.200 0.021 0.000 2.571 240 E HA 0.065 4.410 4.350 -0.008 0.000 0.222 240 E C 0.059 176.722 176.600 0.104 0.000 0.904 240 E CA -0.072 56.389 56.400 0.102 0.000 1.157 240 E CB 0.790 30.641 29.700 0.252 0.000 1.158 240 E HN 0.736 9.096 8.360 -0.000 0.000 0.540 241 N N -0.485 118.219 118.700 0.006 0.000 2.972 241 N HA -0.017 4.718 4.740 -0.008 0.000 0.262 241 N C 0.671 176.142 175.510 -0.065 0.000 1.478 241 N CA -0.354 52.697 53.050 0.002 0.000 0.841 241 N CB 0.431 38.920 38.487 0.004 0.000 1.512 241 N HN -0.061 8.319 8.380 -0.000 0.000 0.548 242 H N -1.103 117.944 119.070 -0.039 0.000 2.387 242 H HA -0.046 4.505 4.556 -0.009 0.000 0.299 242 H C 1.229 176.521 175.328 -0.061 0.000 1.099 242 H CA 2.028 58.050 56.048 -0.043 0.000 1.315 242 H CB -0.111 29.629 29.762 -0.035 0.000 1.380 242 H HN 0.602 8.882 8.280 -0.000 0.000 0.513 243 Q N 0.465 119.820 119.800 -0.740 0.000 2.050 243 Q HA -0.067 4.268 4.340 -0.008 0.000 0.202 243 Q C 2.838 178.680 176.000 -0.264 0.000 0.980 243 Q CA 1.196 56.704 55.803 -0.493 0.000 0.840 243 Q CB -0.276 28.138 28.738 -0.540 0.000 0.898 243 Q HN 0.719 8.989 8.270 -0.000 0.000 0.424 244 G N 0.301 108.947 108.800 -0.257 0.000 2.422 244 G HA2 -0.211 3.744 3.960 -0.008 0.000 0.218 244 G HA3 -0.211 3.744 3.960 -0.008 0.000 0.218 244 G C 1.511 176.348 174.900 -0.105 0.000 1.146 244 G CA 0.898 45.896 45.100 -0.170 0.000 0.769 244 G HN 0.194 8.484 8.290 -0.000 0.000 0.547 245 V N 0.365 120.229 119.914 -0.083 0.000 2.270 245 V HA -0.230 3.885 4.120 -0.008 0.000 0.245 245 V C 2.862 178.935 176.094 -0.035 0.000 1.043 245 V CA 2.204 64.480 62.300 -0.041 0.000 1.014 245 V CB -0.736 31.082 31.823 -0.009 0.000 0.645 245 V HN 0.394 8.584 8.190 -0.000 0.000 0.447 246 Q N 0.291 120.071 119.800 -0.033 0.000 2.061 246 Q HA -0.195 4.140 4.340 -0.008 0.000 0.204 246 Q C 1.669 177.647 176.000 -0.037 0.000 0.984 246 Q CA 1.707 57.497 55.803 -0.021 0.000 0.846 246 Q CB -0.221 28.515 28.738 -0.004 0.000 0.902 246 Q HN 0.582 8.852 8.270 -0.000 0.000 0.421 247 N N 0.306 118.970 118.700 -0.060 0.000 2.370 247 N HA -0.014 4.721 4.740 -0.008 0.000 0.198 247 N C 1.182 176.660 175.510 -0.053 0.000 1.156 247 N CA 0.100 53.115 53.050 -0.059 0.000 0.839 247 N CB 0.165 38.606 38.487 -0.076 0.000 0.989 247 N HN 0.186 8.566 8.380 -0.000 0.000 0.468 248 I N 1.513 122.054 120.570 -0.049 0.000 2.185 248 I HA -0.302 3.863 4.170 -0.008 0.000 0.246 248 I C 1.403 177.497 176.117 -0.038 0.000 1.088 248 I CA 1.656 62.929 61.300 -0.044 0.000 1.347 248 I CB -0.045 37.933 38.000 -0.037 0.000 1.041 248 I HN 0.013 8.223 8.210 -0.000 0.000 0.415 249 D N -0.121 120.258 120.400 -0.035 0.000 2.084 249 D HA -0.166 4.469 4.640 -0.008 0.000 0.194 249 D C 2.484 178.765 176.300 -0.032 0.000 0.990 249 D CA 1.960 55.941 54.000 -0.032 0.000 0.826 249 D CB -0.433 40.349 40.800 -0.030 0.000 0.971 249 D HN 0.540 8.910 8.370 -0.000 0.000 0.453 250 S N 0.275 115.954 115.700 -0.034 0.000 2.383 250 S HA -0.086 4.379 4.470 -0.008 0.000 0.227 250 S C 2.328 176.907 174.600 -0.034 0.000 1.026 250 S CA 0.446 58.626 58.200 -0.032 0.000 0.981 250 S CB -0.633 62.548 63.200 -0.033 0.000 0.818 250 S HN 0.234 8.544 8.310 -0.000 0.000 0.472 251 I N 1.694 122.240 120.570 -0.039 0.000 2.127 251 I HA -0.176 3.989 4.170 -0.008 0.000 0.241 251 I C 2.489 178.586 176.117 -0.032 0.000 1.075 251 I CA 1.521 62.797 61.300 -0.040 0.000 1.334 251 I CB -0.492 37.477 38.000 -0.051 0.000 1.040 251 I HN 0.263 8.473 8.210 -0.000 0.000 0.405 252 I N 0.515 121.066 120.570 -0.032 0.000 2.151 252 I HA -0.354 3.811 4.170 -0.008 0.000 0.243 252 I C 2.643 178.746 176.117 -0.023 0.000 1.080 252 I CA 1.696 62.979 61.300 -0.027 0.000 1.339 252 I CB -0.429 37.554 38.000 -0.028 0.000 1.039 252 I HN 0.317 8.527 8.210 -0.000 0.000 0.409 253 E N 0.623 120.809 120.200 -0.025 0.000 2.085 253 E HA -0.255 4.090 4.350 -0.008 0.000 0.194 253 E C 1.948 178.537 176.600 -0.018 0.000 0.994 253 E CA 1.317 57.704 56.400 -0.022 0.000 0.801 253 E CB 0.166 29.852 29.700 -0.024 0.000 0.743 253 E HN 0.397 8.757 8.360 -0.000 0.000 0.453 254 E N 0.341 120.530 120.200 -0.019 0.000 2.230 254 E HA -0.020 4.325 4.350 -0.008 0.000 0.192 254 E C 1.117 177.710 176.600 -0.011 0.000 0.987 254 E CA 0.493 56.884 56.400 -0.015 0.000 0.841 254 E CB 0.259 29.949 29.700 -0.017 0.000 0.783 254 E HN 0.204 8.564 8.360 -0.000 0.000 0.481 255 S N 0.457 116.149 115.700 -0.012 0.000 2.707 255 S HA 0.228 4.693 4.470 -0.008 0.000 0.276 255 S C 0.533 175.131 174.600 -0.003 0.000 1.179 255 S CA -0.681 57.515 58.200 -0.007 0.000 0.992 255 S CB 1.308 64.503 63.200 -0.010 0.000 1.030 255 S HN -0.163 8.147 8.310 -0.000 0.000 0.554 256 D N 0.124 120.528 120.400 0.006 0.000 2.369 256 D HA 0.359 4.994 4.640 -0.008 0.000 0.211 256 D C 0.740 177.046 176.300 0.009 0.000 1.077 256 D CA 0.645 54.651 54.000 0.010 0.000 0.842 256 D CB 0.534 41.346 40.800 0.019 0.000 0.947 256 D HN 0.813 9.183 8.370 -0.000 0.000 0.509 257 G N 0.234 109.035 108.800 0.001 0.000 2.321 257 G HA2 0.310 4.265 3.960 -0.008 0.000 0.298 257 G HA3 0.310 4.265 3.960 -0.008 0.000 0.298 257 G C -1.963 172.919 174.900 -0.030 0.000 1.385 257 G CA -0.747 44.346 45.100 -0.012 0.000 0.856 257 G HN -0.059 8.231 8.290 -0.000 0.000 0.584 258 I N 0.610 121.147 120.570 -0.054 0.000 2.686 258 I HA 0.537 4.702 4.170 -0.008 0.000 0.295 258 I C -0.263 175.783 176.117 -0.119 0.000 1.114 258 I CA -0.719 60.538 61.300 -0.071 0.000 1.038 258 I CB 1.994 39.962 38.000 -0.053 0.000 1.238 258 I HN 0.709 8.919 8.210 -0.000 0.000 0.420 259 M N 6.057 125.571 119.600 -0.143 0.000 2.167 259 M HA 0.450 4.925 4.480 -0.008 0.000 0.333 259 M C -1.380 174.859 176.300 -0.101 0.000 1.030 259 M CA -0.690 54.505 55.300 -0.176 0.000 0.963 259 M CB 1.479 33.910 32.600 -0.282 0.000 1.589 259 M HN 0.282 8.572 8.290 -0.000 0.000 0.431 260 V N 5.281 125.147 119.914 -0.080 0.000 2.356 260 V HA 0.299 4.414 4.120 -0.008 0.000 0.258 260 V C 0.556 176.628 176.094 -0.037 0.000 1.065 260 V CA -0.436 61.836 62.300 -0.046 0.000 0.935 260 V CB 0.271 32.075 31.823 -0.032 0.000 1.061 260 V HN 0.887 9.077 8.190 -0.000 0.000 0.484 261 A N 5.363 128.171 122.820 -0.020 0.000 2.923 261 A HA 0.420 4.735 4.320 -0.008 0.000 0.306 261 A C 1.413 179.004 177.584 0.013 0.000 1.542 261 A CA -0.499 51.537 52.037 -0.002 0.000 1.225 261 A CB -0.238 18.772 19.000 0.017 0.000 1.147 261 A HN 0.858 9.008 8.150 -0.000 0.000 0.542 262 R N 1.382 121.886 120.500 0.008 0.000 2.103 262 R HA -0.167 4.168 4.340 -0.008 0.000 0.242 262 R C 2.316 178.631 176.300 0.025 0.000 1.142 262 R CA 2.131 58.240 56.100 0.014 0.000 0.960 262 R CB -0.427 29.878 30.300 0.009 0.000 0.858 262 R HN 0.668 8.938 8.270 -0.000 0.000 0.439 263 G N 0.614 109.429 108.800 0.026 0.000 2.446 263 G HA2 -0.297 3.658 3.960 -0.008 0.000 0.217 263 G HA3 -0.297 3.658 3.960 -0.008 0.000 0.217 263 G C 0.691 175.617 174.900 0.043 0.000 1.168 263 G CA 1.447 46.566 45.100 0.033 0.000 0.771 263 G HN 0.321 8.611 8.290 -0.000 0.000 0.551 264 D N 0.248 120.677 120.400 0.049 0.000 2.103 264 D HA -0.007 4.628 4.640 -0.008 0.000 0.199 264 D C 2.532 178.879 176.300 0.078 0.000 0.978 264 D CA 0.322 54.362 54.000 0.066 0.000 0.829 264 D CB -0.186 40.659 40.800 0.075 0.000 0.981 264 D HN 0.260 8.630 8.370 -0.000 0.000 0.464 265 L N 0.746 122.008 121.223 0.065 0.000 2.043 265 L HA -0.143 4.192 4.340 -0.008 0.000 0.212 265 L C 2.509 179.417 176.870 0.063 0.000 1.075 265 L CA 1.482 56.359 54.840 0.061 0.000 0.752 265 L CB -0.730 41.353 42.059 0.040 0.000 0.891 265 L HN 0.180 8.410 8.230 -0.000 0.000 0.432 266 G N -0.963 107.870 108.800 0.055 0.000 2.498 266 G HA2 -0.121 3.834 3.960 -0.008 0.000 0.219 266 G HA3 -0.121 3.834 3.960 -0.008 0.000 0.219 266 G C 1.528 176.473 174.900 0.075 0.000 1.119 266 G CA 0.646 45.778 45.100 0.053 0.000 0.766 266 G HN 0.230 8.520 8.290 -0.000 0.000 0.552 267 V N 1.323 121.295 119.914 0.097 0.000 2.358 267 V HA -0.147 3.968 4.120 -0.008 0.000 0.246 267 V C 2.586 178.822 176.094 0.237 0.000 1.047 267 V CA 2.387 64.779 62.300 0.154 0.000 1.035 267 V CB -0.297 31.618 31.823 0.153 0.000 0.658 267 V HN 0.793 8.983 8.190 -0.000 0.000 0.452 268 E N -0.665 119.616 120.200 0.135 0.000 2.465 268 E HA 0.246 4.591 4.350 -0.008 0.000 0.209 268 E C 0.485 177.114 176.600 0.049 0.000 0.951 268 E CA -0.051 56.385 56.400 0.059 0.000 0.997 268 E CB 0.304 29.975 29.700 -0.047 0.000 1.025 268 E HN 0.518 8.878 8.360 -0.000 0.000 0.500 269 I N 2.648 123.254 120.570 0.060 0.000 2.404 269 I HA 0.336 4.501 4.170 -0.008 0.000 0.293 269 I C -2.394 173.745 176.117 0.037 0.000 0.992 269 I CA -3.066 58.258 61.300 0.040 0.000 1.149 269 I CB 1.592 39.617 38.000 0.042 0.000 1.315 269 I HN -0.202 8.008 8.210 -0.000 0.000 0.446 270 P HA -0.039 4.381 4.420 -0.000 0.000 0.265 270 P C 0.456 177.766 177.300 0.016 0.000 1.187 270 P CA 0.111 63.221 63.100 0.016 0.000 0.766 270 P CB 0.775 32.479 31.700 0.007 0.000 0.820 271 A N 4.338 127.166 122.820 0.013 0.000 1.917 271 A HA -0.238 4.077 4.320 -0.008 0.000 0.219 271 A C 1.897 179.487 177.584 0.011 0.000 1.182 271 A CA 1.807 53.852 52.037 0.013 0.000 0.633 271 A CB -0.956 18.050 19.000 0.010 0.000 0.819 271 A HN 0.687 8.837 8.150 -0.000 0.000 0.448 272 E N 0.549 120.754 120.200 0.008 0.000 2.150 272 E HA -0.204 4.141 4.350 -0.008 0.000 0.193 272 E C 1.615 178.220 176.600 0.008 0.000 0.985 272 E CA 1.503 57.907 56.400 0.007 0.000 0.814 272 E CB -0.417 29.285 29.700 0.004 0.000 0.752 272 E HN 0.666 9.026 8.360 -0.000 0.000 0.466 273 K N 0.660 121.065 120.400 0.009 0.000 2.167 273 K HA 0.031 4.346 4.320 -0.008 0.000 0.203 273 K C 2.278 178.885 176.600 0.012 0.000 1.052 273 K CA 0.880 57.173 56.287 0.009 0.000 0.956 273 K CB 0.131 32.637 32.500 0.009 0.000 0.735 273 K HN -0.025 8.225 8.250 -0.000 0.000 0.451 274 V N 1.080 121.002 119.914 0.015 0.000 2.407 274 V HA -0.214 3.901 4.120 -0.008 0.000 0.248 274 V C 2.238 178.339 176.094 0.012 0.000 1.055 274 V CA 1.371 63.680 62.300 0.016 0.000 1.049 274 V CB -0.330 31.505 31.823 0.019 0.000 0.662 274 V HN 0.055 8.245 8.190 -0.000 0.000 0.455 275 V N -0.120 119.802 119.914 0.012 0.000 2.332 275 V HA -0.244 3.871 4.120 -0.008 0.000 0.248 275 V C 2.407 178.508 176.094 0.012 0.000 1.055 275 V CA 2.094 64.402 62.300 0.013 0.000 1.038 275 V CB -0.503 31.328 31.823 0.013 0.000 0.651 275 V HN 0.427 8.617 8.190 -0.000 0.000 0.450 276 V N 0.125 120.044 119.914 0.009 0.000 2.379 276 V HA -0.188 3.927 4.120 -0.008 0.000 0.245 276 V C 2.711 178.807 176.094 0.004 0.000 1.044 276 V CA 1.728 64.031 62.300 0.005 0.000 1.036 276 V CB -1.142 30.683 31.823 0.002 0.000 0.664 276 V HN 0.547 8.737 8.190 -0.000 0.000 0.453 277 A N -0.394 122.429 122.820 0.005 0.000 1.917 277 A HA -0.361 3.954 4.320 -0.008 0.000 0.219 277 A C 2.271 179.856 177.584 0.001 0.000 1.182 277 A CA 2.416 54.455 52.037 0.003 0.000 0.633 277 A CB -0.615 18.389 19.000 0.006 0.000 0.819 277 A HN 0.636 8.786 8.150 -0.000 0.000 0.448 278 Q N -0.217 119.586 119.800 0.005 0.000 2.061 278 Q HA -0.236 4.099 4.340 -0.008 0.000 0.204 278 Q C 1.989 177.995 176.000 0.010 0.000 0.984 278 Q CA 2.000 57.806 55.803 0.005 0.000 0.846 278 Q CB -0.167 28.576 28.738 0.009 0.000 0.902 278 Q HN 0.701 8.971 8.270 -0.000 0.000 0.421 279 K N 0.126 120.533 120.400 0.013 0.000 2.032 279 K HA -0.150 4.165 4.320 -0.008 0.000 0.209 279 K C 2.126 178.728 176.600 0.004 0.000 1.048 279 K CA 1.689 57.984 56.287 0.014 0.000 0.927 279 K CB -0.189 32.316 32.500 0.009 0.000 0.712 279 K HN 0.294 8.544 8.250 -0.000 0.000 0.441 280 I N 0.677 121.246 120.570 -0.003 0.000 2.142 280 I HA -0.287 3.878 4.170 -0.008 0.000 0.240 280 I C 2.085 178.196 176.117 -0.010 0.000 1.078 280 I CA 0.967 62.261 61.300 -0.010 0.000 1.343 280 I CB -0.230 37.764 38.000 -0.011 0.000 1.046 280 I HN 0.047 8.257 8.210 -0.000 0.000 0.405 281 L N 0.328 121.545 121.223 -0.009 0.000 2.046 281 L HA -0.178 4.157 4.340 -0.008 0.000 0.208 281 L C 2.325 179.191 176.870 -0.007 0.000 1.077 281 L CA 1.828 56.661 54.840 -0.013 0.000 0.747 281 L CB -0.564 41.485 42.059 -0.017 0.000 0.896 281 L HN 0.165 8.395 8.230 -0.000 0.000 0.432 282 I N -1.657 118.915 120.570 0.005 0.000 2.163 282 I HA -0.299 3.866 4.170 -0.008 0.000 0.240 282 I C 2.451 178.587 176.117 0.033 0.000 1.081 282 I CA 1.166 62.479 61.300 0.021 0.000 1.353 282 I CB -0.336 37.689 38.000 0.041 0.000 1.054 282 I HN 0.149 8.359 8.210 -0.000 0.000 0.407 283 S N 0.555 116.270 115.700 0.025 0.000 2.359 283 S HA -0.218 4.247 4.470 -0.008 0.000 0.224 283 S C 1.957 176.553 174.600 -0.007 0.000 1.035 283 S CA 1.420 59.626 58.200 0.009 0.000 1.018 283 S CB -0.226 62.960 63.200 -0.024 0.000 0.876 283 S HN 0.336 8.646 8.310 -0.000 0.000 0.448 284 K N 0.181 120.572 120.400 -0.014 0.000 2.063 284 K HA -0.098 4.217 4.320 -0.008 0.000 0.208 284 K C 2.329 178.917 176.600 -0.021 0.000 1.048 284 K CA 1.486 57.760 56.287 -0.022 0.000 0.928 284 K CB -0.355 32.131 32.500 -0.024 0.000 0.713 284 K HN 0.369 8.619 8.250 -0.000 0.000 0.442 285 C N 0.718 120.010 119.300 -0.014 0.000 2.440 285 C HA -0.042 4.413 4.460 -0.008 0.000 0.278 285 C C 2.151 177.134 174.990 -0.011 0.000 1.295 285 C CA 0.590 59.600 59.018 -0.015 0.000 1.738 285 C CB -1.221 26.511 27.740 -0.014 0.000 1.987 285 C HN 0.540 8.770 8.230 -0.000 0.000 0.492 286 N N 0.782 119.489 118.700 0.010 0.000 2.104 286 N HA -0.146 4.589 4.740 -0.008 0.000 0.190 286 N C 1.538 177.030 175.510 -0.030 0.000 1.024 286 N CA 1.414 54.479 53.050 0.025 0.000 0.853 286 N CB -0.136 38.422 38.487 0.117 0.000 1.008 286 N HN 0.317 8.697 8.380 -0.000 0.000 0.424 287 V N 1.186 121.077 119.914 -0.039 0.000 2.379 287 V HA -0.134 3.981 4.120 -0.008 0.000 0.245 287 V C 2.272 178.322 176.094 -0.074 0.000 1.044 287 V CA 1.713 63.971 62.300 -0.071 0.000 1.036 287 V CB -0.781 31.007 31.823 -0.058 0.000 0.664 287 V HN 0.344 8.534 8.190 -0.000 0.000 0.453 288 A N -0.167 122.623 122.820 -0.050 0.000 2.125 288 A HA 0.187 4.502 4.320 -0.008 0.000 0.219 288 A C 2.017 179.574 177.584 -0.046 0.000 1.156 288 A CA 1.223 53.235 52.037 -0.042 0.000 0.671 288 A CB -0.885 18.097 19.000 -0.031 0.000 0.794 288 A HN 1.349 9.499 8.150 -0.000 0.000 0.459 289 G N -0.929 107.836 108.800 -0.058 0.000 2.221 289 G HA2 -0.261 3.694 3.960 -0.008 0.000 0.265 289 G HA3 -0.261 3.694 3.960 -0.008 0.000 0.265 289 G C -0.035 174.850 174.900 -0.025 0.000 1.041 289 G CA 0.723 45.791 45.100 -0.053 0.000 0.807 289 G HN 0.635 8.925 8.290 -0.000 0.000 0.502 290 K N 0.151 120.539 120.400 -0.021 0.000 2.316 290 K HA 0.510 4.825 4.320 -0.008 0.000 0.251 290 K C -2.635 173.958 176.600 -0.012 0.000 0.934 290 K CA -2.328 53.952 56.287 -0.012 0.000 0.802 290 K CB 2.382 34.874 32.500 -0.013 0.000 1.171 290 K HN -0.075 8.175 8.250 -0.000 0.000 0.426 291 P HA -0.042 4.378 4.420 -0.000 0.000 0.266 291 P C -1.111 176.173 177.300 -0.026 0.000 1.195 291 P CA -0.273 62.821 63.100 -0.010 0.000 0.768 291 P CB 0.631 32.333 31.700 0.003 0.000 0.838 292 V N 5.222 125.116 119.914 -0.033 0.000 2.638 292 V HA 0.510 4.625 4.120 -0.008 0.000 0.306 292 V C -0.851 175.205 176.094 -0.064 0.000 1.052 292 V CA -0.814 61.457 62.300 -0.048 0.000 0.885 292 V CB 1.396 33.201 31.823 -0.029 0.000 0.999 292 V HN 0.287 8.477 8.190 -0.000 0.000 0.424 293 I N 6.259 126.769 120.570 -0.100 0.000 2.378 293 I HA 0.424 4.589 4.170 -0.008 0.000 0.291 293 I C -0.187 175.872 176.117 -0.097 0.000 0.992 293 I CA -0.365 60.863 61.300 -0.119 0.000 1.154 293 I CB 1.611 39.478 38.000 -0.222 0.000 1.315 293 I HN 0.620 8.830 8.210 -0.000 0.000 0.448 294 C N 6.872 126.129 119.300 -0.070 0.000 2.303 294 C HA 0.849 5.304 4.460 -0.008 0.000 0.341 294 C C 0.467 175.425 174.990 -0.053 0.000 1.244 294 C CA -0.092 58.894 59.018 -0.053 0.000 1.765 294 C CB -1.099 26.618 27.740 -0.039 0.000 2.379 294 C HN 0.862 9.092 8.230 -0.000 0.000 0.530 295 A N 4.798 127.588 122.820 -0.049 0.000 2.527 295 A HA 0.962 5.277 4.320 -0.008 0.000 0.293 295 A C 0.031 177.607 177.584 -0.014 0.000 1.117 295 A CA 0.398 52.413 52.037 -0.037 0.000 0.723 295 A CB 0.996 19.958 19.000 -0.062 0.000 1.313 295 A HN 2.396 10.546 8.150 -0.000 0.000 0.411 296 T N -1.100 113.456 114.554 0.002 0.000 0.541 296 T HA -0.146 4.199 4.350 -0.008 0.000 0.774 296 T C -0.036 174.670 174.700 0.011 0.000 0.992 296 T CA 1.023 63.132 62.100 0.015 0.000 4.077 296 T CB -1.781 67.099 68.868 0.020 0.000 2.303 296 T HN 2.286 10.526 8.240 -0.000 0.000 0.398 297 Q N 1.456 121.266 119.800 0.016 0.000 2.439 297 Q HA -0.240 4.095 4.340 -0.008 0.000 0.325 297 Q C 0.996 176.999 176.000 0.004 0.000 1.372 297 Q CA 1.162 56.972 55.803 0.013 0.000 0.909 297 Q CB -0.929 27.818 28.738 0.015 0.000 1.167 297 Q HN 0.712 8.982 8.270 -0.000 0.000 0.418 298 M N -0.691 118.909 119.600 0.000 0.000 2.369 298 M HA 0.091 4.566 4.480 -0.008 0.000 0.254 298 M C 1.169 177.460 176.300 -0.016 0.000 1.136 298 M CA 1.305 56.598 55.300 -0.012 0.000 1.190 298 M CB 0.171 32.762 32.600 -0.016 0.000 1.289 298 M HN 0.379 8.669 8.290 -0.000 0.000 0.468 299 L N -0.080 121.138 121.223 -0.007 0.000 3.059 299 L HA 0.225 4.560 4.340 -0.008 0.000 0.298 299 L C 1.357 178.233 176.870 0.011 0.000 1.304 299 L CA -0.165 54.676 54.840 0.001 0.000 0.855 299 L CB 0.552 42.611 42.059 0.001 0.000 1.266 299 L HN 0.298 8.528 8.230 -0.000 0.000 0.572 300 E N 0.884 121.090 120.200 0.009 0.000 2.097 300 E HA -0.253 4.092 4.350 -0.008 0.000 0.196 300 E C 2.064 178.669 176.600 0.008 0.000 1.000 300 E CA 1.879 58.282 56.400 0.006 0.000 0.804 300 E CB 0.297 30.007 29.700 0.017 0.000 0.740 300 E HN 0.598 8.958 8.360 -0.000 0.000 0.454 301 S N -0.083 115.635 115.700 0.029 0.000 2.474 301 S HA -0.123 4.342 4.470 -0.008 0.000 0.235 301 S C 1.796 176.427 174.600 0.050 0.000 0.997 301 S CA 0.687 58.916 58.200 0.049 0.000 0.949 301 S CB -0.130 63.101 63.200 0.052 0.000 0.766 301 S HN 0.251 8.561 8.310 -0.000 0.000 0.517 302 M N 1.557 121.178 119.600 0.034 0.000 2.618 302 M HA 0.065 4.540 4.480 -0.008 0.000 0.240 302 M C 1.240 177.574 176.300 0.055 0.000 1.123 302 M CA 0.438 55.765 55.300 0.046 0.000 1.060 302 M CB -0.446 32.185 32.600 0.052 0.000 1.535 302 M HN 0.362 8.652 8.290 -0.000 0.000 0.507 303 T N -0.410 114.104 114.554 -0.067 0.000 2.746 303 T HA -0.148 4.197 4.350 -0.008 0.000 0.267 303 T C 0.570 175.027 174.700 -0.404 0.000 1.039 303 T CA 1.528 63.433 62.100 -0.324 0.000 1.142 303 T CB -0.105 68.415 68.868 -0.579 0.000 0.866 303 T HN 0.469 8.709 8.240 -0.000 0.000 0.444 304 Y N 0.251 120.658 120.300 0.177 0.000 2.499 304 Y HA 0.408 4.953 4.550 -0.008 0.000 0.253 304 Y C 0.443 176.523 175.900 0.299 0.000 1.105 304 Y CA -1.315 56.903 58.100 0.196 0.000 1.240 304 Y CB -0.066 38.455 38.460 0.102 0.000 1.289 304 Y HN 0.128 8.408 8.280 -0.000 0.000 0.534 305 N N 2.697 121.585 118.700 0.313 0.000 2.417 305 N HA 0.191 4.926 4.740 -0.008 0.000 0.300 305 N C -2.099 173.293 175.510 -0.198 0.000 1.102 305 N CA -1.761 51.372 53.050 0.138 0.000 0.886 305 N CB 1.443 39.971 38.487 0.068 0.000 1.203 305 N HN -0.185 8.195 8.380 -0.000 0.000 0.496 306 P HA -0.059 4.361 4.420 -0.000 0.000 0.226 306 P C -0.459 176.564 177.300 -0.463 0.000 1.153 306 P CA 1.125 63.656 63.100 -0.948 0.000 0.777 306 P CB 0.549 31.906 31.700 -0.572 0.000 0.794 307 R N -0.359 120.001 120.500 -0.233 0.000 2.771 307 R HA 0.513 4.848 4.340 -0.008 0.000 0.274 307 R C -2.674 173.620 176.300 -0.009 0.000 0.987 307 R CA -2.059 53.972 56.100 -0.113 0.000 0.908 307 R CB 1.908 32.146 30.300 -0.103 0.000 1.213 307 R HN -0.051 8.219 8.270 -0.000 0.000 0.468 308 P HA 0.136 4.556 4.420 -0.000 0.000 0.284 308 P C -0.572 176.771 177.300 0.072 0.000 1.287 308 P CA -0.522 62.628 63.100 0.083 0.000 0.824 308 P CB 0.689 32.457 31.700 0.114 0.000 1.180 309 T N -2.759 111.827 114.554 0.052 0.000 2.868 309 T HA 0.174 4.519 4.350 -0.008 0.000 0.292 309 T C 1.375 176.104 174.700 0.048 0.000 1.028 309 T CA -0.455 61.671 62.100 0.044 0.000 1.059 309 T CB 0.568 69.455 68.868 0.033 0.000 0.991 309 T HN 0.342 8.582 8.240 -0.000 0.000 0.531 310 R N 0.869 121.395 120.500 0.044 0.000 2.096 310 R HA -0.100 4.235 4.340 -0.008 0.000 0.235 310 R C 2.474 178.791 176.300 0.028 0.000 1.127 310 R CA 1.514 57.639 56.100 0.042 0.000 0.968 310 R CB -1.008 29.315 30.300 0.038 0.000 0.861 310 R HN 0.878 9.148 8.270 -0.000 0.000 0.440 311 A N 0.798 123.633 122.820 0.023 0.000 1.969 311 A HA -0.146 4.169 4.320 -0.008 0.000 0.218 311 A C 1.854 179.444 177.584 0.009 0.000 1.169 311 A CA 1.245 53.292 52.037 0.018 0.000 0.635 311 A CB -0.272 18.738 19.000 0.017 0.000 0.810 311 A HN 0.429 8.579 8.150 -0.000 0.000 0.445 312 E N -0.323 119.882 120.200 0.009 0.000 2.110 312 E HA -0.131 4.214 4.350 -0.008 0.000 0.193 312 E C 1.950 178.529 176.600 -0.035 0.000 0.988 312 E CA 1.301 57.697 56.400 -0.006 0.000 0.804 312 E CB -0.244 29.458 29.700 0.004 0.000 0.745 312 E HN 0.412 8.772 8.360 -0.000 0.000 0.458 313 V N 1.358 121.249 119.914 -0.038 0.000 2.295 313 V HA -0.282 3.833 4.120 -0.008 0.000 0.246 313 V C 2.560 178.613 176.094 -0.067 0.000 1.049 313 V CA 2.028 64.271 62.300 -0.095 0.000 1.024 313 V CB -0.670 31.113 31.823 -0.067 0.000 0.648 313 V HN 0.385 8.575 8.190 -0.000 0.000 0.447 314 S N 0.097 115.787 115.700 -0.016 0.000 2.382 314 S HA -0.273 4.192 4.470 -0.008 0.000 0.228 314 S C 1.812 176.420 174.600 0.013 0.000 1.027 314 S CA 1.705 59.914 58.200 0.016 0.000 0.991 314 S CB -0.569 62.652 63.200 0.036 0.000 0.823 314 S HN 0.616 8.926 8.310 -0.000 0.000 0.469 315 D N 1.523 121.921 120.400 -0.004 0.000 2.092 315 D HA -0.110 4.525 4.640 -0.008 0.000 0.193 315 D C 1.889 178.171 176.300 -0.031 0.000 0.994 315 D CA 1.624 55.620 54.000 -0.006 0.000 0.828 315 D CB -0.542 40.252 40.800 -0.009 0.000 0.963 315 D HN 0.311 8.681 8.370 -0.000 0.000 0.450 316 V N 0.931 120.805 119.914 -0.066 0.000 2.261 316 V HA -0.226 3.889 4.120 -0.008 0.000 0.246 316 V C 2.667 178.677 176.094 -0.140 0.000 1.047 316 V CA 1.969 64.207 62.300 -0.104 0.000 1.015 316 V CB -1.126 30.611 31.823 -0.143 0.000 0.642 316 V HN 0.345 8.535 8.190 -0.000 0.000 0.446 317 A N 0.305 123.032 122.820 -0.154 0.000 1.908 317 A HA -0.259 4.056 4.320 -0.008 0.000 0.218 317 A C 2.061 179.477 177.584 -0.279 0.000 1.181 317 A CA 2.175 54.051 52.037 -0.268 0.000 0.627 317 A CB -0.686 18.227 19.000 -0.145 0.000 0.818 317 A HN 0.612 8.762 8.150 -0.000 0.000 0.445 318 N N 0.004 118.710 118.700 0.009 0.000 2.396 318 N HA -0.021 4.714 4.740 -0.008 0.000 0.180 318 N C 1.869 177.427 175.510 0.080 0.000 1.028 318 N CA 1.112 54.265 53.050 0.172 0.000 0.893 318 N CB -0.352 38.238 38.487 0.171 0.000 0.967 318 N HN 0.489 8.869 8.380 -0.000 0.000 0.440 319 A N 0.897 123.712 122.820 -0.009 0.000 1.883 319 A HA -0.103 4.212 4.320 -0.008 0.000 0.217 319 A C 2.484 180.046 177.584 -0.037 0.000 1.186 319 A CA 1.329 53.355 52.037 -0.018 0.000 0.624 319 A CB -0.752 18.220 19.000 -0.046 0.000 0.822 319 A HN 0.089 8.239 8.150 -0.000 0.000 0.444 320 V N -1.111 118.720 119.914 -0.139 0.000 2.295 320 V HA -0.226 3.889 4.120 -0.008 0.000 0.246 320 V C 2.329 178.365 176.094 -0.097 0.000 1.049 320 V CA 1.999 64.179 62.300 -0.201 0.000 1.024 320 V CB -1.059 30.543 31.823 -0.369 0.000 0.648 320 V HN 0.530 8.720 8.190 -0.000 0.000 0.447 321 F N 0.961 120.941 119.950 0.051 0.000 2.171 321 F HA -0.117 4.405 4.527 -0.009 0.000 0.300 321 F C 2.227 178.144 175.800 0.195 0.000 1.090 321 F CA 1.280 59.351 58.000 0.117 0.000 1.293 321 F CB -1.290 37.758 39.000 0.080 0.000 1.013 321 F HN 0.238 8.538 8.300 -0.000 0.000 0.486 322 N N -0.711 118.165 118.700 0.293 0.000 2.205 322 N HA -0.066 4.669 4.740 -0.008 0.000 0.186 322 N C 1.462 177.153 175.510 0.302 0.000 1.015 322 N CA 0.947 54.130 53.050 0.221 0.000 0.862 322 N CB -0.242 38.318 38.487 0.122 0.000 0.986 322 N HN 0.408 8.788 8.380 -0.000 0.000 0.429 323 G N -0.308 108.658 108.800 0.277 0.000 2.164 323 G HA2 -0.129 3.826 3.960 -0.008 0.000 0.154 323 G HA3 -0.129 3.826 3.960 -0.008 0.000 0.154 323 G C 0.000 174.930 174.900 0.049 0.000 1.014 323 G CA -0.123 45.114 45.100 0.227 0.000 0.683 323 G HN 0.482 8.772 8.290 -0.000 0.000 0.500 324 A N 0.108 122.938 122.820 0.016 0.000 2.540 324 A HA 0.502 4.817 4.320 -0.008 0.000 0.239 324 A C 1.087 178.642 177.584 -0.050 0.000 1.061 324 A CA 1.293 53.318 52.037 -0.020 0.000 0.758 324 A CB 0.144 19.125 19.000 -0.031 0.000 0.991 324 A HN 0.336 8.486 8.150 -0.000 0.000 0.502 325 D N 0.268 120.643 120.400 -0.041 0.000 2.123 325 D HA 0.025 4.660 4.640 -0.008 0.000 0.200 325 D C 0.054 176.332 176.300 -0.038 0.000 0.976 325 D CA 1.448 55.423 54.000 -0.041 0.000 0.831 325 D CB 0.061 40.846 40.800 -0.025 0.000 0.974 325 D HN 0.539 8.909 8.370 -0.000 0.000 0.469 326 C N 0.103 119.380 119.300 -0.039 0.000 2.712 326 C HA 0.662 5.117 4.460 -0.008 0.000 0.308 326 C C -0.421 174.543 174.990 -0.044 0.000 1.201 326 C CA -1.183 57.815 59.018 -0.033 0.000 1.554 326 C CB 1.488 29.213 27.740 -0.024 0.000 2.117 326 C HN 0.115 8.345 8.230 -0.000 0.000 0.480 327 V N 0.991 120.883 119.914 -0.037 0.000 2.628 327 V HA 0.763 4.878 4.120 -0.008 0.000 0.306 327 V C -0.594 175.489 176.094 -0.018 0.000 1.045 327 V CA -0.630 61.647 62.300 -0.039 0.000 0.905 327 V CB 1.714 33.505 31.823 -0.052 0.000 0.997 327 V HN 0.977 9.167 8.190 -0.000 0.000 0.436 328 M N 4.352 123.943 119.600 -0.016 0.000 2.393 328 M HA 0.659 5.134 4.480 -0.008 0.000 0.316 328 M C -1.847 174.465 176.300 0.020 0.000 1.087 328 M CA -0.690 54.617 55.300 0.011 0.000 0.937 328 M CB 1.990 34.591 32.600 0.002 0.000 1.668 328 M HN 0.754 9.044 8.290 -0.000 0.000 0.438 329 L N 2.934 124.181 121.223 0.039 0.000 2.317 329 L HA 0.503 4.838 4.340 -0.008 0.000 0.281 329 L C 0.095 177.000 176.870 0.059 0.000 1.024 329 L CA -0.261 54.603 54.840 0.040 0.000 0.810 329 L CB 1.977 44.060 42.059 0.040 0.000 1.240 329 L HN 0.820 9.050 8.230 -0.000 0.000 0.427 330 S N 1.153 116.884 115.700 0.052 0.000 3.096 330 S HA 0.159 4.624 4.470 -0.008 0.000 0.169 330 S C 1.591 176.226 174.600 0.058 0.000 0.736 330 S CA 0.345 58.586 58.200 0.069 0.000 0.976 330 S CB -0.248 62.992 63.200 0.067 0.000 0.705 330 S HN 0.865 9.175 8.310 -0.000 0.000 0.666 331 G N 1.176 109.999 108.800 0.039 0.000 2.462 331 G HA2 -0.182 3.773 3.960 -0.008 0.000 0.220 331 G HA3 -0.182 3.773 3.960 -0.008 0.000 0.220 331 G C 1.004 175.882 174.900 -0.037 0.000 1.121 331 G CA 1.055 46.160 45.100 0.009 0.000 0.758 331 G HN 0.536 8.826 8.290 -0.000 0.000 0.559 332 E N 0.146 120.328 120.200 -0.030 0.000 2.160 332 E HA -0.107 4.239 4.350 -0.008 0.000 0.195 332 E C 2.698 179.295 176.600 -0.004 0.000 0.991 332 E CA 1.795 58.175 56.400 -0.034 0.000 0.810 332 E CB -0.211 29.488 29.700 -0.001 0.000 0.742 332 E HN 0.620 8.980 8.360 -0.000 0.000 0.466 333 T N -3.081 111.485 114.554 0.021 0.000 2.990 333 T HA 0.393 4.738 4.350 -0.008 0.000 0.249 333 T C 1.929 176.656 174.700 0.044 0.000 1.039 333 T CA 0.208 62.330 62.100 0.038 0.000 1.036 333 T CB 0.202 69.102 68.868 0.053 0.000 0.994 333 T HN 0.138 8.378 8.240 -0.000 0.000 0.489 334 A N 3.284 126.135 122.820 0.051 0.000 1.872 334 A HA 0.094 4.409 4.320 -0.008 0.000 0.214 334 A C 2.031 179.649 177.584 0.056 0.000 1.187 334 A CA 1.379 53.461 52.037 0.075 0.000 0.614 334 A CB -0.303 18.757 19.000 0.100 0.000 0.826 334 A HN 0.711 8.861 8.150 -0.000 0.000 0.442 335 K N -1.284 119.130 120.400 0.024 0.000 2.564 335 K HA 0.364 4.679 4.320 -0.008 0.000 0.201 335 K C 0.530 177.120 176.600 -0.016 0.000 1.086 335 K CA 0.141 56.443 56.287 0.024 0.000 1.062 335 K CB 0.163 32.691 32.500 0.047 0.000 0.849 335 K HN 0.245 8.495 8.250 -0.000 0.000 0.529 336 G N 1.127 109.885 108.800 -0.070 0.000 2.537 336 G HA2 0.080 4.035 3.960 -0.008 0.000 0.273 336 G HA3 0.080 4.035 3.960 -0.008 0.000 0.273 336 G C -0.108 174.740 174.900 -0.086 0.000 1.189 336 G CA -0.626 44.384 45.100 -0.150 0.000 0.881 336 G HN 0.173 8.463 8.290 -0.000 0.000 0.535 337 K N -0.847 119.474 120.400 -0.131 0.000 2.361 337 K HA 0.093 4.408 4.320 -0.008 0.000 0.196 337 K C -0.247 176.029 176.600 -0.539 0.000 1.039 337 K CA 0.472 56.564 56.287 -0.325 0.000 1.001 337 K CB 0.084 32.324 32.500 -0.433 0.000 0.795 337 K HN 0.540 8.790 8.250 -0.000 0.000 0.495 338 Y N 0.179 120.486 120.300 0.012 0.000 2.516 338 Y HA 0.238 4.783 4.550 -0.008 0.000 0.341 338 Y C -2.004 173.905 175.900 0.015 0.000 0.912 338 Y CA -2.115 55.995 58.100 0.017 0.000 1.167 338 Y CB 0.973 39.444 38.460 0.019 0.000 1.195 338 Y HN 0.077 8.357 8.280 -0.000 0.000 0.610 339 P HA -0.159 4.261 4.420 -0.000 0.000 0.215 339 P C 0.826 178.177 177.300 0.085 0.000 1.153 339 P CA 1.571 64.716 63.100 0.075 0.000 0.853 339 P CB 0.614 32.341 31.700 0.044 0.000 0.788 340 N N 0.182 118.934 118.700 0.087 0.000 2.142 340 N HA -0.118 4.617 4.740 -0.008 0.000 0.186 340 N C 1.743 177.309 175.510 0.092 0.000 1.023 340 N CA 1.203 54.300 53.050 0.079 0.000 0.852 340 N CB -0.655 37.872 38.487 0.068 0.000 0.998 340 N HN 0.209 8.589 8.380 -0.000 0.000 0.424 341 E N 0.415 120.686 120.200 0.118 0.000 2.106 341 E HA -0.058 4.287 4.350 -0.008 0.000 0.192 341 E C 1.939 178.609 176.600 0.117 0.000 0.984 341 E CA 0.270 56.730 56.400 0.100 0.000 0.806 341 E CB -0.348 29.406 29.700 0.090 0.000 0.750 341 E HN 0.047 8.407 8.360 -0.000 0.000 0.458 342 V N 0.020 120.012 119.914 0.128 0.000 2.358 342 V HA -0.207 3.909 4.120 -0.008 0.000 0.246 342 V C 1.938 178.096 176.094 0.106 0.000 1.047 342 V CA 1.358 63.733 62.300 0.126 0.000 1.035 342 V CB -0.055 31.828 31.823 0.100 0.000 0.658 342 V HN 0.141 8.331 8.190 -0.000 0.000 0.452 343 V N -0.191 119.776 119.914 0.087 0.000 2.307 343 V HA -0.306 3.809 4.120 -0.008 0.000 0.245 343 V C 2.457 178.596 176.094 0.076 0.000 1.045 343 V CA 2.443 64.784 62.300 0.068 0.000 1.024 343 V CB -0.848 31.011 31.823 0.060 0.000 0.651 343 V HN 0.584 8.774 8.190 -0.000 0.000 0.449 344 Q N -1.323 118.533 119.800 0.094 0.000 2.096 344 Q HA -0.239 4.096 4.340 -0.008 0.000 0.204 344 Q C 2.266 178.363 176.000 0.161 0.000 0.982 344 Q CA 2.156 58.020 55.803 0.101 0.000 0.850 344 Q CB -0.272 28.517 28.738 0.086 0.000 0.901 344 Q HN 0.715 8.985 8.270 -0.000 0.000 0.422 345 Y N 0.629 120.930 120.300 0.002 0.000 2.220 345 Y HA -0.145 4.400 4.550 -0.008 0.000 0.291 345 Y C 2.129 178.021 175.900 -0.014 0.000 1.129 345 Y CA 1.278 59.373 58.100 -0.009 0.000 1.161 345 Y CB -0.399 38.051 38.460 -0.016 0.000 0.997 345 Y HN 0.084 8.364 8.280 -0.000 0.000 0.522 346 M N -0.243 119.345 119.600 -0.021 0.000 2.082 346 M HA -0.249 4.226 4.480 -0.008 0.000 0.258 346 M C 2.231 178.484 176.300 -0.080 0.000 1.069 346 M CA 2.386 57.625 55.300 -0.102 0.000 1.102 346 M CB -0.300 32.274 32.600 -0.044 0.000 1.336 346 M HN 0.261 8.551 8.290 -0.000 0.000 0.404 347 A N 0.117 122.929 122.820 -0.014 0.000 1.902 347 A HA -0.224 4.091 4.320 -0.008 0.000 0.217 347 A C 2.190 179.763 177.584 -0.018 0.000 1.181 347 A CA 2.015 54.047 52.037 -0.008 0.000 0.623 347 A CB -0.793 18.222 19.000 0.026 0.000 0.818 347 A HN 0.641 8.791 8.150 -0.000 0.000 0.443 348 R N -0.478 120.033 120.500 0.017 0.000 2.092 348 R HA -0.031 4.304 4.340 -0.008 0.000 0.231 348 R C 1.926 178.199 176.300 -0.044 0.000 1.119 348 R CA 1.491 57.612 56.100 0.035 0.000 0.970 348 R CB -0.350 30.051 30.300 0.169 0.000 0.864 348 R HN 0.580 8.850 8.270 -0.000 0.000 0.440 349 I N -0.176 120.302 120.570 -0.153 0.000 2.202 349 I HA -0.349 3.816 4.170 -0.008 0.000 0.242 349 I C 2.442 178.449 176.117 -0.184 0.000 1.091 349 I CA 0.932 62.105 61.300 -0.211 0.000 1.368 349 I CB -0.317 37.480 38.000 -0.338 0.000 1.058 349 I HN 0.284 8.494 8.210 -0.000 0.000 0.410 350 C N 0.301 119.499 119.300 -0.170 0.000 2.413 350 C HA -0.163 4.292 4.460 -0.008 0.000 0.276 350 C C 2.766 177.655 174.990 -0.169 0.000 1.236 350 C CA 0.615 59.527 59.018 -0.177 0.000 1.735 350 C CB -0.932 26.729 27.740 -0.133 0.000 2.031 350 C HN 0.501 8.731 8.230 -0.000 0.000 0.474 351 L N 1.532 122.682 121.223 -0.121 0.000 2.046 351 L HA -0.101 4.234 4.340 -0.008 0.000 0.208 351 L C 2.471 179.281 176.870 -0.100 0.000 1.077 351 L CA 2.321 57.093 54.840 -0.113 0.000 0.747 351 L CB -0.994 41.025 42.059 -0.067 0.000 0.896 351 L HN 0.324 8.554 8.230 -0.000 0.000 0.432 352 E N -0.052 120.100 120.200 -0.079 0.000 2.058 352 E HA -0.203 4.142 4.350 -0.008 0.000 0.194 352 E C 2.110 178.677 176.600 -0.055 0.000 0.997 352 E CA 1.767 58.138 56.400 -0.049 0.000 0.801 352 E CB -0.480 29.201 29.700 -0.032 0.000 0.746 352 E HN 0.527 8.887 8.360 -0.000 0.000 0.450 353 A N 0.639 123.358 122.820 -0.168 0.000 1.883 353 A HA -0.278 4.037 4.320 -0.008 0.000 0.217 353 A C 2.283 179.756 177.584 -0.186 0.000 1.186 353 A CA 1.959 53.780 52.037 -0.361 0.000 0.624 353 A CB -0.867 17.628 19.000 -0.840 0.000 0.822 353 A HN 0.489 8.639 8.150 -0.000 0.000 0.444 354 Q N -0.061 119.630 119.800 -0.181 0.000 2.135 354 Q HA -0.167 4.168 4.340 -0.008 0.000 0.204 354 Q C 1.990 177.983 176.000 -0.012 0.000 0.981 354 Q CA 1.897 57.630 55.803 -0.115 0.000 0.856 354 Q CB -0.181 28.439 28.738 -0.196 0.000 0.902 354 Q HN 0.600 8.870 8.270 -0.000 0.000 0.425 355 S N -0.140 115.557 115.700 -0.005 0.000 2.474 355 S HA -0.039 4.426 4.470 -0.008 0.000 0.235 355 S C 1.540 176.229 174.600 0.148 0.000 0.997 355 S CA 0.826 59.054 58.200 0.046 0.000 0.949 355 S CB 0.068 63.278 63.200 0.016 0.000 0.766 355 S HN 0.524 8.834 8.310 -0.000 0.000 0.517 356 A N 0.197 123.150 122.820 0.221 0.000 2.252 356 A HA 0.440 4.756 4.320 -0.008 0.000 0.213 356 A C 0.643 178.481 177.584 0.423 0.000 1.188 356 A CA -0.285 51.938 52.037 0.309 0.000 0.863 356 A CB 0.003 19.202 19.000 0.331 0.000 0.893 356 A HN 0.443 8.593 8.150 -0.000 0.000 0.495 357 L N 1.021 122.492 121.223 0.414 0.000 2.319 357 L HA 0.285 4.620 4.340 -0.008 0.000 0.280 357 L C -0.333 176.633 176.870 0.161 0.000 1.099 357 L CA -0.600 54.463 54.840 0.372 0.000 0.828 357 L CB 0.557 42.804 42.059 0.312 0.000 1.150 357 L HN 0.207 8.437 8.230 -0.000 0.000 0.442 358 N N 3.372 122.111 118.700 0.065 0.000 2.439 358 N HA 0.045 4.780 4.740 -0.008 0.000 0.243 358 N C 0.527 176.130 175.510 0.154 0.000 1.088 358 N CA -0.050 52.891 53.050 -0.183 0.000 0.940 358 N CB 1.060 39.367 38.487 -0.300 0.000 1.180 358 N HN 0.632 9.012 8.380 -0.000 0.000 0.505 359 E N 1.813 122.120 120.200 0.178 0.000 2.153 359 E HA -0.181 4.164 4.350 -0.008 0.000 0.194 359 E C 0.851 177.686 176.600 0.392 0.000 0.988 359 E CA 1.014 57.589 56.400 0.292 0.000 0.811 359 E CB -0.229 29.631 29.700 0.267 0.000 0.746 359 E HN 0.664 9.024 8.360 -0.000 0.000 0.466 360 Y N 0.419 120.818 120.300 0.164 0.000 2.207 360 Y HA -0.251 4.294 4.550 -0.008 0.000 0.287 360 Y C 1.963 177.916 175.900 0.087 0.000 1.156 360 Y CA 1.054 59.128 58.100 -0.043 0.000 1.182 360 Y CB -0.080 38.215 38.460 -0.277 0.000 0.979 360 Y HN -0.113 8.167 8.280 -0.000 0.000 0.521 361 V N -0.433 119.586 119.914 0.174 0.000 2.287 361 V HA -0.332 3.783 4.120 -0.008 0.000 0.248 361 V C 2.077 178.153 176.094 -0.030 0.000 1.053 361 V CA 2.112 64.439 62.300 0.045 0.000 1.027 361 V CB -0.927 30.905 31.823 0.016 0.000 0.646 361 V HN 0.320 8.510 8.190 -0.000 0.000 0.447 362 F N -0.535 119.421 119.950 0.010 0.000 2.069 362 F HA -0.184 4.338 4.527 -0.008 0.000 0.298 362 F C 2.206 178.005 175.800 -0.002 0.000 1.113 362 F CA 2.281 60.289 58.000 0.013 0.000 1.214 362 F CB -0.939 38.098 39.000 0.061 0.000 0.978 362 F HN 0.177 8.477 8.300 -0.000 0.000 0.474 363 F N 1.124 121.124 119.950 0.084 0.000 2.065 363 F HA -0.303 4.221 4.527 -0.006 0.000 0.298 363 F C 2.360 178.084 175.800 -0.127 0.000 1.112 363 F CA 2.229 60.227 58.000 -0.005 0.000 1.212 363 F CB -1.012 37.901 39.000 -0.147 0.000 0.975 363 F HN 0.009 8.309 8.300 -0.000 0.000 0.476 364 N N -0.506 117.845 118.700 -0.581 0.000 2.106 364 N HA -0.179 4.556 4.740 -0.008 0.000 0.188 364 N C 1.976 177.272 175.510 -0.355 0.000 1.029 364 N CA 1.467 54.149 53.050 -0.613 0.000 0.848 364 N CB -0.125 38.102 38.487 -0.433 0.000 1.007 364 N HN 0.317 8.697 8.380 -0.000 0.000 0.423 365 S N 1.058 116.615 115.700 -0.238 0.000 2.359 365 S HA -0.100 4.365 4.470 -0.008 0.000 0.224 365 S C 2.048 176.552 174.600 -0.160 0.000 1.035 365 S CA 0.956 59.048 58.200 -0.180 0.000 1.018 365 S CB -0.186 62.899 63.200 -0.191 0.000 0.876 365 S HN 0.296 8.606 8.310 -0.000 0.000 0.448 366 I N 1.219 121.698 120.570 -0.152 0.000 2.202 366 I HA -0.166 3.999 4.170 -0.008 0.000 0.242 366 I C 2.517 178.586 176.117 -0.079 0.000 1.091 366 I CA 1.110 62.333 61.300 -0.128 0.000 1.368 366 I CB -0.268 37.627 38.000 -0.174 0.000 1.058 366 I HN 0.202 8.412 8.210 -0.000 0.000 0.410 367 K N 1.424 121.753 120.400 -0.119 0.000 2.044 367 K HA -0.234 4.082 4.320 -0.008 0.000 0.210 367 K C 2.098 178.628 176.600 -0.116 0.000 1.049 367 K CA 1.640 57.855 56.287 -0.120 0.000 0.927 367 K CB -0.023 32.157 32.500 -0.535 0.000 0.713 367 K HN 0.194 8.444 8.250 -0.000 0.000 0.443 368 K N 0.362 120.670 120.400 -0.154 0.000 2.280 368 K HA -0.106 4.209 4.320 -0.008 0.000 0.202 368 K C 1.860 178.423 176.600 -0.063 0.000 1.047 368 K CA 0.909 57.133 56.287 -0.105 0.000 0.942 368 K CB -0.012 32.424 32.500 -0.108 0.000 0.739 368 K HN 0.225 8.475 8.250 -0.000 0.000 0.457 369 L N 0.929 122.118 121.223 -0.056 0.000 2.554 369 L HA -0.032 4.303 4.340 -0.008 0.000 0.226 369 L C 0.514 177.384 176.870 0.001 0.000 1.137 369 L CA 0.090 54.911 54.840 -0.032 0.000 0.863 369 L CB -0.009 42.023 42.059 -0.045 0.000 0.985 369 L HN 0.074 8.304 8.230 -0.000 0.000 0.451 370 Q N 0.303 120.109 119.800 0.010 0.000 2.332 370 Q HA 0.021 4.356 4.340 -0.008 0.000 0.263 370 Q C -0.346 175.686 176.000 0.052 0.000 0.979 370 Q CA 0.172 56.002 55.803 0.044 0.000 0.885 370 Q CB 0.573 29.345 28.738 0.056 0.000 1.218 370 Q HN 0.153 8.424 8.270 -0.000 0.000 0.405 371 H N 1.799 120.863 119.070 -0.010 0.000 2.722 371 H HA 0.299 4.851 4.556 -0.006 0.000 0.328 371 H C -0.691 174.630 175.328 -0.012 0.000 1.067 371 H CA -0.010 56.030 56.048 -0.014 0.000 1.447 371 H CB 0.227 29.980 29.762 -0.015 0.000 1.469 371 H HN 0.498 8.778 8.280 -0.000 0.000 0.544 372 I N 8.429 128.636 120.570 -0.604 0.000 2.336 372 I HA 0.248 4.414 4.170 -0.008 0.000 0.292 372 I C -1.835 173.835 176.117 -0.745 0.000 0.991 372 I CA -2.022 58.978 61.300 -0.500 0.000 1.227 372 I CB 1.565 39.427 38.000 -0.231 0.000 1.366 372 I HN 0.657 8.867 8.210 -0.000 0.000 0.466 373 P HA 0.276 4.696 4.420 -0.000 0.000 0.278 373 P C -0.909 176.294 177.300 -0.160 0.000 1.238 373 P CA -0.427 62.542 63.100 -0.218 0.000 0.794 373 P CB 0.932 32.573 31.700 -0.098 0.000 0.955 374 M N 1.060 120.606 119.600 -0.091 0.000 2.291 374 M HA 0.228 4.703 4.480 -0.008 0.000 0.324 374 M C 1.108 177.396 176.300 -0.019 0.000 1.148 374 M CA -0.420 54.861 55.300 -0.033 0.000 1.104 374 M CB 1.011 33.596 32.600 -0.025 0.000 1.483 374 M HN 0.401 8.691 8.290 -0.000 0.000 0.467 375 S N 1.020 116.712 115.700 -0.014 0.000 2.614 375 S HA 0.416 4.881 4.470 -0.008 0.000 0.265 375 S C 1.016 175.592 174.600 -0.039 0.000 1.303 375 S CA -0.337 57.837 58.200 -0.043 0.000 1.000 375 S CB 1.106 64.255 63.200 -0.086 0.000 0.935 375 S HN 0.759 9.069 8.310 -0.000 0.000 0.551 376 A N 1.660 124.458 122.820 -0.038 0.000 1.883 376 A HA -0.193 4.122 4.320 -0.008 0.000 0.217 376 A C 1.950 179.579 177.584 0.075 0.000 1.186 376 A CA 1.948 54.016 52.037 0.052 0.000 0.624 376 A CB -1.340 17.774 19.000 0.191 0.000 0.822 376 A HN 1.014 9.164 8.150 -0.000 0.000 0.444 377 D N -0.200 120.173 120.400 -0.045 0.000 2.097 377 D HA -0.215 4.420 4.640 -0.008 0.000 0.195 377 D C 1.669 178.002 176.300 0.054 0.000 0.989 377 D CA 1.723 55.748 54.000 0.040 0.000 0.827 377 D CB -0.804 39.920 40.800 -0.127 0.000 0.966 377 D HN 0.450 8.820 8.370 -0.000 0.000 0.456 378 E N 0.886 121.102 120.200 0.026 0.000 2.077 378 E HA -0.056 4.289 4.350 -0.008 0.000 0.193 378 E C 2.139 178.750 176.600 0.019 0.000 0.989 378 E CA 1.763 58.210 56.400 0.078 0.000 0.800 378 E CB -0.564 29.183 29.700 0.077 0.000 0.746 378 E HN 0.355 8.715 8.360 -0.000 0.000 0.452 379 A N -0.178 122.641 122.820 -0.002 0.000 1.902 379 A HA -0.131 4.184 4.320 -0.008 0.000 0.217 379 A C 2.484 180.046 177.584 -0.037 0.000 1.181 379 A CA 1.557 53.576 52.037 -0.030 0.000 0.623 379 A CB -0.725 18.266 19.000 -0.016 0.000 0.818 379 A HN 0.197 8.347 8.150 -0.000 0.000 0.443 380 V N -0.902 119.012 119.914 0.000 0.000 2.343 380 V HA -0.302 3.813 4.120 -0.008 0.000 0.247 380 V C 2.647 178.728 176.094 -0.022 0.000 1.051 380 V CA 2.087 64.385 62.300 -0.003 0.000 1.036 380 V CB -0.901 30.941 31.823 0.032 0.000 0.654 380 V HN 0.723 8.913 8.190 -0.000 0.000 0.451 381 C N 0.388 119.684 119.300 -0.007 0.000 2.466 381 C HA -0.094 4.361 4.460 -0.008 0.000 0.278 381 C C 3.236 178.137 174.990 -0.148 0.000 1.288 381 C CA 1.194 60.213 59.018 0.001 0.000 1.722 381 C CB -1.004 26.812 27.740 0.126 0.000 2.017 381 C HN 0.758 8.988 8.230 -0.000 0.000 0.488 382 S N 0.940 116.382 115.700 -0.430 0.000 2.382 382 S HA -0.150 4.316 4.470 -0.008 0.000 0.228 382 S C 1.736 176.252 174.600 -0.139 0.000 1.027 382 S CA 1.930 59.724 58.200 -0.676 0.000 0.991 382 S CB -0.641 62.007 63.200 -0.920 0.000 0.823 382 S HN 0.573 8.883 8.310 -0.000 0.000 0.469 383 S N 2.266 117.908 115.700 -0.097 0.000 2.383 383 S HA 0.145 4.610 4.470 -0.008 0.000 0.227 383 S C 2.333 176.911 174.600 -0.038 0.000 1.026 383 S CA 0.945 59.127 58.200 -0.029 0.000 0.981 383 S CB -0.779 62.401 63.200 -0.033 0.000 0.818 383 S HN 0.776 9.086 8.310 -0.000 0.000 0.472 384 A N 1.107 123.894 122.820 -0.054 0.000 1.902 384 A HA -0.038 4.277 4.320 -0.008 0.000 0.217 384 A C 2.322 179.855 177.584 -0.084 0.000 1.181 384 A CA 1.451 53.453 52.037 -0.059 0.000 0.623 384 A CB -0.869 18.106 19.000 -0.042 0.000 0.818 384 A HN 0.342 8.492 8.150 -0.000 0.000 0.443 385 V N 1.131 120.990 119.914 -0.091 0.000 2.358 385 V HA -0.267 3.848 4.120 -0.008 0.000 0.246 385 V C 2.476 178.392 176.094 -0.298 0.000 1.047 385 V CA 2.059 64.255 62.300 -0.174 0.000 1.035 385 V CB -1.000 30.778 31.823 -0.074 0.000 0.658 385 V HN 0.744 8.934 8.190 -0.000 0.000 0.452 386 N N 0.272 118.820 118.700 -0.252 0.000 2.069 386 N HA -0.194 4.541 4.740 -0.008 0.000 0.191 386 N C 1.948 177.457 175.510 -0.002 0.000 1.031 386 N CA 1.966 54.953 53.050 -0.105 0.000 0.852 386 N CB -0.015 38.577 38.487 0.176 0.000 1.018 386 N HN 0.452 8.832 8.380 -0.000 0.000 0.423 387 S N 0.237 115.914 115.700 -0.038 0.000 2.383 387 S HA -0.086 4.379 4.470 -0.008 0.000 0.229 387 S C 2.130 176.681 174.600 -0.081 0.000 1.030 387 S CA 0.830 58.997 58.200 -0.055 0.000 1.002 387 S CB -0.266 62.886 63.200 -0.080 0.000 0.829 387 S HN 0.189 8.499 8.310 -0.000 0.000 0.467 388 V N 0.574 120.410 119.914 -0.130 0.000 2.255 388 V HA -0.231 3.884 4.120 -0.008 0.000 0.247 388 V C 1.953 177.936 176.094 -0.185 0.000 1.051 388 V CA 1.819 64.001 62.300 -0.196 0.000 1.018 388 V CB -0.834 30.794 31.823 -0.325 0.000 0.641 388 V HN 0.477 8.667 8.190 -0.000 0.000 0.445 389 Y N 0.493 120.740 120.300 -0.089 0.000 2.181 389 Y HA -0.187 4.359 4.550 -0.008 0.000 0.288 389 Y C 2.583 178.473 175.900 -0.018 0.000 1.146 389 Y CA 1.755 59.836 58.100 -0.032 0.000 1.164 389 Y CB -0.366 38.110 38.460 0.027 0.000 0.982 389 Y HN 0.325 8.605 8.280 -0.000 0.000 0.515 390 E N -0.922 119.356 120.200 0.130 0.000 2.106 390 E HA -0.144 4.201 4.350 -0.008 0.000 0.192 390 E C 1.858 178.480 176.600 0.037 0.000 0.984 390 E CA 1.707 58.149 56.400 0.071 0.000 0.806 390 E CB -0.124 29.604 29.700 0.046 0.000 0.750 390 E HN 0.518 8.878 8.360 -0.000 0.000 0.458 391 T N -2.123 112.435 114.554 0.007 0.000 3.086 391 T HA 0.161 4.506 4.350 -0.008 0.000 0.250 391 T C 0.401 175.169 174.700 0.114 0.000 1.074 391 T CA -0.296 61.821 62.100 0.028 0.000 0.988 391 T CB -0.015 68.770 68.868 -0.138 0.000 0.988 391 T HN -0.023 8.217 8.240 -0.000 0.000 0.530 392 K N 1.279 121.715 120.400 0.060 0.000 3.278 392 K HA -0.121 4.194 4.320 -0.008 0.000 0.270 392 K C 0.317 176.951 176.600 0.057 0.000 0.955 392 K CA 0.012 56.326 56.287 0.045 0.000 0.723 392 K CB -2.107 30.432 32.500 0.064 0.000 1.382 392 K HN 0.729 8.979 8.250 -0.000 0.000 0.461 393 A N 1.086 123.923 122.820 0.029 0.000 2.483 393 A HA 0.103 4.418 4.320 -0.008 0.000 0.238 393 A C 1.089 178.664 177.584 -0.014 0.000 1.070 393 A CA 0.100 52.167 52.037 0.050 0.000 0.770 393 A CB 0.378 19.380 19.000 0.002 0.000 1.008 393 A HN 0.290 8.440 8.150 -0.000 0.000 0.497 394 K N 0.102 120.505 120.400 0.006 0.000 2.354 394 K HA 0.399 4.714 4.320 -0.008 0.000 0.194 394 K C 0.274 176.830 176.600 -0.072 0.000 1.038 394 K CA 1.070 57.342 56.287 -0.025 0.000 1.052 394 K CB 0.383 32.893 32.500 0.016 0.000 0.861 394 K HN 0.833 9.083 8.250 -0.000 0.000 0.535 395 A N 0.719 123.508 122.820 -0.052 0.000 2.606 395 A HA 0.749 5.064 4.320 -0.008 0.000 0.293 395 A C -1.267 176.285 177.584 -0.052 0.000 1.082 395 A CA -0.723 51.270 52.037 -0.074 0.000 0.685 395 A CB 1.295 20.308 19.000 0.022 0.000 1.284 395 A HN 0.049 8.199 8.150 -0.000 0.000 0.408 396 M N 1.145 120.709 119.600 -0.061 0.000 2.456 396 M HA 0.548 5.023 4.480 -0.008 0.000 0.324 396 M C -1.187 175.117 176.300 0.006 0.000 1.124 396 M CA -0.866 54.415 55.300 -0.031 0.000 0.959 396 M CB 2.103 34.674 32.600 -0.049 0.000 1.692 396 M HN 0.353 8.643 8.290 -0.000 0.000 0.444 397 V N 3.441 123.368 119.914 0.021 0.000 2.409 397 V HA 0.494 4.609 4.120 -0.008 0.000 0.291 397 V C -0.574 175.537 176.094 0.029 0.000 1.020 397 V CA -0.723 61.595 62.300 0.031 0.000 0.848 397 V CB 1.857 33.703 31.823 0.038 0.000 0.990 397 V HN 0.636 8.826 8.190 -0.000 0.000 0.430 398 V N 6.280 126.208 119.914 0.023 0.000 2.409 398 V HA 0.462 4.577 4.120 -0.008 0.000 0.291 398 V C -0.458 175.652 176.094 0.026 0.000 1.020 398 V CA -0.670 61.649 62.300 0.033 0.000 0.848 398 V CB 1.683 33.525 31.823 0.032 0.000 0.990 398 V HN 0.588 8.778 8.190 -0.000 0.000 0.430 399 L N 4.112 125.360 121.223 0.042 0.000 2.260 399 L HA 0.638 4.973 4.340 -0.008 0.000 0.289 399 L C 0.340 177.231 176.870 0.036 0.000 1.057 399 L CA 0.694 55.546 54.840 0.019 0.000 0.811 399 L CB 1.365 43.426 42.059 0.003 0.000 1.184 399 L HN 0.741 8.971 8.230 -0.000 0.000 0.429 400 S N 2.626 118.343 115.700 0.027 0.000 2.653 400 S HA 0.383 4.848 4.470 -0.008 0.000 0.268 400 S C 0.424 175.051 174.600 0.043 0.000 1.153 400 S CA -0.656 57.569 58.200 0.041 0.000 1.036 400 S CB 0.422 63.649 63.200 0.045 0.000 1.103 400 S HN 0.598 8.908 8.310 -0.000 0.000 0.466 401 N N 2.127 120.856 118.700 0.048 0.000 2.207 401 N HA -0.046 4.689 4.740 -0.008 0.000 0.182 401 N C 1.939 177.484 175.510 0.058 0.000 1.020 401 N CA 1.974 55.058 53.050 0.057 0.000 0.858 401 N CB -0.309 38.212 38.487 0.057 0.000 0.991 401 N HN 0.811 9.191 8.380 -0.000 0.000 0.427 402 T N -3.426 111.159 114.554 0.053 0.000 3.081 402 T HA 0.281 4.626 4.350 -0.008 0.000 0.255 402 T C 1.400 176.125 174.700 0.042 0.000 1.113 402 T CA 0.905 63.033 62.100 0.046 0.000 1.082 402 T CB 0.273 69.168 68.868 0.045 0.000 0.939 402 T HN 0.294 8.534 8.240 -0.000 0.000 0.506 403 G N 1.668 110.496 108.800 0.045 0.000 2.217 403 G HA2 -0.348 3.607 3.960 -0.008 0.000 0.246 403 G HA3 -0.348 3.607 3.960 -0.008 0.000 0.246 403 G C 0.942 175.868 174.900 0.044 0.000 0.990 403 G CA 0.569 45.694 45.100 0.041 0.000 0.627 403 G HN 0.619 8.909 8.290 -0.000 0.000 0.522 404 R N 1.294 121.824 120.500 0.050 0.000 2.094 404 R HA -0.140 4.195 4.340 -0.008 0.000 0.239 404 R C 3.007 179.345 176.300 0.063 0.000 1.137 404 R CA 2.872 59.004 56.100 0.053 0.000 0.943 404 R CB -0.398 29.937 30.300 0.059 0.000 0.850 404 R HN 0.751 9.021 8.270 -0.000 0.000 0.433 405 S N -0.226 115.519 115.700 0.075 0.000 2.406 405 S HA 0.005 4.470 4.470 -0.008 0.000 0.228 405 S C 2.160 176.805 174.600 0.075 0.000 1.020 405 S CA 0.689 58.941 58.200 0.086 0.000 0.965 405 S CB -0.127 63.129 63.200 0.094 0.000 0.798 405 S HN 0.464 8.774 8.310 -0.000 0.000 0.488 406 A N 2.644 125.499 122.820 0.059 0.000 1.908 406 A HA -0.080 4.235 4.320 -0.008 0.000 0.218 406 A C 2.417 180.032 177.584 0.052 0.000 1.181 406 A CA 1.485 53.551 52.037 0.049 0.000 0.627 406 A CB -0.647 18.375 19.000 0.036 0.000 0.818 406 A HN 0.563 8.713 8.150 -0.000 0.000 0.445 407 R N -1.458 119.071 120.500 0.049 0.000 2.115 407 R HA -0.039 4.296 4.340 -0.008 0.000 0.230 407 R C 2.013 178.344 176.300 0.052 0.000 1.111 407 R CA 1.149 57.274 56.100 0.041 0.000 0.976 407 R CB -0.394 29.924 30.300 0.031 0.000 0.870 407 R HN 0.466 8.736 8.270 -0.000 0.000 0.445 408 L N 0.454 121.722 121.223 0.076 0.000 2.072 408 L HA -0.095 4.240 4.340 -0.008 0.000 0.205 408 L C 2.023 179.010 176.870 0.196 0.000 1.079 408 L CA 1.451 56.360 54.840 0.114 0.000 0.752 408 L CB -0.241 41.894 42.059 0.126 0.000 0.906 408 L HN -0.115 8.115 8.230 -0.000 0.000 0.436 409 V N -0.134 119.879 119.914 0.165 0.000 2.307 409 V HA -0.265 3.850 4.120 -0.008 0.000 0.245 409 V C 2.766 178.964 176.094 0.173 0.000 1.045 409 V CA 1.563 63.974 62.300 0.184 0.000 1.024 409 V CB -1.262 30.622 31.823 0.102 0.000 0.651 409 V HN 0.559 8.749 8.190 -0.000 0.000 0.449 410 A N -0.021 122.859 122.820 0.100 0.000 1.940 410 A HA -0.297 4.018 4.320 -0.008 0.000 0.219 410 A C 2.325 179.945 177.584 0.060 0.000 1.176 410 A CA 2.230 54.307 52.037 0.067 0.000 0.631 410 A CB -0.591 18.431 19.000 0.037 0.000 0.814 410 A HN 0.567 8.717 8.150 -0.000 0.000 0.446 411 K N -1.447 118.972 120.400 0.032 0.000 2.089 411 K HA -0.233 4.082 4.320 -0.008 0.000 0.210 411 K C 1.341 177.882 176.600 -0.099 0.000 1.048 411 K CA 2.059 58.300 56.287 -0.076 0.000 0.926 411 K CB -0.364 32.028 32.500 -0.180 0.000 0.714 411 K HN 0.546 8.796 8.250 -0.000 0.000 0.448 412 Y N 0.795 121.186 120.300 0.151 0.000 2.529 412 Y HA 0.164 4.709 4.550 -0.009 0.000 0.290 412 Y C -0.028 176.060 175.900 0.313 0.000 1.177 412 Y CA 0.161 58.425 58.100 0.274 0.000 1.305 412 Y CB 0.323 38.999 38.460 0.359 0.000 1.047 412 Y HN 0.011 8.291 8.280 -0.000 0.000 0.522 413 R N -0.229 120.434 120.500 0.271 0.000 3.079 413 R HA -0.149 4.186 4.340 -0.008 0.000 0.254 413 R C -2.942 173.495 176.300 0.230 0.000 0.900 413 R CA 0.253 56.467 56.100 0.191 0.000 0.641 413 R CB -1.972 28.423 30.300 0.159 0.000 1.307 413 R HN 0.262 8.532 8.270 -0.000 0.000 0.477 414 P HA -0.015 4.405 4.420 -0.000 0.000 0.270 414 P C 0.280 177.525 177.300 -0.091 0.000 1.223 414 P CA -0.097 62.931 63.100 -0.120 0.000 0.785 414 P CB 0.424 32.019 31.700 -0.175 0.000 0.923 415 N N 0.312 118.841 118.700 -0.284 0.000 2.378 415 N HA 0.087 4.822 4.740 -0.008 0.000 0.243 415 N C -0.189 175.307 175.510 -0.024 0.000 1.137 415 N CA -0.506 52.516 53.050 -0.047 0.000 0.862 415 N CB -1.270 37.240 38.487 0.038 0.000 1.116 415 N HN 0.453 8.833 8.380 -0.000 0.000 0.499 416 C N -3.023 116.209 119.300 -0.114 0.000 3.171 416 C HA 0.748 5.204 4.460 -0.008 0.000 0.308 416 C C -3.002 171.663 174.990 -0.542 0.000 1.334 416 C CA -1.986 56.866 59.018 -0.276 0.000 1.473 416 C CB 1.501 29.090 27.740 -0.251 0.000 1.866 416 C HN 0.037 8.267 8.230 -0.000 0.000 0.465 417 P HA 0.390 4.810 4.420 -0.000 0.000 0.269 417 P C -0.817 176.245 177.300 -0.396 0.000 1.209 417 P CA 0.282 62.794 63.100 -0.980 0.000 0.776 417 P CB 0.269 31.142 31.700 -1.379 0.000 0.876 418 I N 1.707 122.151 120.570 -0.210 0.000 2.354 418 I HA 0.249 4.415 4.170 -0.008 0.000 0.292 418 I C -0.345 175.767 176.117 -0.009 0.000 0.989 418 I CA -0.892 60.362 61.300 -0.078 0.000 1.188 418 I CB 1.647 39.626 38.000 -0.036 0.000 1.342 418 I HN -0.053 8.157 8.210 -0.000 0.000 0.457 419 V N 5.833 125.762 119.914 0.026 0.000 2.328 419 V HA 0.176 4.291 4.120 -0.008 0.000 0.278 419 V C -0.090 175.997 176.094 -0.011 0.000 1.021 419 V CA -0.609 61.711 62.300 0.035 0.000 0.838 419 V CB 1.341 33.246 31.823 0.137 0.000 0.999 419 V HN 0.875 9.065 8.190 -0.000 0.000 0.447 420 C N 6.988 126.265 119.300 -0.040 0.000 2.415 420 C HA 0.649 5.104 4.460 -0.008 0.000 0.369 420 C C 0.220 175.181 174.990 -0.047 0.000 1.279 420 C CA -0.207 58.796 59.018 -0.026 0.000 1.886 420 C CB -0.000 27.735 27.740 -0.008 0.000 2.468 420 C HN 0.691 8.921 8.230 -0.000 0.000 0.553 421 V N 6.822 126.718 119.914 -0.029 0.000 2.370 421 V HA 0.586 4.702 4.120 -0.008 0.000 0.279 421 V C 0.467 176.559 176.094 -0.004 0.000 1.029 421 V CA 0.011 62.294 62.300 -0.029 0.000 0.870 421 V CB 1.321 33.109 31.823 -0.059 0.000 0.984 421 V HN 0.992 9.182 8.190 -0.000 0.000 0.451 422 T N 1.896 116.477 114.554 0.044 0.000 2.906 422 T HA 0.411 4.756 4.350 -0.008 0.000 0.295 422 T C 0.825 175.609 174.700 0.141 0.000 1.061 422 T CA 0.273 62.423 62.100 0.083 0.000 1.000 422 T CB 1.957 70.883 68.868 0.098 0.000 1.103 422 T HN 0.840 9.080 8.240 -0.000 0.000 0.486 423 T N 0.909 115.546 114.554 0.139 0.000 3.086 423 T HA 0.355 4.700 4.350 -0.008 0.000 0.250 423 T C 0.513 175.406 174.700 0.321 0.000 1.074 423 T CA -0.189 62.006 62.100 0.159 0.000 0.988 423 T CB -0.097 68.843 68.868 0.120 0.000 0.988 423 T HN 0.511 8.751 8.240 -0.000 0.000 0.530 424 R N 0.417 121.095 120.500 0.297 0.000 2.480 424 R HA 0.542 4.878 4.340 -0.008 0.000 0.306 424 R C 0.519 176.907 176.300 0.146 0.000 0.958 424 R CA -0.615 55.615 56.100 0.216 0.000 0.861 424 R CB 1.769 32.134 30.300 0.110 0.000 1.171 424 R HN 0.076 8.346 8.270 -0.000 0.000 0.445 425 L N 1.729 122.922 121.223 -0.050 0.000 2.141 425 L HA -0.191 4.144 4.340 -0.008 0.000 0.209 425 L C 2.485 179.289 176.870 -0.110 0.000 1.094 425 L CA 1.482 56.177 54.840 -0.241 0.000 0.763 425 L CB -0.131 41.641 42.059 -0.477 0.000 0.908 425 L HN 0.707 8.937 8.230 -0.000 0.000 0.437 426 Q N -0.680 119.082 119.800 -0.063 0.000 2.224 426 Q HA -0.165 4.170 4.340 -0.008 0.000 0.203 426 Q C 1.944 177.935 176.000 -0.015 0.000 0.970 426 Q CA 1.621 57.398 55.803 -0.043 0.000 0.865 426 Q CB 0.166 28.882 28.738 -0.036 0.000 0.922 426 Q HN 0.411 8.681 8.270 -0.000 0.000 0.445 427 T N -0.352 114.208 114.554 0.011 0.000 2.737 427 T HA -0.157 4.188 4.350 -0.008 0.000 0.265 427 T C 1.876 176.588 174.700 0.020 0.000 1.038 427 T CA 1.212 63.327 62.100 0.026 0.000 1.144 427 T CB -0.411 68.486 68.868 0.049 0.000 0.866 427 T HN 0.422 8.662 8.240 -0.000 0.000 0.434 428 C N 1.422 120.734 119.300 0.020 0.000 2.401 428 C HA -0.093 4.362 4.460 -0.008 0.000 0.276 428 C C 2.887 177.874 174.990 -0.006 0.000 1.233 428 C CA 0.728 59.751 59.018 0.007 0.000 1.753 428 C CB -1.011 26.728 27.740 -0.002 0.000 2.029 428 C HN 0.539 8.769 8.230 -0.000 0.000 0.478 429 R N -0.048 120.440 120.500 -0.020 0.000 2.073 429 R HA -0.096 4.239 4.340 -0.008 0.000 0.229 429 R C 2.331 178.629 176.300 -0.003 0.000 1.120 429 R CA 1.113 57.201 56.100 -0.020 0.000 0.967 429 R CB -0.383 29.893 30.300 -0.041 0.000 0.862 429 R HN 0.650 8.920 8.270 -0.000 0.000 0.436 430 Q N 0.572 120.371 119.800 -0.001 0.000 2.167 430 Q HA -0.055 4.280 4.340 -0.008 0.000 0.202 430 Q C 1.967 177.982 176.000 0.024 0.000 0.970 430 Q CA 0.922 56.732 55.803 0.012 0.000 0.855 430 Q CB 0.044 28.788 28.738 0.009 0.000 0.911 430 Q HN 0.326 8.596 8.270 -0.000 0.000 0.438 431 L N 0.956 122.192 121.223 0.022 0.000 2.549 431 L HA -0.110 4.225 4.340 -0.008 0.000 0.229 431 L C 1.199 178.087 176.870 0.031 0.000 1.158 431 L CA 0.047 54.902 54.840 0.026 0.000 0.842 431 L CB -0.196 41.876 42.059 0.022 0.000 0.952 431 L HN 0.215 8.445 8.230 -0.000 0.000 0.452 432 N N 0.658 119.377 118.700 0.033 0.000 2.520 432 N HA -0.098 4.637 4.740 -0.008 0.000 0.185 432 N C 1.500 177.039 175.510 0.049 0.000 1.068 432 N CA 0.907 53.982 53.050 0.041 0.000 0.911 432 N CB -0.035 38.475 38.487 0.039 0.000 0.961 432 N HN 0.556 8.936 8.380 -0.000 0.000 0.446 433 I N -3.564 117.037 120.570 0.052 0.000 3.904 433 I HA 0.242 4.407 4.170 -0.008 0.000 0.333 433 I C -0.435 175.699 176.117 0.029 0.000 1.361 433 I CA 0.001 61.333 61.300 0.052 0.000 1.116 433 I CB 0.093 38.142 38.000 0.081 0.000 1.028 433 I HN -0.296 7.914 8.210 -0.000 0.000 0.398 434 T N 2.904 117.474 114.554 0.027 0.000 2.772 434 T HA 0.345 4.690 4.350 -0.008 0.000 0.288 434 T C -0.198 174.513 174.700 0.018 0.000 0.994 434 T CA -0.476 61.635 62.100 0.018 0.000 0.951 434 T CB 1.277 70.158 68.868 0.022 0.000 0.933 434 T HN 0.399 8.639 8.240 -0.000 0.000 0.447 435 Q N 1.861 121.663 119.800 0.003 0.000 2.386 435 Q HA 0.427 4.762 4.340 -0.008 0.000 0.282 435 Q C 1.184 177.199 176.000 0.025 0.000 1.050 435 Q CA 0.632 56.437 55.803 0.002 0.000 0.918 435 Q CB -0.225 28.491 28.738 -0.037 0.000 1.266 435 Q HN 0.856 9.126 8.270 -0.000 0.000 0.423 436 G N 0.362 109.198 108.800 0.061 0.000 2.162 436 G HA2 -0.205 3.751 3.960 -0.008 0.000 0.260 436 G HA3 -0.205 3.751 3.960 -0.008 0.000 0.260 436 G C -0.278 174.653 174.900 0.052 0.000 0.976 436 G CA 0.014 45.174 45.100 0.101 0.000 0.655 436 G HN 0.739 9.029 8.290 -0.000 0.000 0.533 437 V N 0.313 120.258 119.914 0.051 0.000 2.495 437 V HA 0.643 4.758 4.120 -0.008 0.000 0.298 437 V C -0.007 176.122 176.094 0.058 0.000 1.031 437 V CA -0.753 61.569 62.300 0.036 0.000 0.871 437 V CB 1.850 33.689 31.823 0.026 0.000 0.988 437 V HN 0.352 8.542 8.190 -0.000 0.000 0.432 438 E N 1.944 122.178 120.200 0.057 0.000 2.199 438 E HA 0.584 4.929 4.350 -0.008 0.000 0.269 438 E C -1.029 175.497 176.600 -0.122 0.000 0.899 438 E CA -0.467 55.954 56.400 0.035 0.000 0.772 438 E CB 2.113 31.939 29.700 0.209 0.000 1.155 438 E HN 0.651 9.011 8.360 -0.000 0.000 0.408 439 S N 1.390 117.006 115.700 -0.139 0.000 2.489 439 S HA 0.432 4.897 4.470 -0.008 0.000 0.291 439 S C -0.511 173.941 174.600 -0.246 0.000 1.151 439 S CA -0.753 57.359 58.200 -0.147 0.000 1.082 439 S CB 1.370 64.545 63.200 -0.040 0.000 1.019 439 S HN 0.222 8.532 8.310 -0.000 0.000 0.492 440 V N 3.893 123.678 119.914 -0.216 0.000 2.409 440 V HA 0.398 4.513 4.120 -0.008 0.000 0.291 440 V C -0.633 175.496 176.094 0.058 0.000 1.020 440 V CA -0.773 61.433 62.300 -0.156 0.000 0.848 440 V CB 1.023 32.718 31.823 -0.215 0.000 0.990 440 V HN 0.834 9.024 8.190 -0.000 0.000 0.430 441 F N 6.245 126.177 119.950 -0.030 0.000 2.438 441 F HA 0.542 5.064 4.527 -0.009 0.000 0.356 441 F C -0.674 175.171 175.800 0.075 0.000 1.099 441 F CA -1.164 56.846 58.000 0.017 0.000 1.185 441 F CB 0.709 39.702 39.000 -0.012 0.000 1.115 441 F HN 0.433 8.733 8.300 -0.000 0.000 0.526 442 F N 6.861 126.395 119.950 -0.694 0.000 2.375 442 F HA 0.265 4.787 4.527 -0.008 0.000 0.361 442 F C -0.200 174.991 175.800 -1.015 0.000 1.117 442 F CA -0.838 56.767 58.000 -0.659 0.000 1.037 442 F CB 0.313 39.128 39.000 -0.308 0.000 1.192 442 F HN 0.403 8.703 8.300 -0.000 0.000 0.452 443 D N 5.324 124.895 120.400 -1.382 0.000 2.416 443 D HA 0.192 4.827 4.640 -0.008 0.000 0.240 443 D C 1.005 176.922 176.300 -0.638 0.000 1.250 443 D CA 0.381 53.813 54.000 -0.947 0.000 0.967 443 D CB 1.343 41.828 40.800 -0.525 0.000 1.059 443 D HN 0.730 9.100 8.370 -0.000 0.000 0.512 444 A N 3.899 126.519 122.820 -0.332 0.000 1.969 444 A HA -0.170 4.145 4.320 -0.008 0.000 0.218 444 A C 1.738 179.176 177.584 -0.243 0.000 1.169 444 A CA 1.029 52.954 52.037 -0.186 0.000 0.635 444 A CB 0.039 18.994 19.000 -0.074 0.000 0.810 444 A HN 0.447 8.597 8.150 -0.000 0.000 0.445 445 D N -0.617 119.674 120.400 -0.182 0.000 2.144 445 D HA -0.111 4.524 4.640 -0.008 0.000 0.200 445 D C 1.837 178.048 176.300 -0.148 0.000 0.978 445 D CA 1.503 55.419 54.000 -0.140 0.000 0.833 445 D CB -0.101 40.659 40.800 -0.066 0.000 0.961 445 D HN 0.603 8.973 8.370 -0.000 0.000 0.470 446 K N -0.274 120.013 120.400 -0.189 0.000 2.356 446 K HA 0.152 4.467 4.320 -0.008 0.000 0.195 446 K C 1.527 177.980 176.600 -0.245 0.000 1.037 446 K CA 0.177 56.352 56.287 -0.186 0.000 1.014 446 K CB 0.470 32.868 32.500 -0.170 0.000 0.815 446 K HN 0.050 8.300 8.250 -0.000 0.000 0.507 447 L N -0.656 120.359 121.223 -0.345 0.000 2.878 447 L HA 0.361 4.697 4.340 -0.008 0.000 0.253 447 L C 0.425 177.162 176.870 -0.220 0.000 1.135 447 L CA -0.046 54.564 54.840 -0.383 0.000 0.943 447 L CB 1.402 43.007 42.059 -0.756 0.000 1.307 447 L HN 0.305 8.535 8.230 -0.000 0.000 0.545 448 G N -0.834 107.869 108.800 -0.161 0.000 2.525 448 G HA2 -0.175 3.780 3.960 -0.008 0.000 0.685 448 G HA3 -0.175 3.780 3.960 -0.008 0.000 0.685 448 G C -0.158 174.741 174.900 -0.001 0.000 1.290 448 G CA -0.543 44.517 45.100 -0.066 0.000 0.915 448 G HN 0.062 8.352 8.290 -0.000 0.000 0.548 449 H N 0.293 119.416 119.070 0.087 0.000 2.529 449 H HA 0.040 4.591 4.556 -0.008 0.000 0.277 449 H C 1.417 176.786 175.328 0.067 0.000 0.999 449 H CA 1.425 57.521 56.048 0.080 0.000 1.256 449 H CB 0.198 29.984 29.762 0.039 0.000 1.402 449 H HN 0.718 8.998 8.280 -0.000 0.000 0.566 450 D N 1.846 122.361 120.400 0.191 0.000 2.803 450 D HA -0.150 4.485 4.640 -0.008 0.000 0.233 450 D C 1.392 177.705 176.300 0.021 0.000 1.182 450 D CA 0.634 54.695 54.000 0.103 0.000 0.726 450 D CB -0.407 40.342 40.800 -0.085 0.000 0.987 450 D HN 0.573 8.943 8.370 -0.000 0.000 0.412 451 E N -0.289 119.941 120.200 0.050 0.000 2.204 451 E HA -0.094 4.251 4.350 -0.008 0.000 0.194 451 E C 2.069 178.647 176.600 -0.038 0.000 0.989 451 E CA 1.288 57.690 56.400 0.004 0.000 0.824 451 E CB -0.520 29.184 29.700 0.007 0.000 0.756 451 E HN 0.495 8.855 8.360 -0.000 0.000 0.477 452 G N 0.859 109.632 108.800 -0.045 0.000 2.813 452 G HA2 -0.074 3.881 3.960 -0.008 0.000 0.209 452 G HA3 -0.074 3.881 3.960 -0.008 0.000 0.209 452 G C 0.640 175.444 174.900 -0.160 0.000 1.150 452 G CA 0.237 45.287 45.100 -0.084 0.000 0.785 452 G HN 0.156 8.446 8.290 -0.000 0.000 0.535 453 K N -1.021 119.265 120.400 -0.190 0.000 3.584 453 K HA -0.222 4.093 4.320 -0.008 0.000 0.300 453 K C 1.597 178.025 176.600 -0.288 0.000 1.285 453 K CA 1.634 57.741 56.287 -0.301 0.000 1.008 453 K CB -1.212 30.986 32.500 -0.503 0.000 1.271 453 K HN 0.535 8.785 8.250 -0.000 0.000 0.447 454 E N -0.792 119.259 120.200 -0.248 0.000 2.077 454 E HA -0.148 4.197 4.350 -0.008 0.000 0.193 454 E C 1.561 178.007 176.600 -0.257 0.000 0.989 454 E CA 1.804 58.049 56.400 -0.259 0.000 0.800 454 E CB -0.309 29.216 29.700 -0.292 0.000 0.746 454 E HN 0.627 8.987 8.360 -0.000 0.000 0.452 455 H N 0.284 119.270 119.070 -0.140 0.000 2.326 455 H HA 0.097 4.648 4.556 -0.008 0.000 0.301 455 H C 2.089 177.288 175.328 -0.215 0.000 1.081 455 H CA 1.468 57.462 56.048 -0.090 0.000 1.334 455 H CB 0.073 29.865 29.762 0.050 0.000 1.385 455 H HN -0.018 8.262 8.280 -0.000 0.000 0.504 456 R N 0.091 120.341 120.500 -0.417 0.000 2.081 456 R HA -0.102 4.233 4.340 -0.008 0.000 0.235 456 R C 2.331 178.511 176.300 -0.199 0.000 1.131 456 R CA 1.233 57.043 56.100 -0.483 0.000 0.960 456 R CB -0.334 29.585 30.300 -0.633 0.000 0.856 456 R HN 0.135 8.405 8.270 -0.000 0.000 0.436 457 V N 1.099 120.904 119.914 -0.182 0.000 2.255 457 V HA -0.293 3.822 4.120 -0.008 0.000 0.247 457 V C 2.457 178.528 176.094 -0.039 0.000 1.051 457 V CA 2.112 64.350 62.300 -0.102 0.000 1.018 457 V CB -0.781 30.970 31.823 -0.119 0.000 0.641 457 V HN 0.439 8.629 8.190 -0.000 0.000 0.445 458 A N -0.165 122.635 122.820 -0.034 0.000 1.933 458 A HA -0.128 4.187 4.320 -0.008 0.000 0.218 458 A C 2.424 180.044 177.584 0.060 0.000 1.175 458 A CA 2.136 54.182 52.037 0.015 0.000 0.628 458 A CB -0.804 18.207 19.000 0.019 0.000 0.814 458 A HN 0.601 8.751 8.150 -0.000 0.000 0.444 459 A N -0.461 122.407 122.820 0.079 0.000 1.908 459 A HA 0.094 4.409 4.320 -0.008 0.000 0.218 459 A C 2.403 180.060 177.584 0.122 0.000 1.181 459 A CA 2.005 54.116 52.037 0.123 0.000 0.627 459 A CB -1.368 17.738 19.000 0.177 0.000 0.818 459 A HN 0.717 8.867 8.150 -0.000 0.000 0.445 460 G N -0.572 108.273 108.800 0.076 0.000 2.421 460 G HA2 -0.105 3.850 3.960 -0.008 0.000 0.216 460 G HA3 -0.105 3.850 3.960 -0.008 0.000 0.216 460 G C 1.520 176.512 174.900 0.152 0.000 1.171 460 G CA 1.252 46.411 45.100 0.097 0.000 0.775 460 G HN 0.320 8.610 8.290 -0.000 0.000 0.543 461 V N 0.926 120.900 119.914 0.099 0.000 2.295 461 V HA -0.166 3.949 4.120 -0.008 0.000 0.246 461 V C 2.677 178.827 176.094 0.092 0.000 1.049 461 V CA 2.324 64.677 62.300 0.089 0.000 1.024 461 V CB -0.387 31.468 31.823 0.052 0.000 0.648 461 V HN 0.455 8.645 8.190 -0.000 0.000 0.447 462 E N 0.326 120.583 120.200 0.095 0.000 2.058 462 E HA -0.266 4.079 4.350 -0.008 0.000 0.194 462 E C 1.930 178.580 176.600 0.085 0.000 0.997 462 E CA 1.808 58.255 56.400 0.077 0.000 0.801 462 E CB -0.556 29.195 29.700 0.085 0.000 0.746 462 E HN 0.526 8.886 8.360 -0.000 0.000 0.450 463 F N 0.667 120.621 119.950 0.006 0.000 2.095 463 F HA -0.202 4.320 4.527 -0.008 0.000 0.298 463 F C 2.087 177.855 175.800 -0.054 0.000 1.104 463 F CA 2.062 60.057 58.000 -0.009 0.000 1.232 463 F CB -0.721 38.296 39.000 0.028 0.000 0.987 463 F HN 0.120 8.420 8.300 -0.000 0.000 0.475 464 A N 0.272 123.151 122.820 0.099 0.000 1.933 464 A HA -0.211 4.104 4.320 -0.008 0.000 0.218 464 A C 2.261 179.746 177.584 -0.165 0.000 1.175 464 A CA 1.874 53.923 52.037 0.020 0.000 0.628 464 A CB -0.692 18.434 19.000 0.210 0.000 0.814 464 A HN 0.487 8.637 8.150 -0.000 0.000 0.444 465 K N 0.238 120.580 120.400 -0.097 0.000 2.057 465 K HA -0.119 4.196 4.320 -0.008 0.000 0.206 465 K C 2.389 178.877 176.600 -0.187 0.000 1.050 465 K CA 1.608 57.831 56.287 -0.106 0.000 0.935 465 K CB -0.229 32.242 32.500 -0.047 0.000 0.715 465 K HN 0.680 8.930 8.250 -0.000 0.000 0.439 466 S N 0.999 116.553 115.700 -0.243 0.000 2.423 466 S HA -0.027 4.438 4.470 -0.008 0.000 0.231 466 S C 1.628 175.992 174.600 -0.393 0.000 1.014 466 S CA 0.767 58.806 58.200 -0.267 0.000 0.965 466 S CB 0.027 63.090 63.200 -0.229 0.000 0.785 466 S HN 0.093 8.403 8.310 -0.000 0.000 0.495 467 K N 0.954 120.964 120.400 -0.650 0.000 2.444 467 K HA 0.210 4.525 4.320 -0.008 0.000 0.193 467 K C 1.380 177.593 176.600 -0.644 0.000 1.024 467 K CA 0.632 56.419 56.287 -0.834 0.000 1.077 467 K CB -0.418 31.140 32.500 -1.570 0.000 0.833 467 K HN 0.615 8.865 8.250 -0.000 0.000 0.517 468 G N 1.421 109.980 108.800 -0.400 0.000 2.143 468 G HA2 -0.296 3.659 3.960 -0.008 0.000 0.248 468 G HA3 -0.296 3.659 3.960 -0.008 0.000 0.248 468 G C 0.560 175.447 174.900 -0.022 0.000 0.991 468 G CA 0.405 45.405 45.100 -0.167 0.000 0.689 468 G HN 0.198 8.488 8.290 -0.000 0.000 0.522 469 Y N -0.275 119.984 120.300 -0.068 0.000 2.184 469 Y HA 0.257 4.802 4.550 -0.008 0.000 0.290 469 Y C 1.975 177.850 175.900 -0.042 0.000 1.129 469 Y CA 0.787 58.852 58.100 -0.057 0.000 1.144 469 Y CB -0.674 37.733 38.460 -0.089 0.000 0.995 469 Y HN 0.736 9.016 8.280 -0.000 0.000 0.513 470 V N -0.433 119.548 119.914 0.111 0.000 2.769 470 V HA 0.648 4.763 4.120 -0.008 0.000 0.312 470 V C -0.667 175.434 176.094 0.011 0.000 1.061 470 V CA -1.084 61.247 62.300 0.052 0.000 0.931 470 V CB 1.788 33.643 31.823 0.053 0.000 1.010 470 V HN 0.300 8.490 8.190 -0.000 0.000 0.433 471 Q N 1.042 120.842 119.800 -0.001 0.000 2.668 471 Q HA 0.541 4.876 4.340 -0.008 0.000 0.298 471 Q C -0.649 175.336 176.000 -0.025 0.000 1.071 471 Q CA -0.867 54.927 55.803 -0.016 0.000 0.789 471 Q CB 1.448 30.176 28.738 -0.017 0.000 1.497 471 Q HN 0.634 8.904 8.270 -0.000 0.000 0.460 472 T N 0.880 115.417 114.554 -0.028 0.000 2.800 472 T HA 0.260 4.605 4.350 -0.008 0.000 0.283 472 T C 1.023 175.687 174.700 -0.059 0.000 0.999 472 T CA 1.591 63.669 62.100 -0.037 0.000 1.176 472 T CB -0.384 68.465 68.868 -0.030 0.000 0.973 472 T HN 1.002 9.242 8.240 -0.000 0.000 0.519 473 G N 3.254 112.004 108.800 -0.084 0.000 2.175 473 G HA2 -0.196 3.759 3.960 -0.008 0.000 0.244 473 G HA3 -0.196 3.759 3.960 -0.008 0.000 0.244 473 G C -0.114 174.652 174.900 -0.223 0.000 0.982 473 G CA -0.225 44.789 45.100 -0.145 0.000 0.641 473 G HN 0.674 8.964 8.290 -0.000 0.000 0.527 474 D N -0.446 119.863 120.400 -0.152 0.000 2.329 474 D HA 0.543 5.178 4.640 -0.008 0.000 0.246 474 D C 0.187 176.399 176.300 -0.147 0.000 1.111 474 D CA -0.010 53.904 54.000 -0.143 0.000 0.941 474 D CB 0.425 41.202 40.800 -0.039 0.000 1.169 474 D HN 0.085 8.455 8.370 -0.000 0.000 0.441 475 Y N -0.016 120.280 120.300 -0.007 0.000 2.310 475 Y HA 0.316 4.861 4.550 -0.008 0.000 0.326 475 Y C 0.349 176.239 175.900 -0.016 0.000 1.151 475 Y CA -0.972 57.121 58.100 -0.011 0.000 1.195 475 Y CB 1.366 39.816 38.460 -0.016 0.000 1.210 475 Y HN 0.208 8.488 8.280 -0.000 0.000 0.483 476 C N 3.994 123.408 119.300 0.189 0.000 2.431 476 C HA 0.746 5.201 4.460 -0.008 0.000 0.321 476 C C -1.019 174.000 174.990 0.048 0.000 1.202 476 C CA -0.714 58.356 59.018 0.087 0.000 1.398 476 C CB -0.310 27.474 27.740 0.073 0.000 2.047 476 C HN 0.586 8.816 8.230 -0.000 0.000 0.465 477 V N 7.189 127.107 119.914 0.006 0.000 2.385 477 V HA 0.390 4.505 4.120 -0.008 0.000 0.269 477 V C 0.138 176.231 176.094 -0.001 0.000 1.043 477 V CA -0.137 62.152 62.300 -0.019 0.000 0.906 477 V CB 1.190 32.980 31.823 -0.054 0.000 0.995 477 V HN 0.725 8.915 8.190 -0.000 0.000 0.467 478 V N 6.685 126.607 119.914 0.013 0.000 2.483 478 V HA 0.562 4.677 4.120 -0.008 0.000 0.295 478 V C -0.114 176.006 176.094 0.043 0.000 1.035 478 V CA -0.571 61.757 62.300 0.046 0.000 0.896 478 V CB 1.939 33.808 31.823 0.076 0.000 0.986 478 V HN 0.734 8.924 8.190 -0.000 0.000 0.447 479 I N 5.608 126.213 120.570 0.059 0.000 2.619 479 I HA 0.779 4.944 4.170 -0.008 0.000 0.292 479 I C -1.059 175.102 176.117 0.073 0.000 1.100 479 I CA -0.178 61.124 61.300 0.003 0.000 1.043 479 I CB 2.132 40.124 38.000 -0.012 0.000 1.239 479 I HN 1.107 9.317 8.210 -0.000 0.000 0.420 480 H N 4.714 123.766 119.070 -0.030 0.000 2.902 480 H HA 0.808 5.359 4.556 -0.008 0.000 0.297 480 H C -1.051 174.238 175.328 -0.066 0.000 1.406 480 H CA -0.451 55.571 56.048 -0.043 0.000 1.134 480 H CB 0.863 30.591 29.762 -0.057 0.000 1.833 480 H HN 0.666 8.946 8.280 -0.000 0.000 0.527 489 A N 1.191 124.111 122.820 0.168 0.000 2.260 489 A HA 0.524 4.839 4.320 -0.008 0.000 0.312 489 A C -0.208 177.396 177.584 0.034 0.000 1.321 489 A CA -0.052 52.002 52.037 0.029 0.000 0.928 489 A CB -0.988 18.054 19.000 0.069 0.000 1.158 489 A HN 0.952 9.102 8.150 -0.000 0.000 0.542 490 N N 1.354 119.956 118.700 -0.163 0.000 2.143 490 N HA 0.135 4.870 4.740 -0.008 0.000 0.222 490 N C -0.025 175.396 175.510 -0.148 0.000 1.264 490 N CA -0.272 52.714 53.050 -0.107 0.000 0.897 490 N CB 0.327 38.690 38.487 -0.208 0.000 1.092 490 N HN 0.603 8.983 8.380 -0.000 0.000 0.516 491 Q N 0.815 120.459 119.800 -0.259 0.000 2.337 491 Q HA 0.469 4.804 4.340 -0.008 0.000 0.266 491 Q C -1.456 174.336 176.000 -0.346 0.000 1.023 491 Q CA -0.533 55.060 55.803 -0.350 0.000 0.829 491 Q CB 1.984 30.367 28.738 -0.591 0.000 1.306 491 Q HN 0.162 8.432 8.270 -0.000 0.000 0.449 492 T N 3.417 117.845 114.554 -0.212 0.000 2.912 492 T HA 0.637 4.982 4.350 -0.008 0.000 0.299 492 T C -1.112 173.540 174.700 -0.079 0.000 1.052 492 T CA -0.832 61.191 62.100 -0.129 0.000 0.996 492 T CB 1.195 70.012 68.868 -0.085 0.000 1.070 492 T HN 0.559 8.799 8.240 -0.000 0.000 0.465 493 R N 1.630 122.108 120.500 -0.037 0.000 2.686 493 R HA 0.613 4.949 4.340 -0.008 0.000 0.283 493 R C -0.994 175.291 176.300 -0.026 0.000 0.978 493 R CA -0.857 55.234 56.100 -0.015 0.000 0.897 493 R CB 2.134 32.452 30.300 0.031 0.000 1.192 493 R HN 0.528 8.798 8.270 -0.000 0.000 0.457 494 I N 4.032 124.572 120.570 -0.051 0.000 2.307 494 I HA 0.273 4.438 4.170 -0.008 0.000 0.289 494 I C -0.428 175.681 176.117 -0.012 0.000 1.021 494 I CA -0.609 60.640 61.300 -0.084 0.000 1.224 494 I CB 1.222 39.093 38.000 -0.216 0.000 1.376 494 I HN 0.357 8.567 8.210 -0.000 0.000 0.470 495 L N 7.145 128.406 121.223 0.064 0.000 2.317 495 L HA 0.512 4.847 4.340 -0.008 0.000 0.281 495 L C -0.895 176.110 176.870 0.226 0.000 1.024 495 L CA -0.848 54.059 54.840 0.111 0.000 0.810 495 L CB 1.786 43.888 42.059 0.071 0.000 1.240 495 L HN 0.455 8.685 8.230 -0.000 0.000 0.427 496 L N 5.720 127.060 121.223 0.196 0.000 2.265 496 L HA 0.355 4.690 4.340 -0.008 0.000 0.288 496 L C -0.493 176.403 176.870 0.044 0.000 1.058 496 L CA 0.018 54.935 54.840 0.128 0.000 0.809 496 L CB 1.361 43.470 42.059 0.082 0.000 1.179 496 L HN 0.363 8.593 8.230 -0.000 0.000 0.429 497 V N 5.915 125.835 119.914 0.011 0.000 2.529 497 V HA 0.093 4.208 4.120 -0.008 0.000 0.292 497 V C 0.781 176.867 176.094 -0.013 0.000 1.028 497 V CA -0.261 62.041 62.300 0.004 0.000 1.074 497 V CB 0.247 32.071 31.823 0.002 0.000 0.958 497 V HN 0.788 8.978 8.190 -0.000 0.000 0.481 498 E N 0.000 120.198 120.200 -0.004 0.000 2.725 498 E HA 0.000 4.345 4.350 -0.008 0.000 0.291 498 E CA 0.000 56.395 56.400 -0.008 0.000 0.976 498 E CB 0.000 29.698 29.700 -0.003 0.000 0.812 498 E HN 0.000 8.360 8.360 -0.000 0.000 0.440