NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 806 D 4.5394 8.2233 120.1852 53.8400 42.2589 176.2549 807 L 4.5082 8.6218 124.5697 54.7825 42.0218 176.2657 808 H 4.5720 9.7713 115.7737 56.9872 30.3181 176.3663 809 T 4.5507 8.0382 116.9746 64.1954 70.3178 174.4596 810 L 5.0691 7.6575 122.0978 53.4225 46.1014 174.0140 811 N 4.9920 9.5130 124.5896 51.0314 41.2920 174.3340 812 W 4.5044 9.2287 135.0000 60.9868 30.7818 177.2895 813 D 4.1704 8.2682 118.1700 57.0453 40.1753 178.6100 814 L 3.8313 7.9178 120.4427 58.2203 42.1265 178.2001 815 C 4.0730 7.8676 118.6284 62.5903 31.3876 175.6267 816 L 3.6346 7.3076 120.2587 57.8789 41.2338 179.6548 817 T 3.7898 7.6718 115.6056 66.8072 68.2278 176.8347 818 Q 4.0905 8.0565 118.0000 57.7956 28.5317 177.6257 819 A 4.6566 7.6643 122.7130 51.1551 19.2650 176.9027 820 N 3.7841 8.8818 115.9786 54.9341 35.5569 179.7487 *821 H 4.0164 8.7506 115.0650 56.6083 26.2974 178.3102 822 K 4.4724 7.4816 125.6158 56.4213 32.3752 181.2279 823 S 4.4418 8.5605 120.0703 60.7842 62.6659 175.8240 824 N 4.4293 8.1983 118.7195 55.8827 38.0670 177.0201 825 L 3.9322 7.9234 120.5469 58.1979 42.3765 178.4238 826 A 4.1645 7.5238 119.1993 54.9890 18.5845 178.9237 827 L 4.3071 8.5769 119.2313 58.2516 41.9991 180.4369 828 E 3.9136 7.9714 117.1587 56.3072 29.8855 177.5635 *830 L 4.4228 8.1021 121.3718 55.0692 43.7917 180.7210 831 K 4.1380 7.9335 116.7041 55.2555 31.4504 180.3153 *833 L 4.2651 8.0690 122.5730 56.0349 43.9638 178.4104 834 L 3.9597 8.4978 120.0552 58.5126 41.6893 178.5784 835 D 4.3932 8.1544 116.6856 57.0717 41.4263 177.7854 836 S 4.3645 7.9458 113.6843 60.1393 63.2519 176.4781 837 L 3.9652 7.5970 122.9759 57.4019 41.4314 177.2530 838 P 4.2379 0.0000 0.0000 65.8518 31.2198 178.5419 839 E 4.0042 8.1107 116.6722 59.6729 29.3691 179.3685 840 T 3.8609 8.0907 115.8776 66.5158 68.4912 176.8422 841 V 3.5693 8.4481 120.5116 66.0124 31.4962 177.6674 842 E 3.9742 8.2973 118.9978 59.1981 29.4703 178.9715 843 K 3.9783 8.3699 118.7778 59.4412 32.1370 179.3417 844 I 3.6943 8.0389 120.3754 64.3939 37.0516 178.2009 845 Q 3.9570 8.4820 120.6089 59.6600 28.9171 178.5457 846 T 3.8673 8.2886 116.8386 66.6161 68.3921 176.6309 847 A 4.0354 8.1711 122.7124 54.7530 18.3868 179.4953 848 L 3.9674 8.1751 119.2317 58.4189 42.0232 179.5193 849 G 3.6745 7.9188 104.2248 47.3224 0.0000 174.6274 850 Q 4.3766 7.8925 117.1975 54.5245 29.3317 175.1544 851 N 4.1213 7.7477 116.3212 54.2629 36.4588 175.0373 852 D 4.6545 8.0686 119.3697 52.7821 39.9911 176.2856 853 Q 4.0601 8.3429 123.3210 58.4387 29.7169 178.5189 854 A 4.1251 7.7538 118.7791 55.6640 18.6705 181.7644 855 T 4.0220 8.0127 112.5041 63.6349 67.9567 176.7321 *857 L 4.2514 8.1868 124.3243 55.1670 44.0137 178.7795 858 S 4.2061 7.9402 113.5224 61.7089 62.7620 176.6412 859 T 3.8931 8.0679 119.2832 66.4513 68.2729 176.8651 860 I 3.7050 7.7155 121.2267 64.5626 37.1365 177.5842 861 H 4.4154 8.5381 120.8126 58.7516 29.7351 177.4361 862 K 3.9684 8.2069 120.0371 59.3113 31.8143 179.1822 863 L 3.9760 8.1364 120.7586 58.2318 41.8650 178.3687 864 H 4.2718 8.7888 118.7727 59.3463 29.6034 177.0945 865 G 3.7885 7.9372 105.8662 47.9752 0.0000 174.9955 866 A 4.2799 7.9848 123.1578 54.9852 17.9717 179.8354 867 S 4.1140 8.4672 113.0271 61.8707 62.6183 176.2672 868 C 4.2042 7.7999 118.8911 61.4761 27.7514 173.7711 869 Y 4.7333 7.9284 116.3514 57.8108 38.3988 175.6187 870 C 4.7252 8.0893 115.4991 58.4447 29.5542 174.1866 871 G 4.0617 8.6215 108.9792 47.3532 0.0000 174.9527 872 V 5.0259 6.9444 110.0151 57.0921 32.4507 175.0352 873 P 4.2542 0.0000 0.0000 65.8068 31.6045 178.0389 874 T 3.8822 7.9280 114.4189 66.7590 68.2659 176.9328 875 T 3.8513 7.8621 117.1960 66.7236 68.5876 176.1377 876 Q 4.0197 8.1133 122.6907 58.6140 28.9624 178.4648 877 R 3.8629 7.9832 119.6413 59.3715 30.0748 178.4401 878 L 4.1114 7.9730 118.7985 58.0405 41.6196 179.2287 879 C 4.0352 8.2346 116.8181 62.8347 27.9914 176.0082 880 Q 3.8362 7.9541 120.9962 59.1578 28.6949 178.1923 881 E 3.9449 8.3890 119.8550 59.3968 29.4284 179.5152 882 I 3.6951 8.0017 120.0783 64.2285 36.8555 177.9974 883 E 3.9187 8.6509 120.4136 59.4824 29.2747 178.7987 884 S 4.1424 7.9775 113.5125 61.7928 63.2482 176.4660 885 A 4.1374 7.9460 123.0134 55.0935 18.0986 179.5901 886 L 3.9605 8.2968 117.9369 57.9756 41.5396 179.8102 887 K 4.1584 8.1524 116.5698 58.2688 30.6372 178.4193 888 R 4.4613 7.7961 118.0324 54.9363 30.0918 176.2595 889 Q 3.6064 8.0582 116.1076 57.0475 26.8567 174.0747 890 T 4.0205 7.2083 112.8940 62.5899 69.2833 173.1588 891 P 4.2625 0.0000 0.0000 62.9309 32.2453 177.2658 892 V 3.5966 8.6518 121.7201 66.4012 31.2653 177.9815 893 E 3.9811 8.1366 118.2821 59.1931 29.3242 177.9889 894 D 4.5666 7.8070 117.0690 55.8626 41.1854 177.4142 895 L 4.6586 7.6143 120.3655 53.6068 41.7059 177.4540 896 E 3.8881 7.7577 121.9205 59.2682 29.4295 177.3914 897 P 4.2342 0.0000 0.0000 65.6979 31.0959 178.5257 898 E 4.2621 7.9989 118.2495 58.8302 29.3412 179.3086 899 I 3.7701 8.0313 120.1305 64.3623 37.1233 178.4806 900 L 3.9768 8.2248 120.1073 57.8903 40.9701 179.3323 901 E 3.9416 8.3266 118.5388 59.3101 29.2528 179.3396 902 L 3.9664 8.0658 120.4274 58.0901 42.0163 178.9102 903 L 3.9608 8.1411 119.2118 57.7868 41.2284 178.9117 904 D 4.3529 8.2751 118.0273 57.5469 41.0530 178.1135 905 E 4.0507 8.2906 119.7138 59.2141 29.5705 178.7261 906 L 4.0569 8.3309 119.3416 57.7016 41.6312 179.5947 907 T 4.0460 7.6642 116.0340 66.5825 68.3681 176.8092 908 K 3.9821 7.7259 119.1082 59.2811 32.0507 179.3846 909 V 3.6009 8.1701 118.9767 66.1950 31.4196 177.7214 910 E 3.9521 8.3152 118.1728 59.6045 29.3345 179.4138 911 S 4.0616 8.0345 112.5353 61.3228 62.4542 176.0488 912 A 3.9654 8.1350 123.4738 55.0996 18.0777 179.7891 913 V 3.5176 8.2320 117.1191 66.2236 31.4515 178.1916 914 K 3.9360 8.0341 119.2586 60.2970 32.0137 179.6892 915 Q 4.1142 7.9896 120.7532 60.2886 28.1198 181.1173 916 V 3.9254 7.7649 122.0977 65.1505 31.3152 178.0947 917 L 3.9815 8.0338 117.9974 57.3227 41.4701 179.1174 918 S 4.2555 7.5766 114.0590 60.2803 63.1668 174.1678 919 Q 4.1372 7.8143 125.7953 55.8485 28.6900 175.2745 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ 806 D 8.22 4.54 0.00 2.59 2.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 807 L 8.62 4.51 0.00 1.76 1.73 0.94 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 808 H 9.77 4.57 0.00 3.26 3.55 0.00 5.26 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 809 T 8.04 4.55 4.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 810 L 7.66 5.07 0.00 1.75 1.48 1.11 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 811 N 9.51 4.99 0.00 2.92 2.65 0.00 0.00 6.50 7.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 812 W 9.23 4.50 0.00 3.39 3.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 813 D 8.27 4.17 0.00 2.90 2.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 814 L 7.92 3.83 0.00 1.75 1.79 0.88 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 815 C 7.87 4.07 0.00 3.00 2.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 816 L 7.31 3.63 0.00 1.60 1.45 0.70 0.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.29 0.00 0.00 0.00 0.00 0.00 0.00 817 T 7.67 3.79 4.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 818 Q 8.06 4.09 0.00 2.15 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 7.02 0.00 0.00 0.00 0.00 0.00 2.25 2.38 0.00 819 A 7.66 4.66 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 820 N 8.88 3.78 0.00 2.92 2.75 0.00 0.00 6.85 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *821 H 8.75 4.02 0.00 3.05 3.10 0.00 7.16 0.00 0.00 0.00 0.00 5.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 822 K 7.48 4.47 0.00 1.76 1.74 0.00 1.78 0.00 0.00 1.57 0.00 0.00 2.87 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.32 1.30 7.81 823 S 8.56 4.44 0.00 4.02 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 824 N 8.20 4.43 0.00 2.84 2.89 0.00 0.00 6.72 6.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 825 L 7.92 3.93 0.00 1.65 1.81 0.90 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 826 A 7.52 4.16 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 827 L 8.58 4.31 0.00 2.15 1.94 0.92 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 828 E 7.97 3.91 0.00 2.09 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.41 0.00 *830 L 8.10 4.42 0.00 2.06 1.82 1.23 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.39 0.00 0.00 0.00 0.00 0.00 0.00 831 K 7.93 4.14 0.00 1.70 1.78 0.00 1.84 0.00 0.00 1.57 0.00 0.00 2.83 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.37 1.26 7.81 *833 L 8.07 4.27 0.00 1.78 1.93 0.95 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 834 L 8.50 3.96 0.00 1.83 1.81 0.93 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 835 D 8.15 4.39 0.00 2.79 2.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 836 S 7.95 4.36 0.00 4.13 4.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 837 L 7.60 3.97 0.00 1.89 1.93 0.94 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 838 P 0.00 4.24 0.00 2.16 2.11 0.00 3.77 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.19 0.00 839 E 8.11 4.00 0.00 1.98 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.40 2.35 0.00 840 T 8.09 3.86 4.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 841 V 8.45 3.57 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.00 0.00 0.95 0.00 0.00 842 E 8.30 3.97 0.00 2.23 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.40 0.00 843 K 8.37 3.98 0.00 2.05 1.85 0.00 1.73 0.00 0.00 1.66 0.00 0.00 2.95 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.47 1.49 7.81 844 I 8.04 3.69 2.01 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.84 0.91 0.00 0.00 845 Q 8.48 3.96 0.00 2.18 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.81 0.00 0.00 0.00 0.00 0.00 2.36 2.45 0.00 846 T 8.29 3.87 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 847 A 8.17 4.04 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 848 L 8.18 3.97 0.00 1.88 1.89 0.95 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 849 G 7.92 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 850 Q 7.89 4.38 0.00 2.06 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.71 0.00 0.00 0.00 0.00 0.00 2.34 2.46 0.00 851 N 7.75 4.12 0.00 2.88 2.88 0.00 0.00 6.82 7.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 852 D 8.07 4.65 0.00 2.66 2.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 853 Q 8.34 4.06 0.00 2.20 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.83 0.00 0.00 0.00 0.00 0.00 2.33 2.30 0.00 854 A 7.75 4.13 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 855 T 8.01 4.02 4.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 *857 L 8.19 4.25 0.00 1.83 1.86 0.94 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 858 S 7.94 4.21 0.00 4.14 4.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 859 T 8.07 3.89 4.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 860 I 7.72 3.70 1.90 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.82 0.92 0.00 0.00 861 H 8.54 4.42 0.00 3.25 3.53 0.00 5.63 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 862 K 8.21 3.97 0.00 2.10 1.86 0.00 1.75 0.00 0.00 1.60 0.00 0.00 2.93 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.49 1.60 7.81 863 L 8.14 3.98 0.00 1.78 1.83 0.94 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 864 H 8.79 4.27 0.00 3.32 3.42 0.00 5.68 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 865 G 7.94 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 866 A 7.98 4.28 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 867 S 8.47 4.11 0.00 4.06 4.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 868 C 7.80 4.20 0.00 2.76 2.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 869 Y 7.93 4.73 0.00 2.92 2.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 870 C 8.09 4.73 0.00 2.97 2.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 871 G 8.62 4.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 872 V 6.94 5.03 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.96 0.00 0.00 873 P 0.00 4.25 0.00 2.17 2.11 0.00 3.69 0.00 0.00 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.19 0.00 874 T 7.93 3.88 4.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 875 T 7.86 3.85 4.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 876 Q 8.11 4.02 0.00 2.22 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.82 0.00 0.00 0.00 0.00 0.00 2.38 2.28 0.00 877 R 7.98 3.86 0.00 2.02 1.88 0.00 3.13 0.00 0.00 3.15 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.65 0.00 878 L 7.97 4.11 0.00 1.72 1.68 0.93 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 879 C 8.23 4.04 0.00 2.94 2.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 880 Q 7.95 3.84 0.00 2.07 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.81 0.00 0.00 0.00 0.00 0.00 2.37 2.56 0.00 881 E 8.39 3.94 0.00 2.16 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.40 0.00 882 I 8.00 3.70 1.86 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.75 0.91 0.00 0.00 883 E 8.65 3.92 0.00 2.03 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.36 2.40 0.00 884 S 7.98 4.14 0.00 4.11 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 885 A 7.95 4.14 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 886 L 8.30 3.96 0.00 1.83 1.74 0.93 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 887 K 8.15 4.16 0.00 1.86 1.88 0.00 1.71 0.00 0.00 1.72 0.00 0.00 3.03 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.48 1.49 7.81 888 R 7.80 4.46 0.00 1.98 1.92 0.00 3.28 0.00 0.00 3.17 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.84 0.00 889 Q 8.06 3.61 0.00 2.18 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.40 6.82 0.00 0.00 0.00 0.00 0.00 2.30 2.35 0.00 890 T 7.21 4.02 4.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 891 P 0.00 4.26 0.00 2.26 1.99 0.00 3.61 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 2.09 0.00 892 V 8.65 3.60 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.00 0.00 0.93 0.00 0.00 893 E 8.14 3.98 0.00 2.27 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.38 2.40 0.00 894 D 7.81 4.57 0.00 2.89 2.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 895 L 7.61 4.66 0.00 1.83 1.67 0.92 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 896 E 7.76 3.89 0.00 2.17 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.43 0.00 897 P 0.00 4.23 0.00 2.19 2.07 0.00 3.68 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.17 0.00 898 E 8.00 4.26 0.00 2.18 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.39 2.31 0.00 899 I 8.03 3.77 1.87 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.69 0.91 0.00 0.00 900 L 8.22 3.98 0.00 1.82 1.71 nan 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 901 E 8.33 3.94 0.00 2.20 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.48 0.00 902 L 8.07 3.97 0.00 1.83 1.85 0.92 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 903 L 8.14 3.96 0.00 1.84 1.71 0.92 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 904 D 8.28 4.35 0.00 2.83 2.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 905 E 8.29 4.05 0.00 2.24 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.41 0.00 906 L 8.33 4.06 0.00 1.72 1.71 0.93 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 907 T 7.66 4.05 4.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 908 K 7.73 3.98 0.00 2.04 1.87 0.00 1.70 0.00 0.00 1.60 0.00 0.00 2.91 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.47 1.46 7.81 909 V 8.17 3.60 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.00 0.00 0.99 0.00 0.00 910 E 8.32 3.95 0.00 2.22 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.52 0.00 911 S 8.03 4.06 0.00 3.92 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 912 A 8.13 3.97 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 913 V 8.23 3.52 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.00 0.00 0.99 0.00 0.00 914 K 8.03 3.94 0.00 1.92 1.86 0.00 1.75 0.00 0.00 1.74 0.00 0.00 3.05 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.48 1.67 7.81 915 Q 7.99 4.11 0.00 2.08 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.81 0.00 0.00 0.00 0.00 0.00 2.29 2.23 0.00 916 V 7.76 3.93 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.63 0.00 0.00 0.93 0.00 0.00 917 L 8.03 3.98 0.00 1.61 1.67 0.91 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 918 S 7.58 4.26 0.00 3.94 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 919 Q 7.81 4.14 0.00 2.09 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.58 6.55 0.00 0.00 0.00 0.00 0.00 2.24 2.21 0.00 * Residues marked with a * may have inaccurate shift predictions.