NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 787 N 4.5671 8.4249 118.0953 52.9290 39.9846 173.4501 788 L 3.8453 7.8648 119.5626 53.4323 42.8979 174.6725 789 Y 4.5758 8.2795 119.8575 56.4346 40.7241 174.7915 790 F 5.1072 8.4303 120.7740 55.9889 43.4384 173.7473 791 Q 4.6976 8.4632 118.4001 54.9045 31.3919 174.5978 792 G 4.0663 8.2763 106.0869 45.1347 0.0000 173.1996 793 N 4.8690 8.4507 120.4566 51.5526 38.3611 174.8593 794 Q 4.5095 7.3045 118.2961 55.0534 32.6868 174.0176 795 Q 4.2171 8.7656 124.4760 58.3850 29.3606 176.3370 796 V 4.2664 7.4321 113.9174 61.3056 33.7674 171.5452 797 G 3.6487 8.5374 105.9514 43.9754 0.0000 173.0781 798 D 4.7319 8.4815 118.2115 54.6726 42.1936 175.5293 799 C 4.9819 8.2356 115.1199 58.0133 32.6625 172.0435 800 C 4.9265 9.2155 113.1934 57.0251 33.1978 172.7524 801 I 4.8334 8.4094 120.7013 59.6630 38.6857 175.1121 802 I 4.8238 8.8901 120.3154 59.1817 41.5556 174.2470 803 R 5.2005 9.2273 120.9095 54.4837 33.0298 175.2648 804 V 4.8972 9.4476 124.8177 61.2640 33.8521 174.5958 805 S 4.9248 8.9779 123.2306 56.6188 64.5145 172.5258 806 L 4.7433 7.6917 125.4233 53.4135 45.6286 174.1938 807 D 5.1148 8.8309 128.5028 54.2991 41.2054 176.3777 808 V 4.3742 8.3685 124.9207 61.2808 36.0155 171.2395 809 D 4.4754 9.3144 123.7128 55.4339 37.0104 172.5634 810 N 4.2993 8.0137 111.5422 52.9385 35.9979 175.4970 811 G 4.1941 6.8800 106.8333 47.0790 0.0000 172.8402 812 N 5.3663 8.9212 119.7762 51.9665 42.4029 173.7995 813 M 4.4992 8.6473 124.6879 54.6575 33.7555 174.2680 814 Y 5.1367 8.8232 123.7977 56.4926 40.1363 175.1966 815 K 4.7693 8.9275 122.2541 54.6179 36.0257 175.5197 816 S 5.0806 8.7442 119.8361 58.3867 64.0512 173.7117 817 I 4.8692 9.1570 124.7113 59.3178 41.0555 174.3373 818 L 4.3692 8.8352 128.7823 54.7125 42.9615 175.8554 819 V 4.5020 8.9574 126.9689 61.2541 33.9251 174.9932 820 T 4.4381 9.0305 119.4141 60.6659 69.9914 176.1855 821 S 2.9546 7.7691 117.2220 60.8220 62.9026 175.7110 822 Q 4.1964 7.6962 118.3416 57.2180 29.1489 176.0312 823 D 4.3145 7.6757 118.6278 54.7350 41.1696 176.3202 824 K 4.8190 8.4360 122.8863 54.7599 34.2447 177.2989 825 A 4.0094 8.7017 123.1835 55.4646 18.1450 178.6809 826 P 4.1743 0.0000 0.0000 65.5837 31.2822 178.7445 827 A 4.0112 7.7947 119.7854 54.9937 18.2611 179.9390 828 V 3.5018 7.6406 116.3865 66.0698 31.6583 178.1052 829 I 3.6691 7.9500 119.8037 64.5055 36.9597 178.5969 830 R 3.8932 8.0101 118.7738 59.1211 30.0003 179.2845 831 K 3.9457 7.8404 118.1234 59.3955 32.0668 179.2414 832 A 3.9976 8.0297 120.9437 55.4745 18.2539 179.5688 833 M 3.8744 8.2865 117.5335 58.5035 31.8529 178.6624 834 D 4.3344 8.1367 118.9461 57.5289 40.8274 179.1939 835 K 4.0361 7.7195 117.1487 59.2562 32.0610 178.1957 836 H 4.6211 8.0676 114.0165 54.6943 28.9655 174.7550 837 N 4.2306 7.7316 116.8380 54.6092 36.6835 174.3196 838 L 4.7141 7.9257 114.3792 54.3268 42.5215 179.3593 839 E 3.9458 8.3782 120.1343 59.7692 29.5883 178.4033 840 E 4.2514 8.1407 114.5300 56.8486 29.7152 175.8109 841 E 4.7407 7.9044 118.7507 54.6556 32.3674 174.7638 842 E 4.8367 8.2948 118.7429 53.7831 32.4283 176.0079 843 P 4.4297 0.0000 0.0000 65.6778 31.6521 178.4608 844 E 4.0514 8.2244 117.6280 59.0458 29.6496 177.1343 845 D 4.6637 8.2342 117.1902 54.6077 41.1278 175.0446 846 Y 5.3325 7.8247 116.1859 56.0362 41.8633 174.5737 847 E 4.8581 9.6200 118.6787 54.5791 33.7919 174.0342 848 L 5.1590 8.5189 122.8646 53.5478 44.5877 174.7966 849 L 5.2580 8.7959 125.9569 52.8653 45.3734 175.5705 850 Q 3.6892 9.1132 126.5276 55.5855 30.2612 174.9795 851 I 4.2887 8.4561 128.5072 60.8375 36.6570 175.9583 852 L 4.1070 8.5687 128.4834 57.1377 40.7729 176.9911 853 S 4.5725 7.7859 110.8764 57.3260 65.7518 174.3095 854 D 4.5492 8.7031 119.0994 56.8319 40.4978 176.9970 855 D 4.9221 7.5082 113.6516 53.5935 42.6825 175.7294 856 R 4.7681 7.9037 119.0415 54.1686 33.3006 174.8677 857 K 4.9802 8.6538 121.6638 54.4410 36.3329 175.3178 858 L 4.6031 8.9518 126.1170 52.9075 44.1634 175.3279 859 K 4.4299 8.6982 128.7555 56.5066 32.9470 175.9357 860 I 4.3242 8.4725 129.2407 59.4335 38.1490 174.3213 861 P 4.3020 0.0000 0.0000 63.2368 31.8729 177.6606 862 E 4.0218 8.8825 117.3889 58.9831 29.8773 176.9851 863 N 5.0617 7.7993 115.0740 52.8084 39.4026 173.3202 864 A 4.6777 7.8225 120.4898 50.3193 21.6780 176.4829 865 N 4.8605 8.5318 118.5562 53.1356 39.8368 176.0579 866 V 3.5521 8.6099 128.3991 66.2884 31.5701 177.4399 867 F 3.7492 8.1536 118.3244 61.2660 38.9517 175.6818 868 Y 4.6032 7.4605 112.7931 59.3404 38.8482 177.5891 869 A 4.2356 8.2074 121.3704 53.9260 18.7315 177.9194 870 M 4.2625 7.4388 114.1164 55.0186 32.0612 176.3248 871 N 4.5956 9.3913 119.6702 52.6506 37.8542 175.9571 872 S 4.2856 8.5419 122.6089 60.7655 63.1556 175.6050 873 T 4.2271 7.4954 108.1761 61.5550 69.2741 174.5652 874 A 4.4604 7.3905 125.7617 50.3665 20.4105 176.4540 875 N 4.3846 8.4496 116.8671 54.3071 38.9349 175.8361 876 Y 4.8480 8.5641 122.8681 58.7986 38.2062 174.6906 877 D 5.6278 8.1626 119.0065 52.9076 43.6022 176.3477 878 F 5.4757 10.0048 121.8578 55.5770 43.7907 174.0652 879 V 4.6776 9.0079 120.8861 59.9078 33.9303 174.3770 880 L 4.8498 9.0005 127.8393 53.8657 42.6576 175.2525 881 K 4.7156 9.0492 128.7592 54.2382 35.0700 174.8533 882 K 3.8353 8.5352 128.7034 55.7713 32.6348 176.7642 883 R 4.0510 8.5245 129.4151 56.5647 30.8112 177.9373 884 T 4.4446 7.9300 116.1467 60.7800 68.5893 175.6353 *885 F 4.2936 7.4128 122.7698 56.4448 40.7087 176.9301 *888 G 3.8644 8.2537 101.1892 47.7815 0.0000 173.3040 889 V 4.3166 7.3438 109.9289 59.1836 35.0123 175.9652 890 K 4.1937 8.6044 125.6003 55.1661 32.3408 175.7403 891 V 4.0555 8.1668 126.8435 60.8861 32.2936 175.1732 892 K 4.1458 8.6257 131.9501 56.3605 31.5004 176.7479 *893 H 4.4266 8.5954 122.2157 54.7349 27.9804 172.3860 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 787 N 8.42 4.57 0.00 2.45 2.53 0.00 0.00 6.93 6.97 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 0.00 788 L 7.86 3.85 0.00 1.32 0.85 0.95 0.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 789 Y 8.28 4.58 0.00 2.84 2.79 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 0.00 790 F 8.43 5.11 0.00 2.97 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 0.00 791 Q 8.46 4.70 0.00 2.12 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.70 0.00 0.00 0.00 0.00 0.00 2.27 2.37 0.00 792 G 8.28 4.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 793 N 8.45 4.87 0.00 2.66 2.73 0.00 0.00 6.74 7.08 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 0.00 794 Q 7.30 4.51 0.00 1.93 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.33 6.88 0.00 0.00 0.00 0.00 0.00 2.37 2.33 0.00 795 Q 8.77 4.22 0.00 2.07 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.49 0.00 0.00 0.00 0.00 0.00 2.35 2.33 0.00 796 V 7.43 4.27 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.60 0.00 0.00 0.92 0.00 0.00 797 G 8.54 3.65 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 798 D 8.48 4.73 0.00 2.43 2.67 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 0.00 799 C 8.24 4.98 0.00 2.99 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 0.00 800 C 9.22 4.93 0.00 3.06 3.12 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 0.00 801 I 8.41 4.83 1.86 0.00 0.00 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.62 0.34 0.95 0.00 0.00 802 I 8.89 4.82 2.11 0.00 0.00 0.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.90 0.72 0.00 0.00 803 R 9.23 5.20 0.00 2.12 2.26 0.00 3.08 0.00 0.00 3.12 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.67 0.00 804 V 9.45 4.90 2.14 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 0.96 0.00 0.00 0.91 0.00 0.00 805 S 8.98 4.92 0.00 2.72 3.36 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 0.00 806 L 7.69 4.74 0.00 1.32 1.09 0.96 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.00 0.00 0.00 0.00 0.00 0.00 807 D 8.83 5.11 0.00 2.70 2.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 808 V 8.37 4.37 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 0.65 0.00 0.00 0.93 0.00 0.00 809 D 9.31 4.48 0.00 2.83 2.60 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 0.00 0.00 0.00 810 N 8.01 4.30 0.00 2.85 2.73 0.00 0.00 6.78 7.51 0.00 0.00 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 G 6.88 4.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 N 8.92 5.37 0.00 2.64 2.62 0.00 0.00 6.64 7.66 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 0.00 813 M 8.65 4.50 0.00 2.23 1.98 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.60 0.00 814 Y 8.82 5.14 0.00 2.89 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 0.00 815 K 8.93 4.77 0.00 1.56 1.61 0.00 1.60 0.00 0.00 1.62 0.00 0.00 2.78 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.19 1.15 7.81 816 S 8.74 5.08 0.00 3.93 4.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 817 I 9.16 4.87 1.87 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 1.02 0.90 0.00 0.00 818 L 8.84 4.37 0.00 1.38 1.73 0.74 0.89 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 V 8.96 4.50 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 0.99 0.00 0.00 0.75 0.00 0.00 820 T 9.03 4.44 4.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 821 S 7.77 2.95 0.00 3.63 3.09 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 0.00 0.00 0.00 822 Q 7.70 4.20 0.00 2.08 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 6.82 0.00 0.00 0.00 0.00 0.00 2.35 2.31 0.00 823 D 7.68 4.31 0.00 2.86 2.58 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 0.00 824 K 8.44 4.82 0.00 1.82 1.72 0.00 1.72 0.00 0.00 1.98 0.00 0.00 2.95 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.50 1.44 7.81 825 A 8.70 4.01 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 0.00 826 P 0.00 4.17 0.00 2.17 2.12 0.00 3.56 0.00 0.00 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.27 0.00 827 A 7.79 4.01 1.29 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 0.00 0.00 0.00 828 V 7.64 3.50 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 0.89 0.00 0.00 0.85 0.00 0.00 829 I 7.95 3.67 1.99 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.61 0.90 0.00 0.00 830 R 8.01 3.89 0.00 1.99 1.96 0.00 3.12 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 1.64 1.94 0.00 831 K 7.84 3.95 0.00 1.91 1.87 0.00 1.74 0.00 0.00 1.87 0.00 0.00 2.95 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.47 1.65 7.81 832 A 8.03 4.00 1.34 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 0.00 0.00 0.00 833 M 8.29 3.87 0.00 1.92 2.15 0.00 0.00 0.00 0.00 0.00 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.10 0.00 834 D 8.14 4.33 0.00 2.88 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 0.00 835 K 7.72 4.04 0.00 1.81 1.76 0.00 1.75 0.00 0.00 1.64 0.00 0.00 2.98 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.44 1.46 7.81 836 H 8.07 4.62 0.00 3.14 3.25 0.00 5.81 0.00 0.00 0.00 0.00 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 837 N 7.73 4.23 0.00 2.81 2.89 0.00 0.00 6.82 8.98 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 0.00 838 L 7.93 4.71 0.00 1.54 1.59 0.64 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 839 E 8.38 3.95 0.00 2.21 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 2.32 1.92 0.00 840 E 8.14 4.25 0.00 2.23 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 2.31 1.90 0.00 841 E 7.90 4.74 0.00 2.18 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 2.32 2.31 0.00 842 E 8.29 4.84 0.00 2.01 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 2.32 2.22 0.00 843 P 0.00 4.43 0.00 2.24 2.32 0.00 3.73 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.00 0.00 844 E 8.22 4.05 0.00 1.99 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 0.00 2.33 2.42 0.00 845 D 8.23 4.66 0.00 2.93 2.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 846 Y 7.82 5.33 0.00 2.84 2.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 847 E 9.62 4.86 0.00 1.97 2.03 0.00 0.00 0.00 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 2.26 0.00 848 L 8.52 5.16 0.00 1.82 1.63 0.93 0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 849 L 8.80 5.26 0.00 1.70 1.53 0.97 0.62 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 0.00 850 Q 9.11 3.69 0.00 1.53 1.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.51 6.97 0.00 0.00 0.00 0.00 0.00 1.94 1.20 0.00 851 I 8.46 4.29 1.89 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.66 0.98 0.00 0.00 852 L 8.57 4.11 0.00 1.73 1.69 0.90 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 853 S 7.79 4.57 0.00 3.97 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 854 D 8.70 4.55 0.00 2.69 2.78 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 0.00 0.00 0.00 855 D 7.51 4.92 0.00 2.59 2.65 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 0.00 0.00 0.00 0.00 856 R 7.90 4.77 0.00 1.67 1.77 0.00 3.05 0.00 0.00 3.16 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.56 0.00 857 K 8.65 4.98 0.00 1.58 1.65 0.00 1.70 0.00 0.00 1.64 0.00 0.00 2.84 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.32 1.40 7.81 858 L 8.95 4.60 0.00 1.66 1.46 0.93 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 859 K 8.70 4.43 0.00 1.81 1.72 0.00 1.75 0.00 0.00 1.87 0.00 0.00 3.03 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.44 1.56 7.81 860 I 8.47 4.32 2.03 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.21 0.97 0.00 0.00 861 P 0.00 4.30 0.00 2.20 2.01 0.00 3.68 0.00 0.00 4.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.13 0.00 862 E 8.88 4.02 0.00 1.98 1.91 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 2.24 1.91 0.00 863 N 7.80 5.06 0.00 2.60 2.74 0.00 0.00 6.82 7.96 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 0.00 864 A 7.82 4.68 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 0.00 865 N 8.53 4.86 0.00 2.89 2.91 0.00 0.00 6.60 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 0.00 866 V 8.61 3.55 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 0.77 0.00 0.00 0.91 0.00 0.00 867 F 8.15 3.75 0.00 2.83 2.62 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 0.00 868 Y 7.46 4.60 0.00 3.16 2.99 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 0.00 869 A 8.21 4.24 1.42 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 0.00 0.00 870 M 7.44 4.26 0.00 2.37 2.33 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.45 2.60 0.00 871 N 9.39 4.60 0.00 2.67 2.76 0.00 0.00 7.54 7.80 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 0.00 872 S 8.54 4.29 0.00 3.87 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 0.00 873 T 7.50 4.23 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 1.22 0.00 0.00 874 A 7.39 4.46 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 0.00 875 N 8.45 4.38 0.00 2.70 2.78 0.00 0.00 6.91 7.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 876 Y 8.56 4.85 0.00 2.91 3.05 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 0.00 0.00 0.00 877 D 8.16 5.63 0.00 2.71 2.81 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 0.00 878 F 10.00 5.48 0.00 3.00 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 0.00 879 V 9.01 4.68 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 0.81 0.00 0.00 0.92 0.00 0.00 880 L 9.00 4.85 0.00 1.58 1.69 0.90 0.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 881 K 9.05 4.72 0.00 1.87 1.65 0.00 1.69 0.00 0.00 1.78 0.00 0.00 2.75 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.30 1.34 7.81 882 K 8.54 3.84 0.00 1.49 1.48 0.00 1.68 0.00 0.00 1.54 0.00 0.00 2.98 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.03 0.38 7.81 883 R 8.52 4.05 0.00 1.65 1.80 0.00 3.35 0.00 0.00 3.24 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.53 0.00 884 T 7.93 4.44 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 *885 F 7.41 4.29 0.00 2.29 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *888 G 8.25 3.86 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 0.00 0.00 0.00 889 V 7.34 4.32 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.74 0.00 0.00 0.92 0.00 0.00 890 K 8.60 4.19 0.00 1.70 1.72 0.00 1.75 0.00 0.00 1.63 0.00 0.00 2.89 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.37 1.41 7.81 891 V 8.17 4.06 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 0.84 0.00 0.00 0.92 0.00 0.00 892 K 8.63 4.15 0.00 1.75 1.74 0.00 1.82 0.00 0.00 1.74 0.00 0.00 3.05 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.40 1.43 7.81 *893 H 8.60 4.43 0.00 2.97 2.82 0.00 7.29 0.00 0.00 0.00 0.00 6.91 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.