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 2aqx_1_A DATA FIRST_RESID 650 DATA SEQUENCE MVQWSPFVMS FKKKYPWIQL AGHAGSFKAA ANGRILKKHC ESEQRCLDRL DATA SEQUENCE MADVLRPFVP AYHGDVVKDG ERYNQMDDLL ADFDSPCVMD CKMGVRTYLE DATA SEQUENCE EELTKARKKP SLRKDMYQKM VEVDPEAPTE EEKAQRAVTK PRYMQWRETI DATA SEQUENCE SSTATLGFRI EGIKKEDGSV NRDFKKTKTR EQVTEAFREF TKGNQNILIA DATA SEQUENCE YRDRLKAIRA TLEISPFFKC HEVIGSSLLF IHDKKEQAKV WMIDFGKTTP DATA SEQUENCE LPEGQTLQHD VPWQEGNRED GYLSGLDNLI DILTEMSQG 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 650 M HA 0.000 4.480 4.480 -0.000 0.000 0.227 650 M C 0.000 175.950 176.300 -0.584 0.000 1.140 650 M CA 0.000 55.071 55.300 -0.381 0.000 0.988 650 M CB 0.000 32.527 32.600 -0.122 0.000 1.302 651 V N 0.021 119.741 119.914 -0.324 0.000 3.330 651 V HA -0.179 3.941 4.120 0.001 0.000 0.273 651 V C 1.724 177.686 176.094 -0.220 0.000 1.179 651 V CA 1.711 63.851 62.300 -0.267 0.000 1.174 651 V CB -0.978 30.756 31.823 -0.148 0.000 0.794 651 V HN 0.875 9.065 8.190 -0.000 0.000 0.527 652 Q N 0.170 119.847 119.800 -0.205 0.000 2.291 652 Q HA -0.105 4.235 4.340 0.001 0.000 0.205 652 Q C 1.806 177.847 176.000 0.068 0.000 0.970 652 Q CA 1.799 57.583 55.803 -0.031 0.000 0.876 652 Q CB 0.059 28.850 28.738 0.088 0.000 0.935 652 Q HN 0.979 9.249 8.270 -0.000 0.000 0.455 653 W N -4.277 116.996 121.300 -0.046 0.000 1.857 653 W HA 0.494 5.154 4.660 0.001 0.000 0.244 653 W C -0.125 176.334 176.519 -0.100 0.000 0.859 653 W CA -0.175 57.132 57.345 -0.062 0.000 1.112 653 W CB -0.103 29.325 29.460 -0.054 0.000 0.967 653 W HN -0.054 8.126 8.180 -0.000 0.000 0.524 654 S N 3.805 119.285 115.700 -0.367 0.000 2.667 654 S HA 0.381 4.852 4.470 0.001 0.000 0.304 654 S C -0.690 173.726 174.600 -0.306 0.000 1.135 654 S CA -0.996 56.994 58.200 -0.351 0.000 1.125 654 S CB 1.182 64.006 63.200 -0.627 0.000 0.996 654 S HN -0.093 8.217 8.310 -0.000 0.000 0.474 655 P HA 0.143 4.563 4.420 -0.000 0.000 0.219 655 P C -0.036 177.252 177.300 -0.020 0.000 1.150 655 P CA 0.813 63.825 63.100 -0.148 0.000 0.814 655 P CB -0.127 31.511 31.700 -0.103 0.000 0.787 656 F N -3.647 116.292 119.950 -0.019 0.000 2.745 656 F HA 0.593 5.121 4.527 0.001 0.000 0.316 656 F C -1.086 174.715 175.800 0.002 0.000 1.155 656 F CA -1.830 56.162 58.000 -0.013 0.000 0.937 656 F CB 0.510 39.511 39.000 0.003 0.000 1.361 656 F HN -0.457 7.843 8.300 -0.000 0.000 0.472 657 V N 3.111 123.187 119.914 0.271 0.000 2.567 657 V HA 0.430 4.550 4.120 0.001 0.000 0.289 657 V C 0.050 176.342 176.094 0.329 0.000 1.049 657 V CA -0.506 61.919 62.300 0.208 0.000 0.969 657 V CB 1.535 33.429 31.823 0.119 0.000 0.995 657 V HN 0.642 8.832 8.190 -0.000 0.000 0.471 658 M N 3.467 123.232 119.600 0.274 0.000 2.578 658 M HA 0.557 5.037 4.480 0.001 0.000 0.321 658 M C -0.142 176.298 176.300 0.233 0.000 1.182 658 M CA -0.150 55.314 55.300 0.273 0.000 0.965 658 M CB 1.951 34.715 32.600 0.274 0.000 1.694 658 M HN 0.813 9.103 8.290 -0.000 0.000 0.461 659 S N 1.867 117.695 115.700 0.213 0.000 2.595 659 S HA 0.935 5.406 4.470 0.001 0.000 0.281 659 S C -1.125 173.639 174.600 0.273 0.000 1.117 659 S CA -0.654 57.653 58.200 0.179 0.000 0.873 659 S CB 2.177 65.409 63.200 0.053 0.000 1.108 659 S HN 0.555 8.865 8.310 -0.000 0.000 0.477 660 F N -1.033 118.942 119.950 0.042 0.000 2.631 660 F HA 0.694 5.221 4.527 0.001 0.000 0.308 660 F C -0.964 174.859 175.800 0.038 0.000 1.097 660 F CA -1.211 56.812 58.000 0.039 0.000 0.952 660 F CB 1.154 40.180 39.000 0.044 0.000 1.307 660 F HN 0.485 8.785 8.300 -0.000 0.000 0.450 661 K N 2.322 122.784 120.400 0.103 0.000 2.258 661 K HA 0.222 4.542 4.320 0.001 0.000 0.284 661 K C -0.684 175.984 176.600 0.113 0.000 1.051 661 K CA -0.598 55.700 56.287 0.019 0.000 0.923 661 K CB 1.808 34.332 32.500 0.041 0.000 1.046 661 K HN 0.771 9.021 8.250 -0.000 0.000 0.474 662 K N 3.203 123.625 120.400 0.036 0.000 2.258 662 K HA 0.116 4.436 4.320 0.001 0.000 0.284 662 K C -0.784 175.928 176.600 0.186 0.000 1.051 662 K CA -0.231 56.165 56.287 0.182 0.000 0.923 662 K CB 0.708 33.311 32.500 0.171 0.000 1.046 662 K HN 0.402 8.652 8.250 -0.000 0.000 0.474 663 K N 4.131 124.661 120.400 0.216 0.000 2.376 663 K HA 0.278 4.599 4.320 0.001 0.000 0.257 663 K C -1.809 174.928 176.600 0.228 0.000 0.939 663 K CA -0.769 55.596 56.287 0.129 0.000 0.809 663 K CB 0.986 33.530 32.500 0.074 0.000 1.121 663 K HN 0.561 8.811 8.250 -0.000 0.000 0.425 664 Y N 0.712 121.059 120.300 0.078 0.000 2.519 664 Y HA 0.487 5.038 4.550 0.001 0.000 0.336 664 Y C -2.692 173.268 175.900 0.100 0.000 1.089 664 Y CA -2.487 55.665 58.100 0.086 0.000 1.025 664 Y CB 0.215 38.732 38.460 0.095 0.000 1.318 664 Y HN 0.425 8.705 8.280 -0.000 0.000 0.452 665 P HA 0.001 4.421 4.420 -0.000 0.000 0.267 665 P C -0.811 176.653 177.300 0.273 0.000 1.209 665 P CA 0.217 63.407 63.100 0.149 0.000 0.763 665 P CB 0.669 32.441 31.700 0.119 0.000 0.816 666 W N 3.729 125.049 121.300 0.033 0.000 2.112 666 W HA 0.289 4.950 4.660 0.001 0.000 0.349 666 W C -0.264 176.275 176.519 0.033 0.000 1.289 666 W CA -0.073 57.311 57.345 0.066 0.000 1.256 666 W CB 0.326 29.780 29.460 -0.011 0.000 1.148 666 W HN 0.261 8.441 8.180 -0.000 0.000 0.590 667 I N 4.200 124.252 120.570 -0.862 0.000 2.418 667 I HA 0.149 4.320 4.170 0.001 0.000 0.287 667 I C -0.343 175.032 176.117 -1.236 0.000 1.008 667 I CA -0.839 60.016 61.300 -0.743 0.000 1.104 667 I CB 1.628 39.339 38.000 -0.481 0.000 1.264 667 I HN 0.283 8.493 8.210 -0.000 0.000 0.438 668 Q N 6.006 125.400 119.800 -0.677 0.000 2.394 668 Q HA 0.429 4.769 4.340 0.001 0.000 0.259 668 Q C -0.016 175.835 176.000 -0.248 0.000 1.021 668 Q CA -0.409 55.083 55.803 -0.518 0.000 0.805 668 Q CB 1.369 30.053 28.738 -0.089 0.000 1.226 668 Q HN 0.771 9.041 8.270 -0.000 0.000 0.476 669 L N 1.832 122.908 121.223 -0.246 0.000 2.013 669 L HA 0.161 4.501 4.340 0.001 0.000 0.204 669 L C 1.122 177.972 176.870 -0.034 0.000 1.081 669 L CA 0.905 55.675 54.840 -0.116 0.000 0.751 669 L CB -0.373 41.614 42.059 -0.121 0.000 0.901 669 L HN 0.595 8.825 8.230 -0.000 0.000 0.440 670 A N -0.936 121.872 122.820 -0.020 0.000 2.517 670 A HA 0.617 4.938 4.320 0.001 0.000 0.280 670 A C 0.382 178.014 177.584 0.081 0.000 1.353 670 A CA 0.224 52.281 52.037 0.033 0.000 0.907 670 A CB -0.101 18.912 19.000 0.023 0.000 1.495 670 A HN 0.438 8.588 8.150 -0.000 0.000 0.506 671 G N -2.179 106.660 108.800 0.065 0.000 2.781 671 G HA2 0.094 4.055 3.960 0.001 0.000 0.683 671 G HA3 0.094 4.055 3.960 0.001 0.000 0.683 671 G C -0.606 174.367 174.900 0.122 0.000 1.390 671 G CA -0.169 44.964 45.100 0.055 0.000 0.850 671 G HN 1.182 9.472 8.290 -0.000 0.000 0.557 672 H N -0.129 119.041 119.070 0.168 0.000 2.495 672 H HA 0.705 5.261 4.556 0.000 0.000 0.350 672 H C 1.166 176.595 175.328 0.168 0.000 1.202 672 H CA 0.033 56.162 56.048 0.136 0.000 1.322 672 H CB 0.966 30.786 29.762 0.096 0.000 1.544 672 H HN 1.166 9.446 8.280 -0.000 0.000 0.565 673 A N 0.163 123.147 122.820 0.273 0.000 2.540 673 A HA 0.399 4.719 4.320 0.001 0.000 0.239 673 A C 1.355 179.058 177.584 0.198 0.000 1.061 673 A CA 0.593 52.755 52.037 0.208 0.000 0.758 673 A CB -0.803 18.282 19.000 0.141 0.000 0.991 673 A HN 1.083 9.233 8.150 -0.000 0.000 0.502 674 G N 1.556 110.475 108.800 0.199 0.000 2.147 674 G HA2 -0.236 3.724 3.960 0.001 0.000 0.244 674 G HA3 -0.236 3.724 3.960 0.001 0.000 0.244 674 G C 0.849 175.850 174.900 0.168 0.000 1.005 674 G CA 0.685 45.889 45.100 0.173 0.000 0.713 674 G HN 1.074 9.364 8.290 -0.000 0.000 0.515 675 S N -1.177 114.638 115.700 0.192 0.000 2.501 675 S HA 0.470 4.940 4.470 0.001 0.000 0.220 675 S C 0.379 174.836 174.600 -0.238 0.000 0.997 675 S CA 0.449 58.652 58.200 0.005 0.000 0.919 675 S CB 0.150 63.373 63.200 0.039 0.000 0.778 675 S HN 0.434 8.744 8.310 -0.000 0.000 0.523 676 F N 0.653 120.680 119.950 0.129 0.000 2.588 676 F HA 0.656 5.183 4.527 0.001 0.000 0.310 676 F C -0.219 175.505 175.800 -0.127 0.000 1.082 676 F CA -1.066 56.921 58.000 -0.022 0.000 0.929 676 F CB 1.684 40.597 39.000 -0.145 0.000 1.254 676 F HN -0.374 7.926 8.300 -0.000 0.000 0.455 677 K N 0.841 121.181 120.400 -0.101 0.000 2.477 677 K HA 0.799 5.119 4.320 0.001 0.000 0.255 677 K C -0.994 175.425 176.600 -0.302 0.000 0.952 677 K CA -0.817 55.339 56.287 -0.219 0.000 0.826 677 K CB 2.091 34.374 32.500 -0.362 0.000 1.331 677 K HN 0.655 8.905 8.250 -0.000 0.000 0.437 678 A N 1.223 123.886 122.820 -0.263 0.000 2.540 678 A HA 0.521 4.842 4.320 0.001 0.000 0.239 678 A C -0.298 177.146 177.584 -0.234 0.000 1.061 678 A CA 0.694 52.574 52.037 -0.261 0.000 0.758 678 A CB -0.196 18.688 19.000 -0.192 0.000 0.991 678 A HN 0.669 8.819 8.150 -0.000 0.000 0.502 679 A N 1.308 124.000 122.820 -0.214 0.000 2.486 679 A HA 0.886 5.206 4.320 0.001 0.000 0.289 679 A C 0.293 177.794 177.584 -0.139 0.000 1.176 679 A CA -0.157 51.779 52.037 -0.169 0.000 0.757 679 A CB 0.715 19.619 19.000 -0.160 0.000 1.337 679 A HN 2.241 10.391 8.150 -0.000 0.000 0.423 680 A N -0.137 122.610 122.820 -0.121 0.000 2.287 680 A HA 0.567 4.887 4.320 0.001 0.000 0.273 680 A C 0.491 178.015 177.584 -0.100 0.000 1.091 680 A CA 0.095 52.070 52.037 -0.103 0.000 0.817 680 A CB -0.201 18.744 19.000 -0.092 0.000 1.069 680 A HN 1.361 9.511 8.150 -0.000 0.000 0.492 681 N N -0.772 117.879 118.700 -0.081 0.000 2.815 681 N HA -0.183 4.557 4.740 0.001 0.000 0.249 681 N C 0.755 176.235 175.510 -0.051 0.000 1.114 681 N CA 1.985 54.991 53.050 -0.074 0.000 0.717 681 N CB -1.506 36.921 38.487 -0.100 0.000 1.074 681 N HN 2.153 10.533 8.380 -0.000 0.000 0.555 682 G N -0.662 108.127 108.800 -0.017 0.000 2.153 682 G HA2 -0.370 3.590 3.960 0.001 0.000 0.252 682 G HA3 -0.370 3.590 3.960 0.001 0.000 0.252 682 G C 0.223 175.131 174.900 0.014 0.000 0.994 682 G CA 0.983 46.105 45.100 0.038 0.000 0.698 682 G HN 0.594 8.884 8.290 -0.000 0.000 0.521 683 R N -1.305 119.168 120.500 -0.046 0.000 2.758 683 R HA 0.890 5.230 4.340 0.001 0.000 0.265 683 R C -0.323 175.918 176.300 -0.098 0.000 1.016 683 R CA -0.824 55.245 56.100 -0.053 0.000 1.040 683 R CB 1.390 31.626 30.300 -0.108 0.000 1.152 683 R HN 0.202 8.472 8.270 -0.000 0.000 0.503 684 I N 0.657 121.178 120.570 -0.082 0.000 2.802 684 I HA 0.346 4.516 4.170 0.001 0.000 0.298 684 I C -1.530 174.546 176.117 -0.068 0.000 1.176 684 I CA -0.470 60.732 61.300 -0.163 0.000 1.025 684 I CB 2.030 39.882 38.000 -0.247 0.000 1.243 684 I HN 0.336 8.546 8.210 -0.000 0.000 0.424 685 L N 5.509 126.652 121.223 -0.134 0.000 2.317 685 L HA 0.596 4.936 4.340 0.001 0.000 0.281 685 L C -0.531 176.335 176.870 -0.008 0.000 1.024 685 L CA -0.682 54.098 54.840 -0.099 0.000 0.810 685 L CB 1.510 43.306 42.059 -0.437 0.000 1.240 685 L HN 0.445 8.675 8.230 -0.000 0.000 0.427 686 K N 2.530 122.976 120.400 0.077 0.000 2.316 686 K HA 0.390 4.711 4.320 0.001 0.000 0.251 686 K C -0.763 175.861 176.600 0.040 0.000 0.934 686 K CA -0.879 55.262 56.287 -0.242 0.000 0.802 686 K CB 1.904 34.202 32.500 -0.337 0.000 1.171 686 K HN 0.390 8.640 8.250 -0.000 0.000 0.426 687 K N 2.456 122.790 120.400 -0.109 0.000 2.448 687 K HA -0.061 4.259 4.320 0.001 0.000 0.278 687 K C -0.146 176.382 176.600 -0.121 0.000 1.009 687 K CA -0.022 56.167 56.287 -0.164 0.000 0.995 687 K CB 0.282 32.673 32.500 -0.182 0.000 0.917 687 K HN 0.523 8.773 8.250 -0.000 0.000 0.481 688 H N 2.859 121.805 119.070 -0.208 0.000 2.848 688 H HA 0.053 4.609 4.556 0.001 0.000 0.341 688 H C -1.033 174.255 175.328 -0.068 0.000 1.060 688 H CA 0.239 56.230 56.048 -0.094 0.000 1.444 688 H CB 0.794 30.505 29.762 -0.085 0.000 1.446 688 H HN 0.578 8.857 8.280 -0.000 0.000 0.583 689 C N 5.039 123.894 119.300 -0.743 0.000 2.609 689 C HA 0.129 4.590 4.460 0.001 0.000 0.313 689 C C 1.421 176.016 174.990 -0.658 0.000 1.175 689 C CA -0.626 58.104 59.018 -0.480 0.000 1.434 689 C CB 1.100 28.699 27.740 -0.235 0.000 2.005 689 C HN 1.051 9.281 8.230 -0.000 0.000 0.471 690 E N 1.783 121.817 120.200 -0.277 0.000 2.072 690 E HA -0.101 4.249 4.350 0.001 0.000 0.190 690 E C 1.975 178.545 176.600 -0.050 0.000 0.982 690 E CA 2.239 58.589 56.400 -0.083 0.000 0.803 690 E CB 0.250 29.988 29.700 0.062 0.000 0.755 690 E HN 0.845 9.205 8.360 -0.000 0.000 0.453 691 S N -0.339 115.343 115.700 -0.031 0.000 2.428 691 S HA -0.114 4.357 4.470 0.001 0.000 0.230 691 S C 2.032 176.645 174.600 0.022 0.000 1.014 691 S CA 0.923 59.135 58.200 0.020 0.000 0.957 691 S CB -0.201 63.028 63.200 0.048 0.000 0.784 691 S HN 0.357 8.667 8.310 -0.000 0.000 0.499 692 E N 1.592 121.774 120.200 -0.030 0.000 2.047 692 E HA -0.217 4.133 4.350 0.001 0.000 0.191 692 E C 2.337 178.865 176.600 -0.120 0.000 0.987 692 E CA 1.218 57.611 56.400 -0.012 0.000 0.799 692 E CB -0.306 29.375 29.700 -0.033 0.000 0.752 692 E HN 0.712 9.072 8.360 -0.000 0.000 0.449 693 Q N 0.319 120.015 119.800 -0.173 0.000 2.050 693 Q HA -0.236 4.104 4.340 0.001 0.000 0.202 693 Q C 2.241 178.157 176.000 -0.140 0.000 0.980 693 Q CA 1.570 57.263 55.803 -0.182 0.000 0.840 693 Q CB -0.016 28.766 28.738 0.072 0.000 0.898 693 Q HN 0.180 8.450 8.270 -0.000 0.000 0.424 694 R N -0.623 119.859 120.500 -0.031 0.000 2.105 694 R HA -0.141 4.199 4.340 0.001 0.000 0.239 694 R C 2.519 178.830 176.300 0.019 0.000 1.135 694 R CA 1.610 57.724 56.100 0.024 0.000 0.967 694 R CB -0.383 29.957 30.300 0.066 0.000 0.861 694 R HN 0.362 8.632 8.270 -0.000 0.000 0.442 695 C N 0.282 119.576 119.300 -0.010 0.000 2.462 695 C HA -0.050 4.410 4.460 0.001 0.000 0.278 695 C C 2.519 177.305 174.990 -0.340 0.000 1.253 695 C CA 0.584 59.566 59.018 -0.060 0.000 1.713 695 C CB -0.836 26.872 27.740 -0.055 0.000 2.049 695 C HN 0.450 8.680 8.230 -0.000 0.000 0.477 696 L N 0.573 121.542 121.223 -0.424 0.000 2.017 696 L HA -0.177 4.163 4.340 0.001 0.000 0.208 696 L C 2.389 179.045 176.870 -0.358 0.000 1.073 696 L CA 1.554 56.064 54.840 -0.550 0.000 0.745 696 L CB -0.899 40.607 42.059 -0.923 0.000 0.894 696 L HN 0.367 8.597 8.230 -0.000 0.000 0.432 697 D N 0.011 120.270 120.400 -0.236 0.000 2.133 697 D HA -0.199 4.441 4.640 0.001 0.000 0.192 697 D C 2.356 178.629 176.300 -0.045 0.000 1.001 697 D CA 1.295 55.291 54.000 -0.006 0.000 0.844 697 D CB -0.178 40.652 40.800 0.051 0.000 0.944 697 D HN 0.274 8.644 8.370 -0.000 0.000 0.447 698 R N 0.127 120.584 120.500 -0.071 0.000 2.092 698 R HA -0.011 4.329 4.340 0.001 0.000 0.231 698 R C 2.656 178.835 176.300 -0.202 0.000 1.119 698 R CA 0.339 56.427 56.100 -0.021 0.000 0.970 698 R CB -0.609 29.803 30.300 0.187 0.000 0.864 698 R HN 0.272 8.542 8.270 -0.000 0.000 0.440 699 L N 0.283 121.212 121.223 -0.490 0.000 2.201 699 L HA -0.090 4.251 4.340 0.001 0.000 0.212 699 L C 2.253 178.949 176.870 -0.289 0.000 1.105 699 L CA 0.683 55.160 54.840 -0.604 0.000 0.775 699 L CB -0.223 41.330 42.059 -0.844 0.000 0.913 699 L HN 0.074 8.304 8.230 -0.000 0.000 0.440 700 M N -0.819 118.676 119.600 -0.174 0.000 2.549 700 M HA -0.019 4.461 4.480 0.001 0.000 0.260 700 M C 1.437 177.701 176.300 -0.060 0.000 1.076 700 M CA 0.712 55.966 55.300 -0.077 0.000 1.090 700 M CB -1.017 31.587 32.600 0.007 0.000 1.418 700 M HN 0.206 8.496 8.290 -0.000 0.000 0.486 701 A N -0.574 122.206 122.820 -0.067 0.000 2.749 701 A HA 0.386 4.706 4.320 0.001 0.000 0.299 701 A C -0.365 177.202 177.584 -0.027 0.000 1.105 701 A CA -0.429 51.590 52.037 -0.029 0.000 0.987 701 A CB -0.065 18.935 19.000 0.000 0.000 1.180 701 A HN 0.327 8.477 8.150 -0.000 0.000 0.528 702 D N -1.815 118.548 120.400 -0.062 0.000 2.570 702 D HA 0.399 5.039 4.640 0.001 0.000 0.244 702 D C 1.313 177.592 176.300 -0.036 0.000 1.178 702 D CA -0.043 53.935 54.000 -0.037 0.000 0.881 702 D CB 1.906 42.660 40.800 -0.076 0.000 1.453 702 D HN 0.094 8.464 8.370 -0.000 0.000 0.447 703 V N 0.554 120.471 119.914 0.005 0.000 2.546 703 V HA -0.164 3.956 4.120 0.001 0.000 0.254 703 V C 2.040 178.142 176.094 0.013 0.000 1.076 703 V CA 1.316 63.625 62.300 0.015 0.000 1.087 703 V CB -1.063 30.792 31.823 0.052 0.000 0.674 703 V HN 0.583 8.773 8.190 -0.000 0.000 0.470 704 L N -0.149 121.073 121.223 -0.001 0.000 2.465 704 L HA -0.036 4.304 4.340 0.001 0.000 0.224 704 L C 2.783 179.646 176.870 -0.011 0.000 1.145 704 L CA 1.218 56.078 54.840 0.033 0.000 0.834 704 L CB -0.556 41.463 42.059 -0.066 0.000 0.944 704 L HN 0.350 8.580 8.230 -0.000 0.000 0.451 705 R N 1.324 121.773 120.500 -0.085 0.000 2.133 705 R HA -0.203 4.138 4.340 0.001 0.000 0.245 705 R C -0.662 175.585 176.300 -0.090 0.000 1.137 705 R CA 2.220 58.263 56.100 -0.095 0.000 0.947 705 R CB -1.199 29.046 30.300 -0.091 0.000 0.865 705 R HN 0.237 8.507 8.270 -0.000 0.000 0.437 706 P HA -0.108 4.312 4.420 -0.000 0.000 0.239 706 P C 0.026 177.101 177.300 -0.375 0.000 1.184 706 P CA 1.197 64.093 63.100 -0.340 0.000 0.760 706 P CB -0.016 31.336 31.700 -0.580 0.000 0.884 707 F N -0.171 119.814 119.950 0.059 0.000 2.654 707 F HA 0.149 4.677 4.527 0.001 0.000 0.303 707 F C 1.110 177.074 175.800 0.273 0.000 1.099 707 F CA -0.628 57.407 58.000 0.058 0.000 1.270 707 F CB 0.781 39.742 39.000 -0.066 0.000 1.024 707 F HN -0.253 8.047 8.300 -0.000 0.000 0.548 708 V N -2.868 117.295 119.914 0.415 0.000 3.040 708 V HA 0.699 4.820 4.120 0.001 0.000 0.312 708 V C -2.899 173.345 176.094 0.250 0.000 1.115 708 V CA -3.086 59.430 62.300 0.360 0.000 0.998 708 V CB 1.868 33.812 31.823 0.202 0.000 1.042 708 V HN -0.225 7.965 8.190 -0.000 0.000 0.433 709 P HA 0.284 4.704 4.420 -0.000 0.000 0.264 709 P C -0.025 177.295 177.300 0.035 0.000 1.193 709 P CA 0.517 63.621 63.100 0.008 0.000 0.763 709 P CB 0.369 32.089 31.700 0.032 0.000 0.810 710 A N 4.008 126.821 122.820 -0.012 0.000 2.567 710 A HA 0.050 4.371 4.320 0.001 0.000 0.240 710 A C -0.452 176.965 177.584 -0.279 0.000 1.053 710 A CA 0.361 52.313 52.037 -0.141 0.000 0.755 710 A CB -0.760 18.150 19.000 -0.150 0.000 0.978 710 A HN 0.545 8.695 8.150 -0.000 0.000 0.507 711 Y N 2.059 122.117 120.300 -0.404 0.000 2.342 711 Y HA 0.496 5.047 4.550 0.001 0.000 0.334 711 Y C 0.389 176.021 175.900 -0.447 0.000 1.067 711 Y CA -0.517 57.389 58.100 -0.324 0.000 1.128 711 Y CB 1.217 39.596 38.460 -0.136 0.000 1.200 711 Y HN 0.786 9.066 8.280 -0.000 0.000 0.464 712 H N 3.607 122.346 119.070 -0.551 0.000 2.662 712 H HA 0.462 5.018 4.556 0.001 0.000 0.268 712 H C 0.759 175.691 175.328 -0.660 0.000 1.152 712 H CA 0.070 55.841 56.048 -0.462 0.000 1.072 712 H CB 0.412 30.048 29.762 -0.210 0.000 1.660 712 H HN 1.005 9.285 8.280 -0.000 0.000 0.584 713 G N 1.246 109.202 108.800 -1.406 0.000 2.698 713 G HA2 -0.192 3.768 3.960 0.001 0.000 0.225 713 G HA3 -0.192 3.768 3.960 0.001 0.000 0.225 713 G C -1.092 173.673 174.900 -0.224 0.000 1.345 713 G CA -0.341 44.297 45.100 -0.770 0.000 0.871 713 G HN 0.433 8.723 8.290 -0.000 0.000 0.540 714 D N -1.490 118.922 120.400 0.020 0.000 2.414 714 D HA 0.790 5.430 4.640 0.001 0.000 0.241 714 D C -0.489 175.845 176.300 0.058 0.000 1.008 714 D CA -0.616 53.458 54.000 0.123 0.000 1.001 714 D CB 1.903 42.795 40.800 0.154 0.000 1.277 714 D HN 1.367 9.737 8.370 -0.000 0.000 0.538 715 V N -0.107 119.861 119.914 0.090 0.000 3.023 715 V HA 0.290 4.411 4.120 0.001 0.000 0.294 715 V C -1.365 174.802 176.094 0.121 0.000 1.324 715 V CA -0.759 61.587 62.300 0.077 0.000 0.979 715 V CB 2.207 34.068 31.823 0.065 0.000 1.093 715 V HN 0.569 8.759 8.190 -0.000 0.000 0.434 716 V N 6.511 126.467 119.914 0.071 0.000 2.364 716 V HA 0.538 4.658 4.120 0.001 0.000 0.272 716 V C -0.013 176.147 176.094 0.110 0.000 1.036 716 V CA -0.549 61.795 62.300 0.075 0.000 0.880 716 V CB 1.159 32.990 31.823 0.013 0.000 0.991 716 V HN 0.797 8.987 8.190 -0.000 0.000 0.460 717 K N 2.946 123.469 120.400 0.204 0.000 2.324 717 K HA 0.412 4.732 4.320 0.001 0.000 0.253 717 K C -0.447 176.245 176.600 0.152 0.000 0.932 717 K CA -0.925 55.451 56.287 0.149 0.000 0.799 717 K CB 1.741 34.308 32.500 0.111 0.000 1.154 717 K HN 0.639 8.889 8.250 -0.000 0.000 0.425 718 D N 1.728 122.176 120.400 0.080 0.000 2.802 718 D HA -0.195 4.446 4.640 0.001 0.000 0.229 718 D C 0.760 177.097 176.300 0.062 0.000 1.203 718 D CA 1.861 55.899 54.000 0.064 0.000 0.712 718 D CB -1.009 39.830 40.800 0.065 0.000 0.973 718 D HN 0.971 9.341 8.370 -0.000 0.000 0.407 719 G N 0.239 109.061 108.800 0.037 0.000 2.155 719 G HA2 -0.294 3.666 3.960 0.001 0.000 0.257 719 G HA3 -0.294 3.666 3.960 0.001 0.000 0.257 719 G C 0.007 174.900 174.900 -0.012 0.000 0.983 719 G CA 0.703 45.811 45.100 0.013 0.000 0.676 719 G HN 0.590 8.880 8.290 -0.000 0.000 0.528 720 E N -0.914 119.278 120.200 -0.013 0.000 2.340 720 E HA 0.506 4.857 4.350 0.001 0.000 0.273 720 E C -0.393 176.069 176.600 -0.230 0.000 0.891 720 E CA -1.043 55.263 56.400 -0.156 0.000 0.757 720 E CB 2.026 31.579 29.700 -0.244 0.000 1.231 720 E HN 0.262 8.622 8.360 -0.000 0.000 0.439 721 R N 1.611 121.905 120.500 -0.344 0.000 2.407 721 R HA 0.456 4.797 4.340 0.001 0.000 0.303 721 R C -1.322 174.749 176.300 -0.383 0.000 0.981 721 R CA -0.257 55.694 56.100 -0.249 0.000 0.905 721 R CB 0.690 30.864 30.300 -0.210 0.000 1.099 721 R HN 0.457 8.727 8.270 -0.000 0.000 0.459 722 Y N 1.434 121.766 120.300 0.054 0.000 2.512 722 Y HA 0.335 4.885 4.550 0.001 0.000 0.348 722 Y C -0.129 175.870 175.900 0.165 0.000 0.990 722 Y CA -1.122 57.030 58.100 0.087 0.000 1.033 722 Y CB 1.972 40.446 38.460 0.023 0.000 1.259 722 Y HN 0.492 8.772 8.280 -0.000 0.000 0.461 723 N N 2.513 121.433 118.700 0.368 0.000 2.444 723 N HA 0.101 4.842 4.740 0.001 0.000 0.271 723 N C -0.864 174.840 175.510 0.324 0.000 1.069 723 N CA -0.386 52.911 53.050 0.412 0.000 0.965 723 N CB 1.498 40.203 38.487 0.363 0.000 1.092 723 N HN 0.682 9.062 8.380 -0.000 0.000 0.476 724 Q N 2.997 122.955 119.800 0.263 0.000 2.256 724 Q HA 0.507 4.847 4.340 0.001 0.000 0.254 724 Q C -0.609 175.546 176.000 0.258 0.000 0.916 724 Q CA -0.439 55.465 55.803 0.169 0.000 0.932 724 Q CB 0.915 29.694 28.738 0.068 0.000 1.207 724 Q HN 0.669 8.939 8.270 -0.000 0.000 0.426 725 M N 1.729 121.483 119.600 0.256 0.000 2.644 725 M HA 0.469 4.950 4.480 0.001 0.000 0.273 725 M C -1.721 174.715 176.300 0.227 0.000 1.253 725 M CA -0.943 54.527 55.300 0.283 0.000 0.852 725 M CB 1.990 34.746 32.600 0.261 0.000 1.708 725 M HN 0.413 8.703 8.290 -0.000 0.000 0.471 726 D N 2.438 122.963 120.400 0.209 0.000 2.382 726 D HA 0.232 4.873 4.640 0.001 0.000 0.245 726 D C -1.067 175.276 176.300 0.071 0.000 1.120 726 D CA 0.796 54.881 54.000 0.142 0.000 0.890 726 D CB 0.951 41.809 40.800 0.097 0.000 1.201 726 D HN 0.573 8.943 8.370 -0.000 0.000 0.433 727 D N 2.003 122.448 120.400 0.074 0.000 2.365 727 D HA 0.042 4.682 4.640 0.001 0.000 0.237 727 D C 0.962 177.299 176.300 0.061 0.000 1.190 727 D CA -0.253 53.828 54.000 0.135 0.000 0.867 727 D CB 0.372 41.307 40.800 0.226 0.000 1.050 727 D HN 0.284 8.654 8.370 -0.000 0.000 0.491 728 L N 3.123 124.299 121.223 -0.079 0.000 2.549 728 L HA -0.132 4.208 4.340 0.001 0.000 0.230 728 L C 1.455 178.269 176.870 -0.093 0.000 1.162 728 L CA 0.158 54.774 54.840 -0.374 0.000 0.834 728 L CB -0.183 41.423 42.059 -0.755 0.000 0.947 728 L HN 0.480 8.710 8.230 -0.000 0.000 0.452 729 L N -0.738 120.526 121.223 0.069 0.000 2.446 729 L HA 0.094 4.434 4.340 0.001 0.000 0.219 729 L C 2.612 179.525 176.870 0.072 0.000 1.116 729 L CA 1.151 56.049 54.840 0.095 0.000 0.844 729 L CB -0.956 41.156 42.059 0.088 0.000 0.970 729 L HN 0.112 8.342 8.230 -0.000 0.000 0.457 730 A N 0.867 123.747 122.820 0.100 0.000 1.884 730 A HA -0.284 4.037 4.320 0.001 0.000 0.219 730 A C 1.573 179.133 177.584 -0.041 0.000 1.197 730 A CA 2.345 54.414 52.037 0.054 0.000 0.637 730 A CB -0.877 18.189 19.000 0.109 0.000 0.827 730 A HN 0.585 8.735 8.150 -0.000 0.000 0.450 731 D N -2.533 117.850 120.400 -0.028 0.000 2.525 731 D HA 0.377 5.017 4.640 0.001 0.000 0.229 731 D C -0.207 175.925 176.300 -0.280 0.000 1.202 731 D CA -0.512 53.408 54.000 -0.134 0.000 0.828 731 D CB -0.392 40.330 40.800 -0.129 0.000 1.008 731 D HN 0.280 8.650 8.370 -0.000 0.000 0.493 732 F N 0.473 120.375 119.950 -0.081 0.000 2.399 732 F HA 0.397 4.925 4.527 0.001 0.000 0.328 732 F C 0.464 176.204 175.800 -0.100 0.000 1.084 732 F CA -0.987 56.974 58.000 -0.065 0.000 1.053 732 F CB 1.071 40.039 39.000 -0.053 0.000 1.209 732 F HN -0.195 8.105 8.300 -0.000 0.000 0.502 733 D N 0.850 121.332 120.400 0.137 0.000 2.412 733 D HA 0.276 4.916 4.640 0.001 0.000 0.224 733 D C -0.494 175.847 176.300 0.068 0.000 1.093 733 D CA 0.100 54.142 54.000 0.070 0.000 0.850 733 D CB 1.107 41.941 40.800 0.056 0.000 1.046 733 D HN 0.473 8.843 8.370 -0.000 0.000 0.507 734 S N 2.114 117.834 115.700 0.034 0.000 3.527 734 S HA -0.108 4.362 4.470 0.001 0.000 0.409 734 S C -2.409 172.179 174.600 -0.020 0.000 0.900 734 S CA -0.587 57.623 58.200 0.017 0.000 1.320 734 S CB -0.755 62.461 63.200 0.025 0.000 0.915 734 S HN 0.392 8.702 8.310 -0.000 0.000 0.575 735 P HA 0.312 4.732 4.420 -0.000 0.000 0.271 735 P C -0.188 176.989 177.300 -0.206 0.000 1.216 735 P CA -0.387 62.610 63.100 -0.171 0.000 0.776 735 P CB 0.449 32.006 31.700 -0.239 0.000 0.881 736 C N 2.522 121.610 119.300 -0.352 0.000 2.376 736 C HA 0.635 5.096 4.460 0.001 0.000 0.335 736 C C 0.192 175.144 174.990 -0.062 0.000 1.229 736 C CA -0.332 58.538 59.018 -0.247 0.000 1.867 736 C CB 1.169 28.587 27.740 -0.537 0.000 2.319 736 C HN 0.332 8.562 8.230 -0.000 0.000 0.515 737 V N 3.945 123.943 119.914 0.140 0.000 2.709 737 V HA 0.600 4.720 4.120 0.001 0.000 0.308 737 V C -0.428 175.585 176.094 -0.135 0.000 1.062 737 V CA -0.425 61.898 62.300 0.038 0.000 0.901 737 V CB 1.704 33.452 31.823 -0.126 0.000 1.003 737 V HN 0.945 9.135 8.190 -0.000 0.000 0.425 738 M N 3.627 123.060 119.600 -0.278 0.000 2.395 738 M HA 0.573 5.053 4.480 0.001 0.000 0.307 738 M C -1.884 174.290 176.300 -0.211 0.000 1.091 738 M CA -0.400 54.570 55.300 -0.549 0.000 0.919 738 M CB 2.075 33.905 32.600 -1.283 0.000 1.662 738 M HN 0.782 9.072 8.290 -0.000 0.000 0.440 739 D N 4.541 124.822 120.400 -0.199 0.000 2.392 739 D HA 0.347 4.988 4.640 0.001 0.000 0.228 739 D C -1.665 174.574 176.300 -0.102 0.000 1.074 739 D CA -0.144 53.802 54.000 -0.089 0.000 0.838 739 D CB 1.019 41.770 40.800 -0.082 0.000 1.067 739 D HN 0.679 9.049 8.370 -0.000 0.000 0.511 740 C N 4.839 124.124 119.300 -0.024 0.000 2.264 740 C HA 0.361 4.821 4.460 0.001 0.000 0.324 740 C C 0.452 175.453 174.990 0.017 0.000 1.267 740 C CA -0.972 58.039 59.018 -0.012 0.000 1.618 740 C CB 0.260 27.993 27.740 -0.011 0.000 2.278 740 C HN 0.512 8.742 8.230 -0.000 0.000 0.499 741 K N 4.117 124.527 120.400 0.016 0.000 2.349 741 K HA 0.347 4.667 4.320 0.001 0.000 0.288 741 K C -0.097 176.514 176.600 0.019 0.000 1.058 741 K CA -0.087 56.205 56.287 0.007 0.000 0.953 741 K CB 0.376 32.872 32.500 -0.006 0.000 0.997 741 K HN 0.565 8.815 8.250 -0.000 0.000 0.477 742 M N 2.879 122.475 119.600 -0.008 0.000 2.277 742 M HA 0.426 4.906 4.480 0.001 0.000 0.350 742 M C 0.377 176.662 176.300 -0.026 0.000 1.180 742 M CA -0.139 55.112 55.300 -0.080 0.000 1.103 742 M CB 0.566 32.978 32.600 -0.313 0.000 1.577 742 M HN 0.908 9.198 8.290 -0.000 0.000 0.459 743 G N 1.134 109.906 108.800 -0.047 0.000 2.459 743 G HA2 0.013 3.974 3.960 0.001 0.000 0.685 743 G HA3 0.013 3.974 3.960 0.001 0.000 0.685 743 G C -0.058 174.806 174.900 -0.059 0.000 1.303 743 G CA -0.489 44.609 45.100 -0.004 0.000 0.907 743 G HN 0.863 9.153 8.290 -0.000 0.000 0.632 744 V N -2.302 117.574 119.914 -0.063 0.000 3.510 744 V HA 0.481 4.601 4.120 0.001 0.000 0.270 744 V C 0.948 176.919 176.094 -0.204 0.000 1.201 744 V CA 1.458 63.701 62.300 -0.094 0.000 1.166 744 V CB -0.940 30.877 31.823 -0.010 0.000 0.825 744 V HN 0.731 8.921 8.190 -0.000 0.000 0.484 745 R N -0.469 119.842 120.500 -0.316 0.000 2.707 745 R HA 0.577 4.918 4.340 0.001 0.000 0.272 745 R C 0.364 176.410 176.300 -0.423 0.000 1.011 745 R CA 0.256 56.019 56.100 -0.562 0.000 0.893 745 R CB 1.724 31.364 30.300 -1.101 0.000 1.233 745 R HN 0.230 8.500 8.270 -0.000 0.000 0.464 746 T N -2.943 111.388 114.554 -0.370 0.000 3.040 746 T HA 0.189 4.539 4.350 0.001 0.000 0.266 746 T C -0.070 174.573 174.700 -0.096 0.000 1.005 746 T CA -0.193 61.805 62.100 -0.170 0.000 0.906 746 T CB -0.171 68.658 68.868 -0.065 0.000 1.082 746 T HN 0.519 8.759 8.240 -0.000 0.000 0.531 747 Y N 0.392 120.625 120.300 -0.111 0.000 2.446 747 Y HA 0.795 5.346 4.550 0.000 0.000 0.338 747 Y C -0.367 175.462 175.900 -0.119 0.000 1.055 747 Y CA -2.321 55.727 58.100 -0.087 0.000 1.101 747 Y CB 0.775 39.191 38.460 -0.073 0.000 1.221 747 Y HN -0.102 8.178 8.280 -0.000 0.000 0.460 748 L N 2.852 124.119 121.223 0.074 0.000 2.464 748 L HA 0.136 4.476 4.340 0.001 0.000 0.264 748 L C 1.591 178.531 176.870 0.116 0.000 1.199 748 L CA -0.045 54.810 54.840 0.025 0.000 0.818 748 L CB 0.667 42.757 42.059 0.051 0.000 1.102 748 L HN 0.850 9.080 8.230 -0.000 0.000 0.473 749 E N 0.982 121.220 120.200 0.064 0.000 2.085 749 E HA -0.248 4.102 4.350 0.001 0.000 0.194 749 E C 1.727 178.415 176.600 0.146 0.000 0.994 749 E CA 1.855 58.346 56.400 0.152 0.000 0.801 749 E CB 0.081 29.878 29.700 0.162 0.000 0.743 749 E HN 0.723 9.083 8.360 -0.000 0.000 0.453 750 E N 0.817 121.076 120.200 0.098 0.000 2.160 750 E HA -0.224 4.127 4.350 0.001 0.000 0.195 750 E C 1.708 178.358 176.600 0.083 0.000 0.991 750 E CA 1.029 57.477 56.400 0.079 0.000 0.810 750 E CB -0.280 29.453 29.700 0.054 0.000 0.742 750 E HN 0.331 8.691 8.360 -0.000 0.000 0.466 751 E N 0.443 120.705 120.200 0.102 0.000 2.106 751 E HA -0.148 4.202 4.350 0.001 0.000 0.192 751 E C 2.038 178.671 176.600 0.055 0.000 0.984 751 E CA 0.787 57.239 56.400 0.087 0.000 0.806 751 E CB -0.049 29.724 29.700 0.122 0.000 0.750 751 E HN 0.169 8.529 8.360 -0.000 0.000 0.458 752 L N 0.941 122.210 121.223 0.077 0.000 1.988 752 L HA -0.146 4.195 4.340 0.001 0.000 0.207 752 L C 2.201 179.108 176.870 0.063 0.000 1.071 752 L CA 2.060 56.920 54.840 0.033 0.000 0.744 752 L CB -1.020 41.116 42.059 0.129 0.000 0.893 752 L HN 0.039 8.269 8.230 -0.000 0.000 0.433 753 T N 0.062 114.673 114.554 0.094 0.000 2.653 753 T HA -0.275 4.075 4.350 0.001 0.000 0.268 753 T C 1.953 176.684 174.700 0.051 0.000 1.035 753 T CA 1.798 63.943 62.100 0.075 0.000 1.154 753 T CB -0.372 68.541 68.868 0.075 0.000 0.862 753 T HN 0.239 8.479 8.240 -0.000 0.000 0.441 754 K N 1.344 121.772 120.400 0.048 0.000 2.032 754 K HA -0.029 4.291 4.320 0.001 0.000 0.209 754 K C 2.534 179.152 176.600 0.030 0.000 1.048 754 K CA 1.615 57.924 56.287 0.037 0.000 0.927 754 K CB -0.585 31.937 32.500 0.037 0.000 0.712 754 K HN 0.367 8.617 8.250 -0.000 0.000 0.441 755 A N 0.841 123.677 122.820 0.026 0.000 1.969 755 A HA -0.126 4.195 4.320 0.001 0.000 0.218 755 A C 2.067 179.664 177.584 0.023 0.000 1.169 755 A CA 1.334 53.382 52.037 0.019 0.000 0.635 755 A CB -0.359 18.643 19.000 0.004 0.000 0.810 755 A HN 0.273 8.423 8.150 -0.000 0.000 0.445 756 R N -0.435 120.083 120.500 0.029 0.000 2.357 756 R HA 0.020 4.360 4.340 0.001 0.000 0.202 756 R C 1.635 177.951 176.300 0.026 0.000 1.047 756 R CA 1.270 57.389 56.100 0.032 0.000 1.034 756 R CB -0.314 30.012 30.300 0.043 0.000 0.875 756 R HN 0.525 8.795 8.270 -0.000 0.000 0.473 757 K N 0.549 120.963 120.400 0.024 0.000 2.057 757 K HA 0.022 4.343 4.320 0.001 0.000 0.209 757 K C -0.063 176.546 176.600 0.015 0.000 1.028 757 K CA 1.084 57.383 56.287 0.020 0.000 0.950 757 K CB 0.116 32.629 32.500 0.021 0.000 0.784 757 K HN 0.014 8.264 8.250 -0.000 0.000 0.448 758 K N 1.950 122.359 120.400 0.014 0.000 2.231 758 K HA 0.229 4.549 4.320 0.001 0.000 0.255 758 K C -2.474 174.132 176.600 0.011 0.000 1.108 758 K CA -1.446 54.847 56.287 0.010 0.000 0.997 758 K CB 1.054 33.559 32.500 0.009 0.000 1.549 758 K HN -0.012 8.238 8.250 -0.000 0.000 0.419 759 P HA 0.040 4.460 4.420 -0.000 0.000 0.208 759 P C -0.199 177.104 177.300 0.006 0.000 1.837 759 P CA -0.314 62.794 63.100 0.013 0.000 0.953 759 P CB 0.289 31.999 31.700 0.016 0.000 1.870 760 S N 0.950 116.651 115.700 0.002 0.000 2.608 760 S HA 0.329 4.799 4.470 0.001 0.000 0.261 760 S C 0.273 174.867 174.600 -0.010 0.000 1.314 760 S CA -0.585 57.611 58.200 -0.006 0.000 0.992 760 S CB 0.281 63.476 63.200 -0.008 0.000 0.935 760 S HN 0.129 8.439 8.310 -0.000 0.000 0.564 761 L N 1.339 122.550 121.223 -0.021 0.000 2.371 761 L HA 0.504 4.844 4.340 0.001 0.000 0.272 761 L C 0.597 177.446 176.870 -0.035 0.000 1.124 761 L CA -0.527 54.295 54.840 -0.031 0.000 0.816 761 L CB 0.270 42.302 42.059 -0.046 0.000 1.129 761 L HN 0.554 8.784 8.230 -0.000 0.000 0.448 762 R N 2.308 122.785 120.500 -0.038 0.000 2.422 762 R HA 0.224 4.564 4.340 0.001 0.000 0.307 762 R C 0.116 176.397 176.300 -0.032 0.000 1.004 762 R CA -0.812 55.259 56.100 -0.049 0.000 0.882 762 R CB 1.581 31.834 30.300 -0.078 0.000 1.164 762 R HN 0.502 8.772 8.270 -0.000 0.000 0.489 763 K N 1.182 121.568 120.400 -0.023 0.000 2.002 763 K HA -0.184 4.136 4.320 0.001 0.000 0.209 763 K C 1.328 177.955 176.600 0.045 0.000 1.048 763 K CA 2.007 58.305 56.287 0.018 0.000 0.930 763 K CB -0.128 32.371 32.500 -0.002 0.000 0.714 763 K HN 0.530 8.780 8.250 -0.000 0.000 0.438 764 D N 1.014 121.401 120.400 -0.022 0.000 2.123 764 D HA -0.205 4.435 4.640 0.001 0.000 0.196 764 D C 1.776 177.998 176.300 -0.130 0.000 0.992 764 D CA 1.509 55.475 54.000 -0.057 0.000 0.833 764 D CB -0.487 40.272 40.800 -0.069 0.000 0.954 764 D HN 0.230 8.600 8.370 -0.000 0.000 0.455 765 M N -0.984 118.478 119.600 -0.231 0.000 2.175 765 M HA -0.098 4.383 4.480 0.001 0.000 0.264 765 M C 2.273 178.435 176.300 -0.229 0.000 1.063 765 M CA 1.067 56.062 55.300 -0.507 0.000 1.119 765 M CB -0.422 31.772 32.600 -0.676 0.000 1.377 765 M HN 0.031 8.321 8.290 -0.000 0.000 0.415 766 Y N 1.539 121.726 120.300 -0.190 0.000 2.181 766 Y HA -0.239 4.312 4.550 0.001 0.000 0.288 766 Y C 2.314 178.144 175.900 -0.117 0.000 1.146 766 Y CA 1.756 59.773 58.100 -0.139 0.000 1.164 766 Y CB -0.271 38.125 38.460 -0.107 0.000 0.982 766 Y HN 0.243 8.523 8.280 -0.000 0.000 0.515 767 Q N -0.004 119.710 119.800 -0.143 0.000 2.123 767 Q HA -0.154 4.186 4.340 0.001 0.000 0.199 767 Q C 2.177 178.085 176.000 -0.153 0.000 0.966 767 Q CA 1.355 57.050 55.803 -0.179 0.000 0.845 767 Q CB -0.082 28.637 28.738 -0.032 0.000 0.907 767 Q HN 0.504 8.774 8.270 -0.000 0.000 0.439 768 K N 0.596 120.945 120.400 -0.085 0.000 2.025 768 K HA -0.088 4.232 4.320 0.001 0.000 0.207 768 K C 2.085 178.708 176.600 0.038 0.000 1.049 768 K CA 1.075 57.383 56.287 0.035 0.000 0.933 768 K CB -0.112 32.477 32.500 0.150 0.000 0.714 768 K HN 0.172 8.422 8.250 -0.000 0.000 0.438 769 M N 0.616 120.143 119.600 -0.121 0.000 2.117 769 M HA -0.158 4.323 4.480 0.001 0.000 0.262 769 M C 2.016 178.083 176.300 -0.388 0.000 1.065 769 M CA 1.423 56.427 55.300 -0.493 0.000 1.114 769 M CB 0.067 32.162 32.600 -0.842 0.000 1.361 769 M HN 0.001 8.291 8.290 -0.000 0.000 0.408 770 V N 0.348 119.999 119.914 -0.439 0.000 2.719 770 V HA -0.211 3.909 4.120 0.001 0.000 0.252 770 V C 2.026 178.010 176.094 -0.183 0.000 1.065 770 V CA 2.071 64.139 62.300 -0.386 0.000 1.086 770 V CB -0.415 31.043 31.823 -0.609 0.000 0.700 770 V HN 0.615 8.805 8.190 -0.000 0.000 0.467 771 E N -0.505 119.619 120.200 -0.126 0.000 2.047 771 E HA -0.163 4.187 4.350 0.001 0.000 0.191 771 E C 2.118 178.731 176.600 0.022 0.000 0.987 771 E CA 1.761 58.138 56.400 -0.038 0.000 0.799 771 E CB -0.008 29.685 29.700 -0.012 0.000 0.752 771 E HN 0.414 8.774 8.360 -0.000 0.000 0.449 772 V N 0.508 120.477 119.914 0.091 0.000 2.379 772 V HA -0.097 4.023 4.120 0.001 0.000 0.245 772 V C 0.659 176.849 176.094 0.159 0.000 1.044 772 V CA 1.597 64.001 62.300 0.174 0.000 1.036 772 V CB -0.097 31.941 31.823 0.359 0.000 0.664 772 V HN 0.318 8.508 8.190 -0.000 0.000 0.453 773 D N -0.981 119.499 120.400 0.134 0.000 2.478 773 D HA 0.237 4.878 4.640 0.001 0.000 0.240 773 D C -2.332 173.958 176.300 -0.017 0.000 1.364 773 D CA -1.762 52.295 54.000 0.096 0.000 0.987 773 D CB 2.184 43.116 40.800 0.221 0.000 1.328 773 D HN 0.051 8.421 8.370 -0.000 0.000 0.584 774 P HA 0.061 4.481 4.420 -0.000 0.000 0.242 774 P C 0.336 177.610 177.300 -0.042 0.000 1.197 774 P CA 0.558 63.624 63.100 -0.056 0.000 0.765 774 P CB 0.537 32.218 31.700 -0.032 0.000 0.936 775 E N -1.061 119.129 120.200 -0.017 0.000 2.526 775 E HA 0.247 4.597 4.350 0.001 0.000 0.208 775 E C 1.608 178.206 176.600 -0.003 0.000 0.997 775 E CA -0.133 56.267 56.400 -0.001 0.000 0.961 775 E CB 0.322 30.033 29.700 0.018 0.000 1.030 775 E HN 0.129 8.489 8.360 -0.000 0.000 0.483 776 A N 2.451 125.246 122.820 -0.042 0.000 1.898 776 A HA 0.065 4.386 4.320 0.001 0.000 0.214 776 A C -1.390 176.131 177.584 -0.105 0.000 1.183 776 A CA 0.306 52.298 52.037 -0.075 0.000 0.622 776 A CB -1.062 17.810 19.000 -0.214 0.000 0.824 776 A HN 0.093 8.243 8.150 -0.000 0.000 0.444 777 P HA 0.208 4.628 4.420 -0.000 0.000 0.271 777 P C 0.165 177.474 177.300 0.015 0.000 1.218 777 P CA 0.233 63.318 63.100 -0.026 0.000 0.780 777 P CB 0.350 32.116 31.700 0.110 0.000 0.901 778 T N -1.164 113.402 114.554 0.020 0.000 2.802 778 T HA 0.053 4.403 4.350 0.001 0.000 0.305 778 T C 1.229 175.941 174.700 0.019 0.000 1.053 778 T CA -0.081 62.029 62.100 0.017 0.000 1.058 778 T CB 0.453 69.328 68.868 0.012 0.000 0.988 778 T HN 0.242 8.482 8.240 -0.000 0.000 0.539 779 E N 0.577 120.784 120.200 0.011 0.000 2.085 779 E HA -0.085 4.265 4.350 0.001 0.000 0.194 779 E C 2.148 178.741 176.600 -0.012 0.000 0.994 779 E CA 1.499 57.902 56.400 0.005 0.000 0.801 779 E CB -0.376 29.325 29.700 0.002 0.000 0.743 779 E HN 0.843 9.203 8.360 -0.000 0.000 0.453 780 E N 0.391 120.580 120.200 -0.017 0.000 2.070 780 E HA -0.231 4.120 4.350 0.001 0.000 0.197 780 E C 2.000 178.560 176.600 -0.066 0.000 1.004 780 E CA 1.706 58.084 56.400 -0.035 0.000 0.805 780 E CB -0.124 29.560 29.700 -0.026 0.000 0.744 780 E HN 0.341 8.701 8.360 -0.000 0.000 0.451 781 E N 0.299 120.467 120.200 -0.052 0.000 2.072 781 E HA -0.153 4.198 4.350 0.001 0.000 0.191 781 E C 1.957 178.422 176.600 -0.226 0.000 0.985 781 E CA 0.971 57.311 56.400 -0.100 0.000 0.801 781 E CB 0.002 29.709 29.700 0.012 0.000 0.750 781 E HN 0.118 8.478 8.360 -0.000 0.000 0.452 782 K N 0.499 120.875 120.400 -0.041 0.000 2.020 782 K HA -0.188 4.132 4.320 0.001 0.000 0.212 782 K C 2.160 178.675 176.600 -0.142 0.000 1.050 782 K CA 1.423 57.710 56.287 0.000 0.000 0.929 782 K CB -0.214 32.336 32.500 0.083 0.000 0.714 782 K HN 0.076 8.326 8.250 -0.000 0.000 0.443 783 A N 0.899 123.655 122.820 -0.108 0.000 1.972 783 A HA -0.204 4.117 4.320 0.001 0.000 0.219 783 A C 1.862 179.356 177.584 -0.151 0.000 1.169 783 A CA 1.380 53.357 52.037 -0.100 0.000 0.635 783 A CB -0.285 18.677 19.000 -0.064 0.000 0.810 783 A HN 0.340 8.490 8.150 -0.000 0.000 0.446 784 Q N -1.754 117.917 119.800 -0.215 0.000 2.398 784 Q HA 0.136 4.476 4.340 0.001 0.000 0.204 784 Q C -0.088 175.703 176.000 -0.349 0.000 0.932 784 Q CA -0.063 55.604 55.803 -0.226 0.000 0.916 784 Q CB 0.234 28.859 28.738 -0.188 0.000 1.024 784 Q HN 0.566 8.836 8.270 -0.000 0.000 0.504 785 R N -0.417 119.702 120.500 -0.635 0.000 3.405 785 R HA -0.206 4.134 4.340 0.001 0.000 0.258 785 R C -0.989 174.842 176.300 -0.781 0.000 1.030 785 R CA 0.436 55.909 56.100 -1.045 0.000 0.691 785 R CB -1.849 28.225 30.300 -0.376 0.000 1.093 785 R HN 0.249 8.519 8.270 -0.000 0.000 0.448 786 A N -0.824 121.575 122.820 -0.702 0.000 2.566 786 A HA 0.699 5.020 4.320 0.001 0.000 0.297 786 A C -0.659 176.859 177.584 -0.109 0.000 1.059 786 A CA -0.638 51.257 52.037 -0.237 0.000 0.691 786 A CB 1.861 20.770 19.000 -0.152 0.000 1.282 786 A HN 0.015 8.165 8.150 -0.000 0.000 0.401 787 V N 0.730 120.651 119.914 0.012 0.000 3.074 787 V HA 0.779 4.899 4.120 0.001 0.000 0.314 787 V C 0.864 176.974 176.094 0.026 0.000 1.117 787 V CA -0.019 62.305 62.300 0.039 0.000 1.014 787 V CB 2.112 33.993 31.823 0.097 0.000 1.057 787 V HN 1.286 9.476 8.190 -0.000 0.000 0.438 788 T N -0.921 113.660 114.554 0.045 0.000 2.833 788 T HA 0.355 4.705 4.350 0.001 0.000 0.292 788 T C 0.658 175.413 174.700 0.091 0.000 1.031 788 T CA -0.084 62.043 62.100 0.045 0.000 0.937 788 T CB 1.318 70.209 68.868 0.039 0.000 1.256 788 T HN 0.683 8.923 8.240 -0.000 0.000 0.551 789 K N -0.067 120.380 120.400 0.078 0.000 2.329 789 K HA 0.203 4.523 4.320 0.001 0.000 0.198 789 K C -1.264 175.392 176.600 0.094 0.000 1.085 789 K CA -0.411 55.944 56.287 0.112 0.000 0.961 789 K CB -0.823 31.716 32.500 0.065 0.000 0.971 789 K HN 0.335 8.585 8.250 -0.000 0.000 0.502 790 P HA -0.395 4.025 4.420 -0.000 0.000 0.265 790 P C 0.817 178.160 177.300 0.072 0.000 0.787 790 P CA 1.793 64.916 63.100 0.037 0.000 1.059 790 P CB -0.355 31.374 31.700 0.049 0.000 0.849 791 R N -1.397 119.170 120.500 0.111 0.000 2.091 791 R HA -0.197 4.144 4.340 0.001 0.000 0.238 791 R C 2.534 178.962 176.300 0.214 0.000 1.136 791 R CA 2.191 58.378 56.100 0.144 0.000 0.959 791 R CB -1.195 29.177 30.300 0.119 0.000 0.856 791 R HN 0.365 8.635 8.270 -0.000 0.000 0.437 792 Y N 0.643 121.011 120.300 0.113 0.000 2.184 792 Y HA -0.143 4.407 4.550 0.001 0.000 0.290 792 Y C 2.374 178.413 175.900 0.233 0.000 1.129 792 Y CA 1.868 60.086 58.100 0.198 0.000 1.144 792 Y CB -0.376 38.159 38.460 0.124 0.000 0.995 792 Y HN -0.063 8.217 8.280 -0.000 0.000 0.513 793 M N 0.069 119.695 119.600 0.044 0.000 2.108 793 M HA -0.355 4.125 4.480 0.001 0.000 0.257 793 M C 2.230 178.447 176.300 -0.138 0.000 1.071 793 M CA 2.260 57.463 55.300 -0.162 0.000 1.093 793 M CB -0.380 32.001 32.600 -0.365 0.000 1.345 793 M HN 0.382 8.672 8.290 -0.000 0.000 0.403 794 Q N -1.461 118.324 119.800 -0.025 0.000 2.137 794 Q HA -0.192 4.148 4.340 0.001 0.000 0.198 794 Q C 1.813 177.871 176.000 0.097 0.000 0.960 794 Q CA 1.470 57.341 55.803 0.113 0.000 0.847 794 Q CB -0.204 28.647 28.738 0.189 0.000 0.915 794 Q HN 0.699 8.969 8.270 -0.000 0.000 0.448 795 W N 1.581 122.843 121.300 -0.063 0.000 2.363 795 W HA -0.154 4.505 4.660 -0.000 0.000 0.296 795 W C 2.005 178.447 176.519 -0.127 0.000 1.212 795 W CA 1.186 58.489 57.345 -0.070 0.000 1.260 795 W CB -0.092 29.335 29.460 -0.055 0.000 1.131 795 W HN -0.068 8.112 8.180 -0.000 0.000 0.530 796 R N 0.516 120.698 120.500 -0.529 0.000 2.119 796 R HA -0.215 4.125 4.340 0.001 0.000 0.246 796 R C 1.955 177.894 176.300 -0.601 0.000 1.146 796 R CA 2.032 57.632 56.100 -0.834 0.000 0.962 796 R CB -0.471 29.514 30.300 -0.524 0.000 0.863 796 R HN 0.182 8.452 8.270 -0.000 0.000 0.442 797 E N -0.733 119.274 120.200 -0.322 0.000 2.401 797 E HA -0.125 4.226 4.350 0.001 0.000 0.199 797 E C 1.487 177.929 176.600 -0.264 0.000 1.023 797 E CA 0.963 57.231 56.400 -0.220 0.000 0.859 797 E CB -0.037 29.609 29.700 -0.091 0.000 0.780 797 E HN 0.288 8.648 8.360 -0.000 0.000 0.523 798 T N 0.803 115.132 114.554 -0.377 0.000 3.051 798 T HA 0.074 4.425 4.350 0.001 0.000 0.255 798 T C 1.845 176.361 174.700 -0.308 0.000 1.085 798 T CA 0.030 61.953 62.100 -0.296 0.000 1.109 798 T CB 0.077 68.786 68.868 -0.266 0.000 0.921 798 T HN 0.300 8.540 8.240 -0.000 0.000 0.488 799 I N 0.187 120.495 120.570 -0.437 0.000 3.059 799 I HA 0.206 4.377 4.170 0.001 0.000 0.270 799 I C 1.155 177.147 176.117 -0.208 0.000 1.238 799 I CA -0.120 60.987 61.300 -0.321 0.000 1.478 799 I CB -0.250 37.509 38.000 -0.401 0.000 1.097 799 I HN 0.110 8.320 8.210 -0.000 0.000 0.455 800 S N 0.845 116.415 115.700 -0.217 0.000 2.753 800 S HA 0.353 4.823 4.470 0.001 0.000 0.302 800 S C 0.968 175.441 174.600 -0.211 0.000 1.104 800 S CA -0.002 58.093 58.200 -0.176 0.000 0.968 800 S CB 1.093 64.200 63.200 -0.154 0.000 1.278 800 S HN 0.315 8.625 8.310 -0.000 0.000 0.549 801 S N -0.645 114.897 115.700 -0.263 0.000 2.660 801 S HA 0.034 4.504 4.470 0.001 0.000 0.223 801 S C 1.270 175.636 174.600 -0.391 0.000 0.963 801 S CA 0.594 58.570 58.200 -0.373 0.000 0.932 801 S CB -1.102 61.751 63.200 -0.578 0.000 0.775 801 S HN 0.676 8.986 8.310 -0.000 0.000 0.531 802 T N 2.907 117.291 114.554 -0.284 0.000 2.674 802 T HA -0.015 4.336 4.350 0.001 0.000 0.265 802 T C 2.176 176.765 174.700 -0.185 0.000 1.039 802 T CA 1.661 63.623 62.100 -0.230 0.000 1.150 802 T CB -0.737 68.023 68.868 -0.179 0.000 0.864 802 T HN 0.667 8.907 8.240 -0.000 0.000 0.427 803 A N 1.220 123.948 122.820 -0.154 0.000 2.015 803 A HA -0.064 4.256 4.320 0.001 0.000 0.219 803 A C 2.504 180.042 177.584 -0.077 0.000 1.163 803 A CA 2.016 53.999 52.037 -0.090 0.000 0.646 803 A CB -0.792 18.172 19.000 -0.060 0.000 0.806 803 A HN 0.654 8.804 8.150 -0.000 0.000 0.448 804 T N -2.691 111.789 114.554 -0.123 0.000 3.021 804 T HA 0.216 4.566 4.350 0.001 0.000 0.245 804 T C 1.622 176.246 174.700 -0.127 0.000 1.028 804 T CA 0.859 62.896 62.100 -0.105 0.000 1.139 804 T CB -0.256 68.546 68.868 -0.111 0.000 0.884 804 T HN 0.229 8.469 8.240 -0.000 0.000 0.457 805 L N 0.482 121.562 121.223 -0.238 0.000 2.513 805 L HA 0.423 4.763 4.340 0.001 0.000 0.222 805 L C 1.979 178.736 176.870 -0.187 0.000 1.096 805 L CA 0.471 55.145 54.840 -0.277 0.000 0.857 805 L CB -0.274 41.424 42.059 -0.603 0.000 1.026 805 L HN 0.624 8.854 8.230 -0.000 0.000 0.469 806 G N 1.385 110.071 108.800 -0.191 0.000 2.136 806 G HA2 -0.312 3.648 3.960 0.001 0.000 0.242 806 G HA3 -0.312 3.648 3.960 0.001 0.000 0.242 806 G C -0.002 174.911 174.900 0.020 0.000 0.989 806 G CA 0.483 45.549 45.100 -0.057 0.000 0.682 806 G HN 0.404 8.694 8.290 -0.000 0.000 0.522 807 F N -1.849 118.033 119.950 -0.112 0.000 2.741 807 F HA 0.908 5.435 4.527 0.000 0.000 0.313 807 F C -0.614 175.113 175.800 -0.122 0.000 1.153 807 F CA -1.402 56.523 58.000 -0.124 0.000 0.931 807 F CB 0.920 39.847 39.000 -0.120 0.000 1.335 807 F HN 0.482 8.782 8.300 -0.000 0.000 0.460 808 R N 1.207 121.756 120.500 0.081 0.000 2.604 808 R HA 0.700 5.040 4.340 0.001 0.000 0.270 808 R C -2.162 174.158 176.300 0.033 0.000 1.052 808 R CA -0.903 55.181 56.100 -0.026 0.000 0.902 808 R CB 1.652 31.889 30.300 -0.106 0.000 1.233 808 R HN 0.781 9.051 8.270 -0.000 0.000 0.455 809 I N 3.011 123.533 120.570 -0.081 0.000 2.533 809 I HA 0.041 4.211 4.170 0.001 0.000 0.284 809 I C 0.902 176.919 176.117 -0.167 0.000 1.109 809 I CA -0.104 61.024 61.300 -0.286 0.000 1.412 809 I CB 1.047 38.571 38.000 -0.793 0.000 1.396 809 I HN 0.728 8.938 8.210 -0.000 0.000 0.543 810 E N 4.191 124.333 120.200 -0.097 0.000 2.162 810 E HA 0.235 4.585 4.350 0.001 0.000 0.193 810 E C 0.748 177.427 176.600 0.132 0.000 0.953 810 E CA 0.249 56.672 56.400 0.040 0.000 0.849 810 E CB 0.633 30.337 29.700 0.007 0.000 0.810 810 E HN 0.826 9.186 8.360 -0.000 0.000 0.470 811 G N 0.228 109.038 108.800 0.016 0.000 2.646 811 G HA2 0.604 4.564 3.960 0.001 0.000 0.291 811 G HA3 0.604 4.564 3.960 0.001 0.000 0.291 811 G C -1.494 173.373 174.900 -0.055 0.000 1.445 811 G CA -0.692 44.477 45.100 0.115 0.000 0.814 811 G HN -0.027 8.263 8.290 -0.000 0.000 0.495 812 I N 0.274 120.876 120.570 0.052 0.000 2.569 812 I HA 0.393 4.563 4.170 0.001 0.000 0.290 812 I C -0.576 175.555 176.117 0.022 0.000 1.088 812 I CA -0.853 60.401 61.300 -0.077 0.000 1.047 812 I CB 2.742 40.712 38.000 -0.049 0.000 1.237 812 I HN 0.515 8.725 8.210 -0.000 0.000 0.421 813 K N 6.328 126.733 120.400 0.009 0.000 2.265 813 K HA 0.575 4.896 4.320 0.001 0.000 0.267 813 K C -0.999 175.673 176.600 0.119 0.000 0.994 813 K CA -0.450 55.862 56.287 0.042 0.000 0.860 813 K CB 1.281 33.768 32.500 -0.021 0.000 1.099 813 K HN 0.375 8.625 8.250 -0.000 0.000 0.448 814 K N 1.811 122.285 120.400 0.124 0.000 2.177 814 K HA 0.198 4.519 4.320 0.001 0.000 0.238 814 K C 0.666 177.302 176.600 0.060 0.000 1.015 814 K CA -0.782 55.590 56.287 0.142 0.000 0.922 814 K CB 0.742 33.333 32.500 0.151 0.000 1.127 814 K HN 0.538 8.788 8.250 -0.000 0.000 0.469 815 E N 0.960 121.187 120.200 0.044 0.000 2.265 815 E HA -0.178 4.173 4.350 0.001 0.000 0.196 815 E C 0.749 177.366 176.600 0.029 0.000 0.996 815 E CA 1.095 57.508 56.400 0.022 0.000 0.832 815 E CB -0.024 29.691 29.700 0.026 0.000 0.756 815 E HN 0.481 8.841 8.360 -0.000 0.000 0.491 816 D N -0.253 120.171 120.400 0.039 0.000 2.221 816 D HA -0.124 4.516 4.640 0.001 0.000 0.204 816 D C 1.338 177.656 176.300 0.029 0.000 0.982 816 D CA 1.488 55.508 54.000 0.035 0.000 0.857 816 D CB -0.164 40.660 40.800 0.041 0.000 0.934 816 D HN 0.377 8.747 8.370 -0.000 0.000 0.475 817 G N -0.030 108.787 108.800 0.029 0.000 2.143 817 G HA2 -0.255 3.705 3.960 0.001 0.000 0.249 817 G HA3 -0.255 3.705 3.960 0.001 0.000 0.249 817 G C 0.333 175.248 174.900 0.024 0.000 0.981 817 G CA 0.708 45.823 45.100 0.024 0.000 0.665 817 G HN 0.582 8.872 8.290 -0.000 0.000 0.528 818 S N -1.143 114.576 115.700 0.032 0.000 2.617 818 S HA 0.811 5.281 4.470 0.001 0.000 0.283 818 S C -0.230 174.391 174.600 0.035 0.000 1.189 818 S CA -0.386 57.832 58.200 0.030 0.000 1.036 818 S CB 2.927 66.146 63.200 0.032 0.000 1.014 818 S HN 1.049 9.359 8.310 -0.000 0.000 0.522 819 V N 3.082 123.010 119.914 0.024 0.000 2.531 819 V HA 0.484 4.604 4.120 0.001 0.000 0.301 819 V C -0.865 175.240 176.094 0.019 0.000 1.034 819 V CA -0.904 61.411 62.300 0.025 0.000 0.865 819 V CB 1.635 33.462 31.823 0.006 0.000 0.995 819 V HN 0.947 9.137 8.190 -0.000 0.000 0.424 820 N N 4.077 122.807 118.700 0.050 0.000 2.362 820 N HA 0.558 5.298 4.740 0.001 0.000 0.298 820 N C 0.101 175.629 175.510 0.031 0.000 1.048 820 N CA -0.597 52.445 53.050 -0.013 0.000 0.858 820 N CB 2.705 41.193 38.487 0.001 0.000 1.218 820 N HN 0.545 8.925 8.380 -0.000 0.000 0.488 821 R N -0.300 120.123 120.500 -0.128 0.000 2.541 821 R HA 0.087 4.428 4.340 0.001 0.000 0.332 821 R C -0.675 175.483 176.300 -0.236 0.000 0.951 821 R CA -0.200 55.871 56.100 -0.049 0.000 1.136 821 R CB 0.585 30.891 30.300 0.010 0.000 1.449 821 R HN 0.400 8.670 8.270 -0.000 0.000 0.531 822 D N 0.197 120.275 120.400 -0.537 0.000 2.563 822 D HA 0.064 4.705 4.640 0.001 0.000 0.222 822 D C -0.508 175.397 176.300 -0.659 0.000 1.145 822 D CA -0.055 53.682 54.000 -0.438 0.000 1.001 822 D CB 0.006 40.626 40.800 -0.301 0.000 1.049 822 D HN 0.020 8.390 8.370 -0.000 0.000 0.515 823 F N 1.383 121.310 119.950 -0.039 0.000 2.708 823 F HA 0.283 4.810 4.527 -0.000 0.000 0.300 823 F C 1.804 177.564 175.800 -0.067 0.000 1.118 823 F CA -0.475 57.492 58.000 -0.055 0.000 1.307 823 F CB 0.426 39.391 39.000 -0.058 0.000 0.986 823 F HN 0.030 8.330 8.300 -0.000 0.000 0.522 824 K N 1.009 121.422 120.400 0.021 0.000 2.044 824 K HA -0.142 4.179 4.320 0.001 0.000 0.210 824 K C 1.240 177.820 176.600 -0.034 0.000 1.049 824 K CA 1.504 57.784 56.287 -0.012 0.000 0.927 824 K CB -0.084 32.402 32.500 -0.023 0.000 0.713 824 K HN 0.108 8.358 8.250 -0.000 0.000 0.443 825 K N 0.320 120.704 120.400 -0.027 0.000 2.570 825 K HA 0.128 4.449 4.320 0.001 0.000 0.210 825 K C -0.741 175.846 176.600 -0.021 0.000 1.048 825 K CA -0.035 56.231 56.287 -0.035 0.000 1.167 825 K CB 0.999 33.484 32.500 -0.026 0.000 0.892 825 K HN -0.033 8.217 8.250 -0.000 0.000 0.480 826 T N 1.266 115.830 114.554 0.017 0.000 2.738 826 T HA 0.164 4.515 4.350 0.001 0.000 0.294 826 T C 0.707 175.365 174.700 -0.069 0.000 0.914 826 T CA 0.081 62.197 62.100 0.026 0.000 1.052 826 T CB 0.934 69.910 68.868 0.181 0.000 0.897 826 T HN 0.137 8.377 8.240 -0.000 0.000 0.522 827 K N 1.390 121.734 120.400 -0.094 0.000 2.412 827 K HA 0.106 4.426 4.320 0.001 0.000 0.201 827 K C 1.291 177.796 176.600 -0.159 0.000 1.275 827 K CA 0.231 56.437 56.287 -0.135 0.000 0.910 827 K CB 0.526 32.966 32.500 -0.100 0.000 1.346 827 K HN 0.643 8.893 8.250 -0.000 0.000 0.490 828 T N -1.172 113.310 114.554 -0.120 0.000 2.902 828 T HA 0.290 4.640 4.350 0.001 0.000 0.280 828 T C 0.949 175.576 174.700 -0.122 0.000 0.992 828 T CA -0.640 61.396 62.100 -0.108 0.000 1.015 828 T CB 1.863 70.689 68.868 -0.071 0.000 1.044 828 T HN -0.003 8.237 8.240 -0.000 0.000 0.520 829 R N 0.213 120.653 120.500 -0.099 0.000 2.127 829 R HA -0.104 4.236 4.340 0.001 0.000 0.238 829 R C 2.160 178.407 176.300 -0.088 0.000 1.134 829 R CA 1.543 57.593 56.100 -0.084 0.000 0.975 829 R CB -0.221 30.052 30.300 -0.045 0.000 0.865 829 R HN 0.711 8.981 8.270 -0.000 0.000 0.447 830 E N 0.531 120.689 120.200 -0.070 0.000 2.028 830 E HA -0.168 4.183 4.350 0.001 0.000 0.191 830 E C 1.964 178.522 176.600 -0.071 0.000 0.988 830 E CA 1.136 57.502 56.400 -0.057 0.000 0.799 830 E CB -0.041 29.636 29.700 -0.038 0.000 0.755 830 E HN 0.268 8.628 8.360 -0.000 0.000 0.447 831 Q N -0.162 119.593 119.800 -0.074 0.000 2.135 831 Q HA -0.158 4.182 4.340 0.001 0.000 0.204 831 Q C 2.153 178.081 176.000 -0.120 0.000 0.981 831 Q CA 1.457 57.221 55.803 -0.066 0.000 0.856 831 Q CB -0.027 28.680 28.738 -0.051 0.000 0.902 831 Q HN 0.147 8.417 8.270 -0.000 0.000 0.425 832 V N -0.169 119.620 119.914 -0.208 0.000 2.283 832 V HA -0.244 3.876 4.120 0.001 0.000 0.243 832 V C 2.169 177.919 176.094 -0.572 0.000 1.039 832 V CA 2.097 64.141 62.300 -0.426 0.000 1.016 832 V CB -0.803 30.783 31.823 -0.395 0.000 0.650 832 V HN 0.419 8.609 8.190 -0.000 0.000 0.449 833 T N -0.254 114.091 114.554 -0.349 0.000 2.624 833 T HA -0.316 4.034 4.350 0.001 0.000 0.268 833 T C 1.876 176.534 174.700 -0.070 0.000 1.041 833 T CA 2.209 64.201 62.100 -0.181 0.000 1.159 833 T CB -0.307 68.518 68.868 -0.073 0.000 0.863 833 T HN 0.582 8.822 8.240 -0.000 0.000 0.434 834 E N 1.312 121.477 120.200 -0.058 0.000 2.065 834 E HA -0.203 4.147 4.350 0.001 0.000 0.201 834 E C 2.181 178.810 176.600 0.048 0.000 1.016 834 E CA 1.834 58.236 56.400 0.003 0.000 0.818 834 E CB -0.652 29.049 29.700 0.001 0.000 0.749 834 E HN 0.477 8.837 8.360 -0.000 0.000 0.453 835 A N -0.190 122.637 122.820 0.012 0.000 1.855 835 A HA -0.115 4.205 4.320 0.001 0.000 0.215 835 A C 2.115 179.855 177.584 0.260 0.000 1.191 835 A CA 1.540 53.636 52.037 0.098 0.000 0.613 835 A CB -0.968 18.023 19.000 -0.015 0.000 0.829 835 A HN 0.371 8.521 8.150 -0.000 0.000 0.442 836 F N -0.020 119.922 119.950 -0.014 0.000 2.063 836 F HA -0.193 4.335 4.527 0.001 0.000 0.298 836 F C 2.426 178.292 175.800 0.111 0.000 1.109 836 F CA 1.477 59.508 58.000 0.051 0.000 1.212 836 F CB -1.220 37.756 39.000 -0.041 0.000 0.973 836 F HN 0.243 8.543 8.300 -0.000 0.000 0.480 837 R N 0.255 120.914 120.500 0.264 0.000 2.096 837 R HA -0.213 4.127 4.340 0.001 0.000 0.240 837 R C 2.280 178.662 176.300 0.136 0.000 1.139 837 R CA 1.902 58.093 56.100 0.151 0.000 0.952 837 R CB -0.412 29.945 30.300 0.096 0.000 0.854 837 R HN 0.383 8.653 8.270 -0.000 0.000 0.436 838 E N -0.594 119.704 120.200 0.162 0.000 2.072 838 E HA -0.216 4.134 4.350 0.001 0.000 0.191 838 E C 1.695 178.420 176.600 0.208 0.000 0.985 838 E CA 1.076 57.570 56.400 0.156 0.000 0.801 838 E CB -0.180 29.611 29.700 0.153 0.000 0.750 838 E HN 0.344 8.704 8.360 -0.000 0.000 0.452 839 F N 0.828 120.847 119.950 0.115 0.000 2.269 839 F HA -0.123 4.404 4.527 0.000 0.000 0.301 839 F C 2.077 177.999 175.800 0.204 0.000 1.082 839 F CA 1.595 59.679 58.000 0.140 0.000 1.360 839 F CB -0.210 38.850 39.000 0.100 0.000 1.041 839 F HN -0.074 8.226 8.300 -0.000 0.000 0.512 840 T N -0.884 113.640 114.554 -0.049 0.000 2.990 840 T HA 0.099 4.450 4.350 0.001 0.000 0.250 840 T C 0.735 175.338 174.700 -0.160 0.000 1.041 840 T CA 0.028 61.966 62.100 -0.271 0.000 1.010 840 T CB -0.042 68.756 68.868 -0.117 0.000 1.003 840 T HN 0.190 8.430 8.240 -0.000 0.000 0.499 841 K N 0.511 120.889 120.400 -0.036 0.000 3.016 841 K HA -0.212 4.109 4.320 0.001 0.000 0.262 841 K C 0.802 177.387 176.600 -0.026 0.000 1.043 841 K CA 0.326 56.605 56.287 -0.013 0.000 0.761 841 K CB -1.728 30.763 32.500 -0.015 0.000 1.230 841 K HN 0.572 8.822 8.250 -0.000 0.000 0.485 842 G N 0.647 109.437 108.800 -0.018 0.000 2.180 842 G HA2 -0.385 3.575 3.960 0.001 0.000 0.263 842 G HA3 -0.385 3.575 3.960 0.001 0.000 0.263 842 G C -0.023 174.850 174.900 -0.045 0.000 0.989 842 G CA 0.403 45.493 45.100 -0.016 0.000 0.692 842 G HN 0.546 8.836 8.290 -0.000 0.000 0.526 843 N N 0.393 119.040 118.700 -0.089 0.000 2.429 843 N HA 0.116 4.857 4.740 0.001 0.000 0.271 843 N C 1.450 176.896 175.510 -0.106 0.000 1.272 843 N CA 0.560 53.544 53.050 -0.111 0.000 0.921 843 N CB 0.715 39.099 38.487 -0.170 0.000 1.128 843 N HN 0.479 8.859 8.380 -0.000 0.000 0.481 844 Q N 3.772 123.529 119.800 -0.072 0.000 2.050 844 Q HA -0.099 4.242 4.340 0.001 0.000 0.202 844 Q C 1.130 177.085 176.000 -0.076 0.000 0.980 844 Q CA 1.664 57.433 55.803 -0.057 0.000 0.840 844 Q CB 0.037 28.751 28.738 -0.039 0.000 0.898 844 Q HN 0.608 8.878 8.270 -0.000 0.000 0.424 845 N N -0.125 118.521 118.700 -0.090 0.000 2.069 845 N HA -0.157 4.583 4.740 0.001 0.000 0.191 845 N C 1.790 177.207 175.510 -0.156 0.000 1.031 845 N CA 1.415 54.404 53.050 -0.102 0.000 0.852 845 N CB -0.266 38.164 38.487 -0.095 0.000 1.018 845 N HN 0.324 8.704 8.380 -0.000 0.000 0.423 846 I N 0.543 120.977 120.570 -0.226 0.000 2.226 846 I HA -0.240 3.930 4.170 0.001 0.000 0.245 846 I C 1.849 177.767 176.117 -0.332 0.000 1.100 846 I CA 0.621 61.687 61.300 -0.389 0.000 1.374 846 I CB -0.050 37.600 38.000 -0.583 0.000 1.057 846 I HN 0.033 8.243 8.210 -0.000 0.000 0.413 847 L N 0.253 121.383 121.223 -0.154 0.000 2.046 847 L HA -0.203 4.137 4.340 0.001 0.000 0.208 847 L C 2.280 179.162 176.870 0.019 0.000 1.077 847 L CA 1.915 56.750 54.840 -0.009 0.000 0.747 847 L CB -0.621 41.439 42.059 0.002 0.000 0.896 847 L HN 0.162 8.392 8.230 -0.000 0.000 0.432 848 I N -1.214 119.338 120.570 -0.029 0.000 2.315 848 I HA -0.260 3.910 4.170 0.001 0.000 0.248 848 I C 2.494 178.600 176.117 -0.018 0.000 1.117 848 I CA 1.062 62.352 61.300 -0.016 0.000 1.404 848 I CB -0.390 37.592 38.000 -0.030 0.000 1.071 848 I HN 0.206 8.416 8.210 -0.000 0.000 0.419 849 A N 0.061 122.843 122.820 -0.064 0.000 1.898 849 A HA -0.222 4.099 4.320 0.001 0.000 0.216 849 A C 2.202 179.789 177.584 0.005 0.000 1.181 849 A CA 1.428 53.423 52.037 -0.070 0.000 0.620 849 A CB -0.852 18.061 19.000 -0.145 0.000 0.819 849 A HN 0.334 8.484 8.150 -0.000 0.000 0.442 850 Y N -0.168 120.107 120.300 -0.042 0.000 2.114 850 Y HA -0.160 4.391 4.550 0.000 0.000 0.284 850 Y C 2.636 178.507 175.900 -0.049 0.000 1.143 850 Y CA 1.460 59.544 58.100 -0.027 0.000 1.135 850 Y CB -0.592 37.900 38.460 0.052 0.000 0.980 850 Y HN 0.243 8.523 8.280 -0.000 0.000 0.499 851 R N 0.691 121.276 120.500 0.141 0.000 2.091 851 R HA -0.160 4.180 4.340 0.001 0.000 0.238 851 R C 1.356 177.657 176.300 0.001 0.000 1.136 851 R CA 1.902 58.032 56.100 0.051 0.000 0.959 851 R CB -0.454 29.870 30.300 0.040 0.000 0.856 851 R HN 0.364 8.634 8.270 -0.000 0.000 0.437 852 D N -0.393 120.006 120.400 -0.003 0.000 2.234 852 D HA -0.118 4.522 4.640 0.001 0.000 0.205 852 D C 1.908 178.175 176.300 -0.055 0.000 0.962 852 D CA 0.631 54.616 54.000 -0.026 0.000 0.855 852 D CB -0.157 40.632 40.800 -0.019 0.000 0.951 852 D HN 0.060 8.430 8.370 -0.000 0.000 0.500 853 R N 1.104 121.569 120.500 -0.060 0.000 2.115 853 R HA 0.034 4.375 4.340 0.001 0.000 0.226 853 R C 2.107 178.268 176.300 -0.232 0.000 1.100 853 R CA 0.740 56.767 56.100 -0.122 0.000 0.980 853 R CB -0.835 29.403 30.300 -0.103 0.000 0.875 853 R HN 0.176 8.446 8.270 -0.000 0.000 0.445 854 L N 0.211 121.325 121.223 -0.182 0.000 2.056 854 L HA -0.088 4.253 4.340 0.001 0.000 0.207 854 L C 2.309 179.060 176.870 -0.199 0.000 1.078 854 L CA 1.520 56.230 54.840 -0.217 0.000 0.749 854 L CB -0.404 41.569 42.059 -0.143 0.000 0.901 854 L HN 0.199 8.429 8.230 -0.000 0.000 0.433 855 K N 0.100 120.422 120.400 -0.130 0.000 2.097 855 K HA -0.157 4.163 4.320 0.001 0.000 0.206 855 K C 2.194 178.717 176.600 -0.128 0.000 1.049 855 K CA 1.359 57.586 56.287 -0.100 0.000 0.933 855 K CB -0.196 32.272 32.500 -0.054 0.000 0.717 855 K HN 0.271 8.521 8.250 -0.000 0.000 0.442 856 A N 1.700 124.427 122.820 -0.156 0.000 1.902 856 A HA -0.160 4.161 4.320 0.001 0.000 0.217 856 A C 2.123 179.466 177.584 -0.401 0.000 1.181 856 A CA 1.265 53.203 52.037 -0.165 0.000 0.623 856 A CB -0.580 18.382 19.000 -0.062 0.000 0.818 856 A HN 0.163 8.313 8.150 -0.000 0.000 0.443 857 I N -1.182 118.988 120.570 -0.667 0.000 2.127 857 I HA -0.300 3.870 4.170 0.001 0.000 0.241 857 I C 2.777 178.651 176.117 -0.405 0.000 1.075 857 I CA 1.642 62.453 61.300 -0.814 0.000 1.334 857 I CB -0.445 37.128 38.000 -0.712 0.000 1.040 857 I HN 0.339 8.549 8.210 -0.000 0.000 0.405 858 R N 0.878 121.224 120.500 -0.257 0.000 2.113 858 R HA -0.257 4.084 4.340 0.001 0.000 0.244 858 R C 2.306 178.554 176.300 -0.087 0.000 1.142 858 R CA 2.139 58.160 56.100 -0.132 0.000 0.953 858 R CB -0.459 29.796 30.300 -0.076 0.000 0.860 858 R HN 0.438 8.708 8.270 -0.000 0.000 0.438 859 A N -0.525 122.246 122.820 -0.082 0.000 2.019 859 A HA -0.114 4.206 4.320 0.001 0.000 0.219 859 A C 2.048 179.633 177.584 0.003 0.000 1.164 859 A CA 1.934 53.958 52.037 -0.022 0.000 0.644 859 A CB -0.388 18.607 19.000 -0.008 0.000 0.805 859 A HN 0.427 8.577 8.150 -0.000 0.000 0.449 860 T N -0.043 114.498 114.554 -0.021 0.000 2.978 860 T HA 0.097 4.447 4.350 0.001 0.000 0.262 860 T C 1.735 176.446 174.700 0.018 0.000 1.063 860 T CA 0.891 63.017 62.100 0.043 0.000 1.140 860 T CB -0.226 68.739 68.868 0.161 0.000 0.886 860 T HN 0.348 8.588 8.240 -0.000 0.000 0.470 861 L N 0.935 122.113 121.223 -0.075 0.000 2.046 861 L HA -0.061 4.279 4.340 0.001 0.000 0.208 861 L C 2.600 179.567 176.870 0.162 0.000 1.077 861 L CA 1.344 56.129 54.840 -0.091 0.000 0.747 861 L CB -0.560 41.234 42.059 -0.442 0.000 0.896 861 L HN 0.262 8.492 8.230 -0.000 0.000 0.432 862 E N 0.243 120.515 120.200 0.120 0.000 2.331 862 E HA -0.205 4.146 4.350 0.001 0.000 0.199 862 E C 1.491 178.171 176.600 0.135 0.000 1.008 862 E CA 1.214 57.702 56.400 0.146 0.000 0.843 862 E CB -0.026 29.730 29.700 0.093 0.000 0.761 862 E HN 0.695 9.055 8.360 -0.000 0.000 0.507 863 I N -3.281 117.361 120.570 0.120 0.000 3.947 863 I HA 0.238 4.409 4.170 0.001 0.000 0.327 863 I C 0.328 176.521 176.117 0.126 0.000 1.519 863 I CA -0.514 60.850 61.300 0.107 0.000 1.122 863 I CB 1.209 39.256 38.000 0.079 0.000 1.146 863 I HN -0.216 7.994 8.210 -0.000 0.000 0.442 864 S N 3.224 119.030 115.700 0.177 0.000 2.404 864 S HA 0.452 4.923 4.470 0.001 0.000 0.309 864 S C -1.244 173.495 174.600 0.232 0.000 1.076 864 S CA -1.375 56.947 58.200 0.203 0.000 1.095 864 S CB 0.712 64.052 63.200 0.234 0.000 0.972 864 S HN 0.108 8.418 8.310 -0.000 0.000 0.484 865 P HA -0.123 4.297 4.420 -0.000 0.000 0.218 865 P C 1.247 178.663 177.300 0.194 0.000 1.148 865 P CA 0.971 64.162 63.100 0.151 0.000 0.822 865 P CB -0.077 31.695 31.700 0.119 0.000 0.784 866 F N -0.146 119.850 119.950 0.076 0.000 2.102 866 F HA -0.191 4.336 4.527 0.000 0.000 0.298 866 F C 2.210 178.086 175.800 0.127 0.000 1.105 866 F CA 1.230 59.259 58.000 0.048 0.000 1.239 866 F CB -0.826 38.117 39.000 -0.096 0.000 0.991 866 F HN -0.248 8.052 8.300 -0.000 0.000 0.474 867 F N 2.583 122.678 119.950 0.242 0.000 2.134 867 F HA -0.179 4.348 4.527 0.000 0.000 0.299 867 F C 2.446 178.328 175.800 0.137 0.000 1.097 867 F CA 2.133 60.191 58.000 0.096 0.000 1.264 867 F CB -0.811 38.204 39.000 0.025 0.000 1.001 867 F HN 0.118 8.418 8.300 -0.000 0.000 0.479 868 K N -0.260 120.180 120.400 0.067 0.000 2.439 868 K HA -0.049 4.272 4.320 0.001 0.000 0.197 868 K C 1.280 177.831 176.600 -0.082 0.000 1.041 868 K CA 1.267 57.541 56.287 -0.022 0.000 0.970 868 K CB -1.030 31.496 32.500 0.044 0.000 0.773 868 K HN 0.426 8.676 8.250 -0.000 0.000 0.479 869 C N -0.172 119.092 119.300 -0.060 0.000 2.849 869 C HA 0.462 4.922 4.460 0.001 0.000 0.271 869 C C -0.615 174.244 174.990 -0.220 0.000 1.519 869 C CA -1.057 57.889 59.018 -0.119 0.000 1.783 869 C CB -1.691 25.994 27.740 -0.091 0.000 2.869 869 C HN 0.236 8.466 8.230 -0.000 0.000 0.527 870 H N 0.724 119.618 119.070 -0.293 0.000 2.600 870 H HA 0.492 5.048 4.556 0.001 0.000 0.357 870 H C -0.719 174.546 175.328 -0.106 0.000 1.106 870 H CA -0.087 55.791 56.048 -0.283 0.000 1.193 870 H CB 1.304 30.744 29.762 -0.536 0.000 1.594 870 H HN 0.441 8.721 8.280 -0.000 0.000 0.526 871 E N 3.166 123.368 120.200 0.004 0.000 2.052 871 E HA 0.208 4.558 4.350 0.001 0.000 0.283 871 E C -0.859 175.812 176.600 0.119 0.000 1.071 871 E CA -0.386 56.044 56.400 0.050 0.000 0.851 871 E CB 0.426 30.122 29.700 -0.005 0.000 1.066 871 E HN 0.305 8.665 8.360 -0.000 0.000 0.396 872 V N 7.403 127.417 119.914 0.168 0.000 2.284 872 V HA 0.218 4.338 4.120 0.001 0.000 0.260 872 V C -0.065 176.147 176.094 0.197 0.000 1.084 872 V CA -0.401 62.026 62.300 0.211 0.000 0.894 872 V CB 0.108 32.046 31.823 0.192 0.000 1.119 872 V HN 0.611 8.801 8.190 -0.000 0.000 0.484 873 I N 3.024 123.674 120.570 0.134 0.000 2.474 873 I HA 0.621 4.791 4.170 0.001 0.000 0.294 873 I C 1.109 177.261 176.117 0.058 0.000 1.005 873 I CA -0.002 61.335 61.300 0.061 0.000 1.113 873 I CB 1.209 39.196 38.000 -0.023 0.000 1.289 873 I HN 0.687 8.897 8.210 -0.000 0.000 0.436 874 G N 4.371 113.188 108.800 0.028 0.000 2.176 874 G HA2 -0.234 3.726 3.960 0.001 0.000 0.253 874 G HA3 -0.234 3.726 3.960 0.001 0.000 0.253 874 G C 0.289 175.176 174.900 -0.021 0.000 0.979 874 G CA 0.397 45.498 45.100 0.003 0.000 0.641 874 G HN 0.845 9.135 8.290 -0.000 0.000 0.530 875 S N -0.656 115.037 115.700 -0.011 0.000 2.652 875 S HA 0.842 5.312 4.470 0.001 0.000 0.270 875 S C 0.165 174.742 174.600 -0.039 0.000 1.243 875 S CA 0.508 58.638 58.200 -0.118 0.000 0.999 875 S CB 2.256 65.360 63.200 -0.160 0.000 0.973 875 S HN 0.788 9.098 8.310 -0.000 0.000 0.544 876 S N 0.397 116.047 115.700 -0.083 0.000 2.634 876 S HA 0.587 5.057 4.470 0.001 0.000 0.296 876 S C -0.908 173.684 174.600 -0.013 0.000 1.104 876 S CA -0.832 57.351 58.200 -0.028 0.000 0.920 876 S CB 0.936 64.118 63.200 -0.030 0.000 1.111 876 S HN 0.677 8.987 8.310 -0.000 0.000 0.493 877 L N 2.258 123.479 121.223 -0.004 0.000 2.272 877 L HA 0.525 4.866 4.340 0.001 0.000 0.289 877 L C -1.018 175.849 176.870 -0.005 0.000 1.032 877 L CA -0.651 54.154 54.840 -0.057 0.000 0.810 877 L CB 1.114 43.087 42.059 -0.143 0.000 1.205 877 L HN 0.401 8.631 8.230 -0.000 0.000 0.422 878 L N 4.498 125.694 121.223 -0.045 0.000 2.280 878 L HA 0.488 4.829 4.340 0.001 0.000 0.287 878 L C -0.922 175.942 176.870 -0.009 0.000 1.023 878 L CA 0.260 55.130 54.840 0.051 0.000 0.819 878 L CB 0.538 42.642 42.059 0.074 0.000 1.212 878 L HN 0.213 8.443 8.230 -0.000 0.000 0.420 879 F N 6.062 125.941 119.950 -0.117 0.000 2.408 879 F HA 0.577 5.105 4.527 0.001 0.000 0.344 879 F C 0.160 176.056 175.800 0.159 0.000 1.112 879 F CA -0.483 57.464 58.000 -0.088 0.000 1.096 879 F CB 0.986 39.722 39.000 -0.441 0.000 1.129 879 F HN 0.236 8.536 8.300 -0.000 0.000 0.486 880 I N 3.121 123.938 120.570 0.412 0.000 2.569 880 I HA 0.396 4.567 4.170 0.001 0.000 0.290 880 I C -0.978 175.127 176.117 -0.020 0.000 1.088 880 I CA -0.799 60.517 61.300 0.026 0.000 1.047 880 I CB 2.293 40.047 38.000 -0.409 0.000 1.237 880 I HN 0.697 8.907 8.210 -0.000 0.000 0.421 881 H N 2.330 121.298 119.070 -0.171 0.000 3.008 881 H HA 0.825 5.381 4.556 0.001 0.000 0.354 881 H C -1.946 173.348 175.328 -0.056 0.000 1.252 881 H CA -0.896 55.082 56.048 -0.116 0.000 1.117 881 H CB 1.765 31.397 29.762 -0.217 0.000 1.857 881 H HN 0.527 8.807 8.280 -0.000 0.000 0.547 882 D N -0.367 120.191 120.400 0.264 0.000 2.714 882 D HA 0.243 4.883 4.640 0.001 0.000 0.278 882 D C 0.543 176.941 176.300 0.162 0.000 1.102 882 D CA -1.156 52.948 54.000 0.173 0.000 1.108 882 D CB 1.109 42.057 40.800 0.247 0.000 1.444 882 D HN 0.552 8.922 8.370 -0.000 0.000 0.568 883 K N -0.899 119.557 120.400 0.093 0.000 2.152 883 K HA -0.099 4.221 4.320 0.001 0.000 0.206 883 K C 1.140 177.764 176.600 0.040 0.000 1.048 883 K CA 1.208 57.529 56.287 0.056 0.000 0.933 883 K CB -0.045 32.476 32.500 0.035 0.000 0.721 883 K HN 0.147 8.397 8.250 -0.000 0.000 0.447 884 K N 0.774 121.204 120.400 0.050 0.000 2.551 884 K HA -0.016 4.304 4.320 0.001 0.000 0.192 884 K C -0.433 176.175 176.600 0.014 0.000 1.027 884 K CA 0.451 56.751 56.287 0.022 0.000 1.059 884 K CB 0.080 32.587 32.500 0.012 0.000 0.831 884 K HN 0.148 8.398 8.250 -0.000 0.000 0.508 885 E N -0.287 119.929 120.200 0.027 0.000 2.722 885 E HA -0.280 4.070 4.350 0.001 0.000 0.265 885 E C -0.839 175.759 176.600 -0.004 0.000 1.081 885 E CA 0.332 56.721 56.400 -0.018 0.000 0.781 885 E CB -1.351 28.311 29.700 -0.062 0.000 1.372 885 E HN 0.471 8.831 8.360 -0.000 0.000 0.423 886 Q N -0.083 119.761 119.800 0.074 0.000 2.313 886 Q HA 0.444 4.785 4.340 0.001 0.000 0.266 886 Q C -0.268 175.903 176.000 0.285 0.000 0.989 886 Q CA 0.583 56.447 55.803 0.103 0.000 0.890 886 Q CB 1.281 30.006 28.738 -0.023 0.000 1.200 886 Q HN 0.310 8.580 8.270 -0.000 0.000 0.396 887 A N 3.360 126.270 122.820 0.149 0.000 2.408 887 A HA 0.678 4.998 4.320 0.001 0.000 0.295 887 A C -1.071 176.567 177.584 0.089 0.000 1.040 887 A CA -0.643 51.402 52.037 0.014 0.000 0.707 887 A CB 1.301 19.982 19.000 -0.532 0.000 1.235 887 A HN 0.664 8.814 8.150 -0.000 0.000 0.418 888 K N 0.178 120.744 120.400 0.276 0.000 2.499 888 K HA 0.818 5.139 4.320 0.001 0.000 0.277 888 K C -1.618 174.965 176.600 -0.028 0.000 1.025 888 K CA -0.693 55.600 56.287 0.010 0.000 0.900 888 K CB 2.792 35.109 32.500 -0.306 0.000 1.494 888 K HN 0.512 8.762 8.250 -0.000 0.000 0.442 889 V N 0.837 120.450 119.914 -0.502 0.000 2.777 889 V HA 0.491 4.611 4.120 0.001 0.000 0.306 889 V C -1.356 174.440 176.094 -0.497 0.000 1.112 889 V CA -0.981 61.006 62.300 -0.522 0.000 0.917 889 V CB 1.577 32.936 31.823 -0.774 0.000 1.018 889 V HN 0.651 8.841 8.190 -0.000 0.000 0.426 890 W N 3.087 124.306 121.300 -0.135 0.000 2.864 890 W HA 0.659 5.319 4.660 0.001 0.000 0.343 890 W C -0.453 176.038 176.519 -0.047 0.000 1.109 890 W CA -0.967 56.372 57.345 -0.010 0.000 1.192 890 W CB 2.322 31.816 29.460 0.057 0.000 1.426 890 W HN 0.439 8.619 8.180 -0.000 0.000 0.529 891 M N 3.104 122.868 119.600 0.274 0.000 2.211 891 M HA 0.370 4.850 4.480 0.001 0.000 0.356 891 M C -0.068 176.333 176.300 0.169 0.000 1.216 891 M CA 0.047 55.457 55.300 0.184 0.000 1.134 891 M CB 0.779 33.529 32.600 0.250 0.000 1.564 891 M HN 0.293 8.583 8.290 -0.000 0.000 0.463 892 I N -1.335 119.189 120.570 -0.077 0.000 3.095 892 I HA 0.707 4.878 4.170 0.001 0.000 0.310 892 I C -1.171 174.607 176.117 -0.564 0.000 1.196 892 I CA -1.011 60.181 61.300 -0.179 0.000 0.985 892 I CB 2.288 40.286 38.000 -0.005 0.000 1.250 892 I HN 0.668 8.878 8.210 -0.000 0.000 0.446 893 D N 2.486 122.622 120.400 -0.440 0.000 4.465 893 D HA -0.198 4.442 4.640 0.001 0.000 0.244 893 D C -1.086 174.873 176.300 -0.567 0.000 1.062 893 D CA 0.773 54.576 54.000 -0.328 0.000 1.227 893 D CB -0.677 40.039 40.800 -0.140 0.000 0.829 893 D HN 0.593 8.963 8.370 -0.000 0.000 0.402 894 F N 1.160 121.137 119.950 0.045 0.000 2.668 894 F HA 0.380 4.907 4.527 0.001 0.000 0.301 894 F C 2.301 178.120 175.800 0.032 0.000 1.106 894 F CA 0.024 58.054 58.000 0.050 0.000 1.289 894 F CB 0.541 39.565 39.000 0.039 0.000 1.006 894 F HN 0.397 8.697 8.300 -0.000 0.000 0.535 895 G N 0.825 109.681 108.800 0.094 0.000 2.545 895 G HA2 -0.281 3.680 3.960 0.001 0.000 0.222 895 G HA3 -0.281 3.680 3.960 0.001 0.000 0.222 895 G C 1.359 176.298 174.900 0.064 0.000 1.126 895 G CA 0.840 45.969 45.100 0.048 0.000 0.754 895 G HN 0.328 8.618 8.290 -0.000 0.000 0.583 896 K N 0.219 120.667 120.400 0.079 0.000 2.758 896 K HA 0.209 4.530 4.320 0.001 0.000 0.208 896 K C -0.609 176.062 176.600 0.118 0.000 1.091 896 K CA -0.133 56.201 56.287 0.079 0.000 1.059 896 K CB 1.099 33.629 32.500 0.051 0.000 0.801 896 K HN -0.007 8.243 8.250 -0.000 0.000 0.470 897 T N 2.161 116.832 114.554 0.195 0.000 2.743 897 T HA 0.191 4.542 4.350 0.001 0.000 0.292 897 T C -0.022 174.828 174.700 0.250 0.000 0.972 897 T CA -0.409 61.849 62.100 0.263 0.000 0.967 897 T CB 1.116 70.253 68.868 0.448 0.000 0.926 897 T HN 0.255 8.495 8.240 -0.000 0.000 0.459 898 T N 2.001 116.644 114.554 0.148 0.000 2.887 898 T HA 0.661 5.012 4.350 0.001 0.000 0.288 898 T C -3.043 171.512 174.700 -0.242 0.000 1.021 898 T CA -2.592 59.522 62.100 0.023 0.000 1.000 898 T CB 1.872 70.736 68.868 -0.007 0.000 1.034 898 T HN 0.159 8.399 8.240 -0.000 0.000 0.467 899 P HA 0.280 4.700 4.420 -0.000 0.000 0.275 899 P C -0.089 176.972 177.300 -0.400 0.000 1.227 899 P CA -0.569 62.031 63.100 -0.834 0.000 0.781 899 P CB 0.763 32.136 31.700 -0.545 0.000 0.906 900 L N 4.445 125.450 121.223 -0.364 0.000 2.474 900 L HA 0.223 4.564 4.340 0.001 0.000 0.259 900 L C -1.598 175.180 176.870 -0.154 0.000 1.232 900 L CA -1.778 52.941 54.840 -0.201 0.000 0.821 900 L CB -0.856 41.098 42.059 -0.175 0.000 1.108 900 L HN 0.261 8.491 8.230 -0.000 0.000 0.495 901 P HA -0.044 4.376 4.420 -0.000 0.000 0.267 901 P C -0.491 176.764 177.300 -0.074 0.000 1.201 901 P CA -0.032 63.023 63.100 -0.074 0.000 0.775 901 P CB 0.356 32.025 31.700 -0.051 0.000 0.854 902 E N 1.440 121.606 120.200 -0.057 0.000 2.415 902 E HA 0.115 4.465 4.350 0.001 0.000 0.262 902 E C 0.933 177.509 176.600 -0.039 0.000 1.038 902 E CA 0.825 57.197 56.400 -0.047 0.000 0.921 902 E CB -0.126 29.555 29.700 -0.031 0.000 0.950 902 E HN 0.768 9.128 8.360 -0.000 0.000 0.438 903 G N 3.040 111.820 108.800 -0.034 0.000 2.249 903 G HA2 -0.329 3.632 3.960 0.001 0.000 0.273 903 G HA3 -0.329 3.632 3.960 0.001 0.000 0.273 903 G C 0.024 174.903 174.900 -0.036 0.000 1.036 903 G CA 1.033 46.116 45.100 -0.028 0.000 0.824 903 G HN 0.548 8.838 8.290 -0.000 0.000 0.504 904 Q N -1.007 118.762 119.800 -0.052 0.000 2.421 904 Q HA 0.752 5.093 4.340 0.001 0.000 0.280 904 Q C -0.658 175.293 176.000 -0.083 0.000 1.085 904 Q CA -0.331 55.435 55.803 -0.062 0.000 0.807 904 Q CB 2.183 30.883 28.738 -0.063 0.000 1.405 904 Q HN 0.312 8.582 8.270 -0.000 0.000 0.419 905 T N 1.598 116.097 114.554 -0.091 0.000 2.883 905 T HA 0.681 5.032 4.350 0.001 0.000 0.296 905 T C -1.931 172.665 174.700 -0.175 0.000 1.117 905 T CA -0.442 61.586 62.100 -0.120 0.000 1.006 905 T CB 1.174 69.991 68.868 -0.085 0.000 1.191 905 T HN 0.400 8.640 8.240 -0.000 0.000 0.508 906 L N 3.121 124.173 121.223 -0.286 0.000 2.354 906 L HA 0.560 4.901 4.340 0.001 0.000 0.269 906 L C 1.051 177.628 176.870 -0.488 0.000 1.005 906 L CA -0.309 54.255 54.840 -0.459 0.000 0.819 906 L CB 2.088 43.672 42.059 -0.792 0.000 1.311 906 L HN 0.645 8.875 8.230 -0.000 0.000 0.423 907 Q N 0.931 120.528 119.800 -0.338 0.000 2.089 907 Q HA 0.023 4.363 4.340 0.001 0.000 0.195 907 Q C 0.375 176.345 176.000 -0.050 0.000 0.963 907 Q CA 1.431 57.145 55.803 -0.147 0.000 0.834 907 Q CB -0.005 28.704 28.738 -0.048 0.000 0.906 907 Q HN 0.845 9.115 8.270 -0.000 0.000 0.452 908 H N -0.842 118.232 119.070 0.008 0.000 4.059 908 H HA -0.131 4.425 4.556 0.001 0.000 0.139 908 H C -0.240 175.187 175.328 0.166 0.000 0.756 908 H CA 0.947 57.043 56.048 0.081 0.000 1.257 908 H CB -0.950 28.850 29.762 0.063 0.000 0.775 908 H HN 0.403 8.683 8.280 -0.000 0.000 0.511 909 D N 0.592 121.121 120.400 0.214 0.000 2.469 909 D HA 0.206 4.846 4.640 0.001 0.000 0.215 909 D C 0.626 176.996 176.300 0.117 0.000 1.154 909 D CA 0.587 54.689 54.000 0.171 0.000 0.832 909 D CB -0.069 40.820 40.800 0.148 0.000 1.008 909 D HN 0.306 8.676 8.370 -0.000 0.000 0.506 910 V N -2.919 117.056 119.914 0.102 0.000 2.850 910 V HA 0.741 4.861 4.120 0.001 0.000 0.315 910 V C -2.744 173.408 176.094 0.097 0.000 1.064 910 V CA -2.315 60.031 62.300 0.076 0.000 0.979 910 V CB 1.375 33.225 31.823 0.044 0.000 1.039 910 V HN -0.279 7.911 8.190 -0.000 0.000 0.452 911 P HA 0.133 4.553 4.420 -0.000 0.000 0.269 911 P C -1.150 176.237 177.300 0.146 0.000 1.209 911 P CA 0.167 63.330 63.100 0.104 0.000 0.776 911 P CB 0.248 31.981 31.700 0.054 0.000 0.876 912 W N 3.307 124.610 121.300 0.005 0.000 2.316 912 W HA 0.341 5.001 4.660 0.000 0.000 0.321 912 W C -0.843 175.683 176.519 0.011 0.000 1.203 912 W CA 0.061 57.407 57.345 0.003 0.000 1.214 912 W CB 0.817 30.275 29.460 -0.004 0.000 1.169 912 W HN 0.321 8.501 8.180 -0.000 0.000 0.561 913 Q N 4.138 123.352 119.800 -0.976 0.000 2.271 913 Q HA 0.086 4.426 4.340 0.001 0.000 0.268 913 Q C -1.098 174.219 176.000 -1.139 0.000 1.021 913 Q CA -1.176 53.981 55.803 -1.076 0.000 0.802 913 Q CB 2.360 30.830 28.738 -0.447 0.000 1.282 913 Q HN 0.591 8.861 8.270 -0.000 0.000 0.431 914 E N 0.436 119.963 120.200 -1.122 0.000 3.056 914 E HA -0.111 4.239 4.350 0.001 0.000 0.264 914 E C 0.949 177.493 176.600 -0.093 0.000 0.899 914 E CA 2.103 58.331 56.400 -0.287 0.000 0.966 914 E CB -0.009 29.604 29.700 -0.145 0.000 0.913 914 E HN 0.834 9.194 8.360 -0.000 0.000 0.522 915 G N 3.838 112.705 108.800 0.112 0.000 2.234 915 G HA2 -0.396 3.564 3.960 0.001 0.000 0.260 915 G HA3 -0.396 3.564 3.960 0.001 0.000 0.260 915 G C 0.790 175.726 174.900 0.060 0.000 0.987 915 G CA 0.652 45.796 45.100 0.074 0.000 0.625 915 G HN 0.734 9.024 8.290 -0.000 0.000 0.532 916 N N 0.538 119.273 118.700 0.057 0.000 2.353 916 N HA 0.075 4.816 4.740 0.001 0.000 0.185 916 N C 1.314 176.907 175.510 0.138 0.000 1.098 916 N CA 0.818 53.904 53.050 0.059 0.000 0.872 916 N CB -0.360 38.124 38.487 -0.005 0.000 0.970 916 N HN 0.638 9.018 8.380 -0.000 0.000 0.467 917 R N -1.014 119.647 120.500 0.270 0.000 4.024 917 R HA -0.135 4.206 4.340 0.001 0.000 0.391 917 R C -0.829 175.553 176.300 0.136 0.000 1.157 917 R CA 1.163 57.374 56.100 0.185 0.000 1.215 917 R CB -1.545 28.792 30.300 0.062 0.000 1.738 917 R HN 0.378 8.648 8.270 -0.000 0.000 0.566 918 E N 1.347 121.687 120.200 0.234 0.000 2.384 918 E HA -0.031 4.320 4.350 0.001 0.000 0.266 918 E C 0.741 177.416 176.600 0.126 0.000 1.012 918 E CA 0.598 57.082 56.400 0.139 0.000 0.901 918 E CB 0.631 30.422 29.700 0.152 0.000 0.967 918 E HN 0.231 8.591 8.360 -0.000 0.000 0.435 919 D N 0.941 121.414 120.400 0.121 0.000 2.389 919 D HA 0.100 4.740 4.640 0.001 0.000 0.206 919 D C 1.170 177.557 176.300 0.145 0.000 1.055 919 D CA 0.390 54.445 54.000 0.092 0.000 0.856 919 D CB 0.192 41.101 40.800 0.181 0.000 0.957 919 D HN 0.607 8.977 8.370 -0.000 0.000 0.509 920 G N 0.217 109.144 108.800 0.211 0.000 2.168 920 G HA2 -0.458 3.502 3.960 0.001 0.000 0.257 920 G HA3 -0.458 3.502 3.960 0.001 0.000 0.257 920 G C 0.596 175.634 174.900 0.230 0.000 0.997 920 G CA 0.587 45.803 45.100 0.193 0.000 0.708 920 G HN 0.421 8.711 8.290 -0.000 0.000 0.520 921 Y N 0.284 120.710 120.300 0.209 0.000 2.114 921 Y HA -0.091 4.460 4.550 0.001 0.000 0.282 921 Y C 2.679 178.687 175.900 0.180 0.000 1.165 921 Y CA 2.403 60.624 58.100 0.202 0.000 1.148 921 Y CB -0.164 38.465 38.460 0.281 0.000 0.972 921 Y HN 0.324 8.604 8.280 -0.000 0.000 0.504 922 L N -0.974 120.526 121.223 0.461 0.000 2.275 922 L HA -0.190 4.151 4.340 0.001 0.000 0.215 922 L C 2.381 179.343 176.870 0.153 0.000 1.119 922 L CA 1.052 56.074 54.840 0.303 0.000 0.790 922 L CB -0.502 41.760 42.059 0.338 0.000 0.919 922 L HN 0.158 8.388 8.230 -0.000 0.000 0.443 923 S N 0.203 115.992 115.700 0.147 0.000 2.355 923 S HA -0.109 4.361 4.470 0.001 0.000 0.222 923 S C 2.120 176.775 174.600 0.092 0.000 1.031 923 S CA 1.208 59.471 58.200 0.106 0.000 0.993 923 S CB -0.645 62.615 63.200 0.101 0.000 0.859 923 S HN 0.581 8.891 8.310 -0.000 0.000 0.453 924 G N 1.942 110.787 108.800 0.075 0.000 2.446 924 G HA2 -0.205 3.756 3.960 0.001 0.000 0.217 924 G HA3 -0.205 3.756 3.960 0.001 0.000 0.217 924 G C 1.409 176.331 174.900 0.037 0.000 1.168 924 G CA 1.044 46.222 45.100 0.130 0.000 0.771 924 G HN 0.400 8.690 8.290 -0.000 0.000 0.551 925 L N 0.928 122.093 121.223 -0.096 0.000 2.046 925 L HA -0.015 4.326 4.340 0.001 0.000 0.208 925 L C 2.201 179.049 176.870 -0.037 0.000 1.077 925 L CA 2.098 56.870 54.840 -0.113 0.000 0.747 925 L CB -0.460 41.535 42.059 -0.107 0.000 0.896 925 L HN 0.131 8.361 8.230 -0.000 0.000 0.432 926 D N -0.522 119.889 120.400 0.020 0.000 2.117 926 D HA -0.182 4.458 4.640 0.001 0.000 0.197 926 D C 1.841 178.166 176.300 0.042 0.000 0.987 926 D CA 1.147 55.166 54.000 0.032 0.000 0.829 926 D CB -0.296 40.534 40.800 0.051 0.000 0.961 926 D HN 0.424 8.794 8.370 -0.000 0.000 0.460 927 N N 0.624 119.374 118.700 0.083 0.000 2.084 927 N HA -0.112 4.628 4.740 0.001 0.000 0.190 927 N C 1.899 177.463 175.510 0.089 0.000 1.030 927 N CA 0.330 53.465 53.050 0.141 0.000 0.849 927 N CB -0.367 38.297 38.487 0.295 0.000 1.012 927 N HN 0.105 8.485 8.380 -0.000 0.000 0.423 928 L N 1.681 122.868 121.223 -0.060 0.000 2.043 928 L HA -0.084 4.256 4.340 0.001 0.000 0.212 928 L C 2.164 179.016 176.870 -0.030 0.000 1.075 928 L CA 1.154 55.883 54.840 -0.185 0.000 0.752 928 L CB -0.904 40.962 42.059 -0.321 0.000 0.891 928 L HN 0.172 8.402 8.230 -0.000 0.000 0.432 929 I N -0.986 119.572 120.570 -0.020 0.000 2.252 929 I HA -0.257 3.914 4.170 0.001 0.000 0.245 929 I C 2.056 178.188 176.117 0.025 0.000 1.102 929 I CA 0.941 62.242 61.300 0.000 0.000 1.385 929 I CB -0.434 37.559 38.000 -0.011 0.000 1.064 929 I HN 0.218 8.428 8.210 -0.000 0.000 0.414 930 D N 1.316 121.737 120.400 0.034 0.000 2.104 930 D HA -0.171 4.470 4.640 0.001 0.000 0.194 930 D C 2.254 178.584 176.300 0.050 0.000 0.994 930 D CA 1.489 55.514 54.000 0.040 0.000 0.830 930 D CB -0.310 40.516 40.800 0.045 0.000 0.959 930 D HN 0.328 8.698 8.370 -0.000 0.000 0.452 931 I N 0.588 121.199 120.570 0.068 0.000 2.127 931 I HA -0.247 3.923 4.170 0.001 0.000 0.241 931 I C 2.479 178.661 176.117 0.108 0.000 1.075 931 I CA 0.846 62.196 61.300 0.084 0.000 1.334 931 I CB -0.191 37.868 38.000 0.099 0.000 1.040 931 I HN -0.027 8.183 8.210 -0.000 0.000 0.405 932 L N -0.106 121.186 121.223 0.114 0.000 2.275 932 L HA -0.156 4.184 4.340 0.001 0.000 0.215 932 L C 2.484 179.394 176.870 0.067 0.000 1.119 932 L CA 1.161 56.063 54.840 0.103 0.000 0.790 932 L CB -0.653 41.451 42.059 0.074 0.000 0.919 932 L HN 0.316 8.546 8.230 -0.000 0.000 0.443 933 T N -1.303 113.280 114.554 0.049 0.000 2.809 933 T HA -0.190 4.160 4.350 0.001 0.000 0.260 933 T C 1.730 176.449 174.700 0.033 0.000 1.039 933 T CA 1.027 63.147 62.100 0.034 0.000 1.141 933 T CB -0.034 68.849 68.868 0.025 0.000 0.869 933 T HN 0.327 8.567 8.240 -0.000 0.000 0.437 934 E N 0.801 121.022 120.200 0.036 0.000 2.097 934 E HA -0.163 4.188 4.350 0.001 0.000 0.196 934 E C 2.133 178.753 176.600 0.034 0.000 1.000 934 E CA 1.189 57.608 56.400 0.031 0.000 0.804 934 E CB -0.168 29.551 29.700 0.031 0.000 0.740 934 E HN 0.451 8.811 8.360 -0.000 0.000 0.454 935 M N 0.222 119.851 119.600 0.049 0.000 2.296 935 M HA -0.103 4.377 4.480 0.001 0.000 0.265 935 M C 2.287 178.609 176.300 0.036 0.000 1.064 935 M CA 1.452 56.783 55.300 0.052 0.000 1.109 935 M CB 0.101 32.754 32.600 0.088 0.000 1.396 935 M HN 0.128 8.418 8.290 -0.000 0.000 0.430 936 S N -1.202 114.517 115.700 0.032 0.000 2.558 936 S HA 0.009 4.480 4.470 0.001 0.000 0.217 936 S C 1.520 176.125 174.600 0.009 0.000 0.975 936 S CA 0.153 58.363 58.200 0.017 0.000 0.912 936 S CB 0.073 63.283 63.200 0.016 0.000 0.776 936 S HN 0.336 8.646 8.310 -0.000 0.000 0.526 937 Q N 2.165 121.973 119.800 0.013 0.000 1.967 937 Q HA 0.356 4.697 4.340 0.001 0.000 0.196 937 Q C 1.441 177.445 176.000 0.007 0.000 0.978 937 Q CA 1.343 57.151 55.803 0.008 0.000 0.833 937 Q CB -1.058 27.686 28.738 0.010 0.000 0.898 937 Q HN 0.640 8.910 8.270 -0.000 0.000 0.446 938 G N 0.000 108.806 108.800 0.010 0.000 5.446 938 G HA2 0.000 3.960 3.960 0.001 0.000 0.244 938 G HA3 0.000 3.960 3.960 0.001 0.000 0.244 938 G CA 0.000 45.105 45.100 0.009 0.000 0.502 938 G HN 0.000 8.290 8.290 -0.000 0.000 0.925