NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 774 T 5.0854 8.3998 110.8711 62.0610 70.1595 172.5390 775 K 4.3847 8.0223 122.0540 54.4167 35.6226 170.5522 776 E 5.3256 8.6240 117.7677 54.7708 33.6121 175.5749 777 G 4.3553 8.6066 107.8597 46.6977 0.0000 171.3886 778 M 5.2754 8.9843 120.0506 54.8030 33.7081 175.0181 779 L 4.9396 9.0073 123.9108 54.1804 47.1581 174.1977 780 H 5.7790 8.8383 115.4313 55.0566 33.4030 172.7432 781 Y 5.6494 8.3649 116.3463 56.7583 40.6936 175.8328 782 K 2.8334 7.3859 124.6643 58.3768 32.7540 176.8249 783 A 3.8322 7.9296 121.7753 52.2911 19.3235 176.3592 784 G 3.9914 8.5060 107.3620 46.6223 0.0000 174.7360 *785 T 4.1258 7.2374 110.2372 61.4916 71.3366 173.5694 *786 S 4.4631 8.4129 128.1413 56.6766 70.0800 180.2776 *787 Y 3.6316 7.9379 123.9435 57.3311 34.3948 172.5984 *788 L 4.2179 8.6231 114.8631 58.5584 41.5335 174.4762 789 G 3.6631 8.0324 106.4018 47.5970 0.0000 173.7993 *790 K 3.9965 9.2605 129.8277 55.8728 28.9659 172.6118 *791 E 4.5816 8.0837 120.0746 54.3151 31.2115 173.7848 792 H 4.9382 8.2705 117.3704 54.4651 30.4204 175.4659 793 W 4.4364 8.6661 123.0012 55.3251 29.3156 175.8829 794 K 4.2698 7.6893 126.0637 55.7396 33.0910 176.4862 795 T 4.8803 8.2838 116.1052 62.0709 70.3675 172.6202 796 C 5.2591 9.2307 116.3464 58.3199 33.9438 172.0824 797 F 5.4212 9.7481 121.7715 56.4477 41.6356 173.9298 798 V 4.7470 8.7666 125.7005 60.9910 34.7288 174.2969 799 V 4.7978 8.6642 125.9209 61.2743 35.2197 173.8549 800 L 5.1780 9.3700 130.5481 53.2458 43.1380 173.4049 801 S 5.0735 9.0934 119.5105 55.8805 64.9451 172.1523 802 N 4.3410 9.2902 126.0009 55.2272 37.3058 174.4641 803 G 4.1971 8.8647 102.3925 45.6564 0.0000 170.4211 804 I 4.6316 7.9473 121.4847 59.1093 40.0306 174.2854 805 L 5.0936 8.3216 127.6614 53.5258 44.4489 174.5939 806 Y 4.9966 9.5252 124.0145 56.1224 41.3207 174.4319 807 Q 4.7889 8.7757 123.8061 54.4699 32.2460 173.7488 808 Y 5.2784 8.9718 123.7309 55.3710 41.2253 175.2350 809 P 4.7518 0.0000 0.0000 65.4303 31.8913 175.3458 810 D 4.7527 7.7479 116.2854 52.8457 41.5362 174.8736 811 R 3.9052 8.3961 115.3067 56.4301 29.0371 176.7095 812 T 4.4768 8.1408 106.7070 61.2326 70.1390 175.0426 813 D 4.0078 8.2953 122.0946 55.2152 41.4644 176.5289 814 V 2.6241 6.7663 113.2565 62.9439 31.9131 173.0796 815 I 4.2765 8.5925 121.0760 58.4333 37.1072 172.3337 816 P 3.9991 0.0000 0.0000 61.9174 31.2931 176.1079 817 L 4.2047 9.0336 126.4598 57.5944 42.8923 176.6944 818 L 4.4524 7.2302 118.2916 53.8278 45.6027 173.9199 819 S 4.8574 8.4544 119.3372 56.6026 65.2852 173.1794 820 V 4.2747 8.5405 120.3597 59.5079 35.2774 174.7182 821 N 4.8409 8.6248 124.0909 52.3786 38.7734 173.7525 822 M 4.2901 8.0588 124.5419 56.4126 32.6386 177.5483 823 G 3.9291 9.0645 111.0673 45.0220 0.0000 173.3634 824 G 3.8073 7.7374 111.3146 44.4983 0.0000 174.5717 *825 E 4.1894 8.3329 111.5995 55.8995 31.4298 172.0439 826 Q 4.3853 8.1130 118.1372 55.3120 31.4842 173.4821 827 C 5.1209 8.1770 120.2082 57.5887 33.2253 173.7201 828 G 3.8795 10.3048 112.6726 46.0798 0.0000 173.3371 829 G 4.1441 7.0113 106.5477 44.0479 0.0000 171.7793 830 C 5.6849 8.2766 116.1596 57.9321 32.3393 173.9624 831 R 4.7720 8.3819 116.8373 54.9385 32.6663 174.1899 832 R 4.6393 8.6435 118.9763 56.3710 30.9939 176.3308 833 A 4.7442 8.7104 125.6126 50.2115 21.3264 176.1283 834 N 4.7022 8.4809 116.9972 52.5181 39.4838 175.0569 835 T 3.7082 8.7392 118.3228 63.6281 67.3195 175.5665 836 T 3.3170 9.1297 114.7729 64.8625 68.1266 173.8022 837 D 4.2202 7.9938 115.7232 54.9129 38.1734 173.4478 838 R 4.4336 7.2727 115.2098 54.2447 30.1977 173.0075 839 P 4.0525 0.0000 0.0000 65.2936 32.2262 176.5166 840 H 4.0903 8.4977 115.0946 57.0994 26.0831 173.9263 841 A 5.3251 7.8446 120.0865 50.9428 21.0550 177.2010 842 F 5.6106 8.5593 115.5351 55.6646 42.2402 173.1206 843 Q 5.0370 9.3028 116.5863 54.4817 32.6430 174.4353 844 V 4.5439 8.1773 120.6671 61.0489 33.5569 174.8336 845 I 4.2523 8.5660 130.2665 61.4078 38.0286 175.4623 846 L 5.2557 8.2566 125.4687 52.7538 45.1061 176.4921 847 S 4.1463 8.5652 118.5418 59.2912 64.0361 174.2151 848 D 4.7661 8.7084 122.3707 54.5235 38.5296 173.4688 849 R 4.4104 7.3813 110.5779 54.3523 32.2227 172.4618 850 P 4.1531 0.0000 0.0000 63.4701 31.3413 175.7632 851 C 4.4235 8.3804 115.8745 58.2328 31.0816 172.6937 852 L 4.2281 8.4629 122.4545 54.0342 42.8268 175.4429 853 E 4.3295 8.5490 127.4446 55.6301 30.6073 175.8353 854 L 5.4847 8.3553 124.7866 52.4307 45.5561 175.7634 855 S 4.9865 8.2527 113.5881 57.4754 65.8543 173.4629 856 A 5.1979 8.7890 129.9124 50.8850 20.8395 175.8389 857 E 4.3822 8.4067 113.7508 56.9712 30.8146 176.0261 858 S 4.3742 7.3921 112.7260 55.1838 66.6493 174.3540 859 E 4.0518 8.5779 120.5617 58.9525 29.1735 178.8491 860 A 3.9372 7.8172 120.6694 54.9965 18.7100 178.7486 861 E 3.8614 7.9167 117.7466 59.7261 29.7046 178.9158 862 M 4.1213 7.9634 116.5748 58.5827 31.2617 178.4237 863 A 4.1487 7.8734 121.4863 54.4778 18.5755 179.3010 864 E 3.7707 8.3614 118.5456 59.0471 29.6891 179.0738 865 W 4.1064 8.4185 119.4343 59.8875 29.0838 177.8746 866 M 3.8165 8.2666 118.5178 58.9507 31.4640 178.0625 867 Q 3.9120 8.0367 119.2995 59.3611 29.1264 178.0293 868 H 4.2188 8.0335 116.7270 58.9478 28.8786 177.6938 869 L 4.0868 8.4903 121.1577 58.2803 41.2777 179.5692 870 C 4.2571 8.1704 115.4692 62.3759 28.3976 175.7488 871 Q 4.0727 7.8684 121.1890 59.2141 28.8569 177.9867 872 A 4.0389 8.1914 121.8626 55.2485 17.8993 179.7762 873 V 3.6902 7.7571 116.7301 66.1068 31.4283 177.9328 874 S 4.3661 7.7364 111.7740 60.6938 63.0579 174.9816 875 K 4.6460 9.3079 122.2384 55.8654 32.8135 176.4364 876 G 3.6132 8.8316 114.4444 47.1841 0.0000 171.5750 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 774 T 8.40 5.09 4.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 775 K 8.02 4.38 0.00 1.55 1.55 0.00 0.86 0.00 0.00 0.61 0.00 0.00 2.13 0.00 0.00 2.39 0.00 0.00 0.00 0.00 0.73 0.42 7.81 776 E 8.62 5.33 0.00 2.05 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 2.25 2.47 0.00 777 G 8.61 4.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 778 M 8.98 5.28 0.00 2.21 2.20 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.80 2.78 0.00 779 L 9.01 4.94 0.00 1.65 1.56 1.12 0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 780 H 8.84 5.78 0.00 3.30 3.45 0.00 5.66 0.00 0.00 0.00 0.00 6.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 781 Y 8.36 5.65 0.00 2.99 2.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 782 K 7.39 2.83 0.00 0.79 0.97 0.00 1.79 0.00 0.00 1.54 0.00 0.00 2.67 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.03 0.87 7.81 783 A 7.93 3.83 1.24 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 0.00 0.00 0.00 784 G 8.51 3.99 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *785 T 7.24 4.13 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 *786 S 8.41 4.46 0.00 3.56 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *787 Y 7.94 3.63 0.00 2.52 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 0.00 0.00 0.00 0.00 *788 L 8.62 4.22 0.00 1.66 1.60 0.92 0.64 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 0.00 789 G 8.03 3.66 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 0.00 0.00 0.00 *790 K 9.26 4.00 0.00 1.84 2.11 0.00 1.80 0.00 0.00 1.74 0.00 0.00 2.78 0.00 0.00 2.59 0.00 0.00 0.00 0.00 1.20 0.93 7.81 *791 E 8.08 4.58 0.00 1.98 1.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 1.89 0.00 792 H 8.27 4.94 0.00 3.11 3.22 0.00 5.66 0.00 0.00 0.00 0.00 6.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 793 W 8.67 4.44 0.00 3.10 3.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 794 K 7.69 4.27 0.00 1.61 0.95 0.00 1.56 0.00 0.00 1.69 0.00 0.00 2.91 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.33 1.30 7.81 795 T 8.28 4.88 4.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 796 C 9.23 5.26 0.00 3.36 3.57 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 0.00 797 F 9.75 5.42 0.00 3.10 3.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 798 V 8.77 4.75 1.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.64 0.00 0.00 0.71 0.00 0.00 799 V 8.66 4.80 2.24 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 0.97 0.00 0.00 0.85 0.00 0.00 800 L 9.37 5.18 0.00 2.08 1.83 1.03 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 801 S 9.09 5.07 0.00 4.04 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 802 N 9.29 4.34 0.00 2.98 2.07 0.00 0.00 6.89 7.98 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 0.00 803 G 8.86 4.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 804 I 7.95 4.63 1.87 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.92 0.13 0.00 0.00 805 L 8.32 5.09 0.00 1.70 1.36 0.97 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 806 Y 9.53 5.00 0.00 2.71 2.40 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 0.00 807 Q 8.78 4.79 0.00 1.78 1.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.68 0.00 0.00 0.00 0.00 0.00 2.00 2.09 0.00 808 Y 8.97 5.28 0.00 3.27 2.93 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 0.00 809 P 0.00 4.75 0.00 2.32 2.43 0.00 3.96 0.00 0.00 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.22 0.00 810 D 7.75 4.75 0.00 2.78 2.74 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 0.00 0.00 0.00 0.00 811 R 8.40 3.91 0.00 1.31 1.23 0.00 2.87 0.00 0.00 3.08 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.43 0.00 812 T 8.14 4.48 4.18 0.00 0.00 0.00 0.00 0.00 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 0.00 813 D 8.30 4.01 0.00 3.09 2.82 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 0.00 0.00 0.00 0.00 814 V 6.77 2.62 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 0.66 0.00 0.00 0.85 0.00 0.00 815 I 8.59 4.28 1.93 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.96 1.16 0.00 0.00 816 P 0.00 4.00 0.00 2.19 2.09 0.00 3.97 0.00 0.00 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.13 0.00 817 L 9.03 4.20 0.00 1.62 1.73 0.94 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 0.00 0.00 0.00 0.00 818 L 7.23 4.45 0.00 1.59 1.37 0.80 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 819 S 8.45 4.86 0.00 3.77 3.58 0.00 0.00 0.00 0.00 0.00 0.00 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 V 8.54 4.27 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 0.52 0.00 0.00 0.85 0.00 0.00 821 N 8.62 4.84 0.00 2.73 2.67 0.00 0.00 7.23 7.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 822 M 8.06 4.29 0.00 2.07 2.12 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.64 2.56 0.00 823 G 9.06 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 0.00 0.00 0.00 824 G 7.74 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.33 4.19 0.00 1.75 1.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.40 0.00 826 Q 8.11 4.39 0.00 1.95 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.84 0.00 0.00 0.00 0.00 0.00 2.31 2.27 0.00 827 C 8.18 5.12 0.00 2.94 2.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 828 G 10.30 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 0.00 0.00 0.00 829 G 7.01 4.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 830 C 8.28 5.68 0.00 2.85 2.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 831 R 8.38 4.77 0.00 1.88 2.01 0.00 2.99 0.00 0.00 3.36 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.72 0.00 832 R 8.64 4.64 0.00 1.77 1.97 0.00 3.21 0.00 0.00 3.26 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.68 0.00 833 A 8.71 4.74 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 834 N 8.48 4.70 0.00 2.85 2.90 0.00 0.00 6.03 7.71 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 0.00 835 T 8.74 3.71 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 1.20 0.00 0.00 836 T 9.13 3.32 4.28 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 1.28 0.00 0.00 837 D 7.99 4.22 0.00 2.75 2.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 838 R 7.27 4.43 0.00 1.02 1.44 0.00 3.24 0.00 0.00 3.50 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.25 0.00 839 P 0.00 4.05 0.00 1.83 1.95 0.00 3.68 0.00 0.00 3.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 1.90 0.00 840 H 8.50 4.09 0.00 3.58 3.52 0.00 5.60 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 841 A 7.84 5.33 1.30 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 0.00 0.00 0.00 842 F 8.56 5.61 0.00 3.33 3.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 843 Q 9.30 5.04 0.00 2.10 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.45 6.78 0.00 0.00 0.00 0.00 0.00 2.45 2.32 0.00 844 V 8.18 4.54 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.95 0.00 0.00 0.98 0.00 0.00 845 I 8.57 4.25 2.07 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.43 0.90 0.00 0.00 846 L 8.26 5.26 0.00 1.60 1.48 0.89 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 847 S 8.57 4.15 0.00 3.77 3.76 0.00 0.00 0.00 0.00 0.00 0.00 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 D 8.71 4.77 0.00 2.77 2.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 849 R 7.38 4.41 0.00 1.90 1.81 0.00 3.10 0.00 0.00 3.23 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 1.47 0.00 850 P 0.00 4.15 0.00 2.14 2.09 0.00 3.73 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.95 0.00 851 C 8.38 4.42 0.00 3.13 2.96 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 0.00 0.00 0.00 852 L 8.46 4.23 0.00 1.67 1.49 0.63 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 853 E 8.55 4.33 0.00 1.62 1.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 2.16 0.00 854 L 8.36 5.48 0.00 0.27 0.85 0.69 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 855 S 8.25 4.99 0.00 3.65 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 856 A 8.79 5.20 1.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 857 E 8.41 4.38 0.00 1.91 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 2.54 2.24 0.00 858 S 7.39 4.37 0.00 3.90 3.89 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.58 4.05 0.00 2.20 2.02 0.00 0.00 0.00 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 2.45 0.00 860 A 7.82 3.94 1.30 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 0.00 0.00 0.00 861 E 7.92 3.86 0.00 2.08 2.06 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 2.65 2.41 0.00 862 M 7.96 4.12 0.00 2.59 2.52 0.00 0.00 0.00 0.00 0.00 2.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.69 2.71 0.00 863 A 7.87 4.15 1.40 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 0.00 0.00 0.00 864 E 8.36 3.77 0.00 2.06 1.88 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 2.09 2.19 0.00 865 W 8.42 4.11 0.00 3.22 2.82 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 0.00 0.00 0.00 0.00 866 M 8.27 3.82 0.00 2.08 2.00 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.57 0.00 867 Q 8.04 3.91 0.00 2.18 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.60 0.00 0.00 0.00 0.00 0.00 2.25 2.34 0.00 868 H 8.03 4.22 0.00 3.42 3.32 0.00 5.68 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 0.00 869 L 8.49 4.09 0.00 1.72 1.80 1.05 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 870 C 8.17 4.26 0.00 2.99 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 7.87 4.07 0.00 2.38 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.78 0.00 0.00 0.00 0.00 0.00 2.37 2.38 0.00 872 A 8.19 4.04 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 0.00 873 V 7.76 3.69 2.25 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 1.03 0.00 0.00 1.03 0.00 0.00 874 S 7.74 4.37 0.00 4.09 3.90 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 0.00 875 K 9.31 4.65 0.00 1.85 1.52 0.00 1.85 0.00 0.00 1.72 0.00 0.00 2.99 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.36 1.50 7.81 876 G 8.83 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.