NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 806 D 4.5599 8.3229 120.1937 53.9543 41.3675 176.4954 807 L 4.3938 8.4435 126.8220 55.6122 41.6756 174.4291 *808 H 4.4449 8.9624 114.8713 58.1779 29.3186 183.0946 809 T 4.6367 7.9313 114.4752 65.0024 68.8836 174.4035 810 L 4.7694 7.9876 122.3903 53.5445 45.1814 174.1138 811 N 5.1120 9.2191 124.9905 50.6749 39.7235 173.9648 812 W 4.5043 8.9809 135.0000 60.8040 30.6516 177.0976 813 D 4.1012 8.1988 118.0595 57.0578 40.3102 178.3431 814 L 3.8495 8.3148 120.9765 58.1510 42.0965 178.5361 815 C 4.1804 8.1819 118.9482 62.3313 31.4851 175.4264 816 L 3.5373 7.7731 120.7306 58.0333 41.1534 179.3318 817 T 3.6100 7.8364 115.5981 67.0604 68.2376 176.3314 818 Q 4.0864 8.2921 118.5102 58.4077 29.0514 178.3328 819 A 4.6983 7.9324 122.7537 51.6855 20.0234 177.0216 820 N 4.2392 8.9894 115.3046 55.3399 35.4714 177.7888 821 H 3.9575 8.3622 115.5013 57.8152 27.5254 177.3098 822 K 4.3832 7.5467 126.0144 55.2231 31.2943 181.4423 823 S 4.4990 8.5271 122.3279 60.6556 62.9835 175.8119 824 N 4.3749 8.2134 120.3191 56.2762 38.1371 176.7507 825 L 3.9619 7.8294 119.1294 57.8686 41.9829 178.9400 826 A 4.1907 7.6110 118.8598 55.5923 18.5502 179.5183 827 L 4.3465 8.4135 117.2938 57.6090 41.3896 179.4639 828 E 4.3430 7.7405 116.9969 56.6678 29.8791 177.5040 *830 L 4.4395 7.9430 119.3461 54.4210 43.8712 179.6404 831 K 4.0419 8.1298 114.0560 57.4893 31.7942 178.2852 *833 L 4.2084 8.0301 122.4376 55.1145 43.7210 178.5156 834 L 3.9557 8.0501 119.7419 58.3428 41.7088 178.3400 835 D 4.3516 8.0356 116.8955 57.2472 41.5274 177.8761 836 S 4.4055 7.9026 113.2893 60.1206 63.3091 176.3987 837 L 4.0201 7.5541 123.6015 57.3224 41.3256 177.3985 838 P 4.2385 0.0000 0.0000 65.5069 31.3060 178.2509 839 E 3.9562 8.1266 117.7110 59.4314 29.5525 178.8016 840 T 3.8554 7.8473 115.6323 66.5641 68.4636 176.6361 841 V 3.6314 8.1928 122.8315 66.7374 31.5636 178.4459 842 E 4.2420 8.0375 119.2244 60.6198 29.5395 181.0572 843 K 4.2042 8.2046 119.7189 59.2330 32.0659 179.6451 844 I 3.7159 8.0077 120.1934 64.5130 37.1185 178.4206 845 Q 4.0111 8.3666 119.2147 59.3424 28.5286 179.3083 846 T 3.9756 8.1013 116.3928 66.6029 68.5763 176.7672 847 A 4.0050 8.1339 122.7384 54.9400 17.8636 179.4189 848 L 3.9960 8.1937 119.0695 58.4114 41.9931 179.5956 849 G 3.6647 7.7363 104.0388 47.4509 0.0000 174.9341 850 Q 4.2271 8.1614 117.7380 55.0520 29.9441 175.1919 851 N 4.0637 7.4939 115.7518 54.3335 36.5105 175.8556 852 D 4.6532 7.8620 117.3872 52.3401 40.6969 175.2758 853 Q 4.0681 8.6214 125.7237 58.8213 29.7533 177.7481 854 A 4.1526 8.1233 120.1875 55.7351 18.7556 180.6441 855 T 4.0003 7.9237 109.7801 64.2082 68.0014 176.2811 *857 L 4.1966 8.0873 124.1817 55.2820 43.9154 178.5388 858 S 4.1074 8.1510 112.4982 61.8991 62.3092 176.1557 859 T 3.9609 8.0785 115.5734 65.0500 67.0491 176.4550 860 I 3.7474 7.7169 121.5092 64.4361 37.1889 177.5273 861 H 4.5303 8.4959 120.8141 58.8204 29.6934 177.5263 862 K 3.9537 7.9555 119.8861 59.2004 31.7929 179.1485 863 L 3.9566 7.8973 120.5607 58.2816 41.7755 178.3640 864 H 4.2732 8.5253 117.7692 59.2638 29.6649 176.9493 865 G 3.8172 7.9984 107.0932 47.9074 0.0000 175.1760 866 A 4.1377 7.9536 124.1146 54.9004 17.9060 179.9009 867 S 4.1156 8.4788 112.7139 61.7013 62.6961 176.1457 868 C 4.2197 7.7390 118.3772 61.4276 27.8580 173.5798 869 Y 4.6771 8.0313 115.8034 57.7017 39.0031 175.5152 870 C 4.6926 7.9433 115.6348 58.6268 29.3333 174.1843 871 G 3.9992 8.8461 108.1936 47.4469 0.0000 175.3383 872 V 4.5440 6.9270 110.1950 56.9776 32.5854 175.0837 873 P 4.2288 0.0000 0.0000 65.6907 31.5009 178.0820 874 T 3.8907 7.8681 114.2940 66.7912 68.2954 176.8117 875 T 3.8433 7.9167 117.2094 66.7590 68.5197 176.0207 876 Q 4.2941 8.2259 122.7468 58.6140 29.0224 178.4166 877 R 3.8472 7.9705 119.5017 59.4848 30.1639 178.4288 878 L 3.9617 8.1232 118.9964 58.0865 41.5770 179.3657 879 C 4.0875 8.3932 117.0148 62.6042 27.9639 175.9349 880 Q 3.7259 8.0022 121.0989 59.1967 28.6979 178.2013 881 E 3.9428 8.2400 119.5606 59.4453 29.4457 179.5408 882 I 3.6718 7.8455 119.6925 64.2898 37.0980 177.8855 883 E 3.9168 8.4301 120.4579 59.5537 29.5360 178.8778 884 S 4.1538 8.1924 114.7300 61.6750 62.9801 176.6112 885 A 3.9996 8.0607 123.1200 55.3470 18.1105 179.6729 886 L 3.9737 8.3007 117.7767 57.9329 41.4470 179.9459 887 K 4.0723 8.1116 117.3973 58.7271 32.0445 178.5865 888 R 4.2812 7.5078 115.7591 55.5263 30.2564 176.3104 889 Q 3.6331 7.9939 116.8225 56.9807 26.5748 173.4537 890 T 4.0389 7.6960 113.1391 60.9348 68.0649 172.5572 891 P 4.6475 0.0000 0.0000 62.3703 32.3773 177.1203 892 V 3.5439 8.3580 119.7024 66.4853 31.1190 177.9104 893 E 3.8978 8.2784 118.2316 59.7023 29.1668 178.1727 894 D 4.5795 8.0147 116.1736 55.6745 41.1965 177.4375 895 L 4.7660 7.6987 120.6566 53.5169 41.9026 177.3303 896 E 3.9060 7.8178 122.3338 59.1308 29.4784 177.1121 897 P 4.2409 0.0000 0.0000 65.8704 31.5065 178.4913 898 E 4.0329 8.0943 116.7219 59.3147 29.3840 179.3417 899 I 3.8577 8.1544 120.4019 64.2627 37.1836 178.4445 900 L 3.9973 8.2875 120.3181 57.7401 41.4610 179.1782 901 E 3.9426 8.2861 119.3093 59.0770 29.5020 178.6393 902 L 3.9566 8.2034 120.7793 58.0879 42.2278 178.8780 903 L 3.9606 8.2710 119.3546 57.8872 41.4454 178.9636 904 D 4.3275 8.1480 117.8771 57.3973 41.2155 177.9167 905 E 3.9435 8.2898 119.7368 59.3416 29.5296 178.8428 906 L 4.0565 8.2308 119.1639 57.8508 41.6975 179.5164 907 T 3.8671 7.7861 115.3954 66.7367 68.3947 176.7918 908 K 4.0430 7.8345 120.3890 59.2743 31.9294 179.7105 909 V 3.6027 8.0729 118.8400 65.9217 31.4540 177.8510 910 E 3.9570 8.4876 118.7465 59.5490 29.3231 179.4091 911 S 4.0509 7.9887 112.3123 61.2757 62.4359 176.0502 912 A 3.9703 8.1592 123.5891 55.1238 18.1608 179.8538 913 V 3.5309 8.1599 117.1418 66.1642 31.8098 178.4175 914 K 4.0430 8.2098 120.6173 59.9783 31.8945 180.0574 915 Q 3.9893 7.9411 121.1919 60.1332 28.1383 182.2942 916 V 3.7501 8.0034 120.0985 64.8805 31.4637 177.6947 917 L 4.1365 7.8757 118.5117 57.1397 41.6987 179.0169 918 S 4.1420 7.7433 114.0088 61.1317 62.7138 176.1866 919 Q 4.0736 7.6830 121.3160 58.1653 29.1324 176.4292 920 L 4.4876 7.2514 115.6029 54.1010 43.0187 176.5729 921 S 4.3753 7.8978 114.5114 57.3794 64.0461 174.1964 922 A 4.3057 8.4611 125.5610 52.2901 19.0076 175.9795 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 8.32 4.56 0.00 2.70 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 0.00 807 L 8.44 4.39 0.00 1.79 1.56 0.92 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 *808 H 8.96 4.44 0.00 2.85 3.10 0.00 7.16 0.00 0.00 0.00 0.00 6.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 809 T 7.93 4.64 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 1.30 0.00 0.00 810 L 7.99 4.77 0.00 1.73 1.49 1.08 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 0.00 0.00 0.00 0.00 811 N 9.22 5.11 0.00 2.90 2.67 0.00 0.00 6.42 7.61 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 0.00 812 W 8.98 4.50 0.00 3.40 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 8.20 4.10 0.00 2.87 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 0.00 814 L 8.31 3.85 0.00 1.73 1.85 0.86 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 815 C 8.18 4.18 0.00 3.04 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 0.00 816 L 7.77 3.54 0.00 1.44 1.43 0.60 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 817 T 7.84 3.61 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 1.14 0.00 0.00 818 Q 8.29 4.09 0.00 2.11 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 7.39 0.00 0.00 0.00 0.00 0.00 2.20 2.37 0.00 819 A 7.93 4.70 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 8.99 4.24 0.00 2.85 2.75 0.00 0.00 6.90 7.72 0.00 0.00 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 8.36 3.96 0.00 3.24 3.38 0.00 5.61 0.00 0.00 0.00 0.00 6.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 822 K 7.55 4.38 0.00 1.78 1.73 0.00 1.82 0.00 0.00 1.70 0.00 0.00 2.98 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.32 1.30 7.81 823 S 8.53 4.50 0.00 4.43 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 0.00 824 N 8.21 4.37 0.00 2.86 2.91 0.00 0.00 7.16 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 7.83 3.96 0.00 1.61 1.74 0.91 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 826 A 7.61 4.19 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 0.00 827 L 8.41 4.35 0.00 1.88 1.81 1.03 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 0.00 0.00 0.00 0.00 0.00 0.00 828 E 7.74 4.34 0.00 2.08 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 0.00 2.33 2.40 0.00 *830 L 7.94 4.44 0.00 2.04 1.81 1.21 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 0.00 0.00 0.00 0.00 0.00 0.00 831 K 8.13 4.04 0.00 2.05 1.83 0.00 1.83 0.00 0.00 1.59 0.00 0.00 2.90 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.47 1.54 7.81 *833 L 8.03 4.21 0.00 1.78 1.90 0.95 0.54 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 0.00 834 L 8.05 3.96 0.00 1.88 1.87 0.93 1.05 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 8.04 4.35 0.00 2.80 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 0.00 836 S 7.90 4.41 0.00 4.10 4.10 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 0.00 837 L 7.55 4.02 0.00 1.81 1.92 0.94 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 838 P 0.00 4.24 0.00 2.16 2.10 0.00 3.77 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.14 0.00 839 E 8.13 3.96 0.00 2.08 1.95 0.00 0.00 0.00 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 2.47 0.00 840 T 7.85 3.86 4.39 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 1.22 0.00 0.00 841 V 8.19 3.63 2.22 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 1.08 0.00 0.00 1.00 0.00 0.00 842 E 8.04 4.24 0.00 2.03 1.95 0.00 0.00 0.00 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 2.09 0.00 843 K 8.20 4.20 0.00 1.95 1.89 0.00 1.64 0.00 0.00 1.65 0.00 0.00 2.96 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.46 1.70 7.81 844 I 8.01 3.72 2.00 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 1.53 0.78 0.91 0.00 0.00 845 Q 8.37 4.01 0.00 2.23 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.82 0.00 0.00 0.00 0.00 0.00 2.38 2.53 0.00 846 T 8.10 3.98 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 8.13 4.01 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 8.19 4.00 0.00 1.87 1.86 0.92 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 849 G 7.74 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 0.00 850 Q 8.16 4.23 0.00 2.10 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.65 0.00 0.00 0.00 0.00 0.00 2.36 2.57 0.00 851 N 7.49 4.06 0.00 2.88 2.85 0.00 0.00 6.80 7.94 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 0.00 852 D 7.86 4.65 0.00 2.64 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 0.00 853 Q 8.62 4.07 0.00 2.03 2.12 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 2.34 2.43 0.00 854 A 8.12 4.15 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 0.00 855 T 7.92 4.00 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 8.09 4.20 0.00 1.75 1.87 0.93 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 858 S 8.15 4.11 0.00 3.95 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 0.00 859 T 8.08 3.96 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 1.31 0.00 0.00 860 I 7.72 3.75 1.89 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 0.69 0.94 0.00 0.00 861 H 8.50 4.53 0.00 3.24 3.55 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 7.96 3.95 0.00 1.83 1.84 0.00 1.75 0.00 0.00 1.59 0.00 0.00 2.94 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.48 1.61 7.81 863 L 7.90 3.96 0.00 1.90 1.85 0.94 0.89 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 8.53 4.27 0.00 3.27 3.46 0.00 5.84 0.00 0.00 0.00 0.00 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 865 G 8.00 3.82 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 0.00 0.00 0.00 866 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 0.00 867 S 8.48 4.12 0.00 4.06 4.27 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 0.00 0.00 0.00 0.00 868 C 7.74 4.22 0.00 2.99 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 8.03 4.68 0.00 2.92 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 0.00 870 C 7.94 4.69 0.00 3.01 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 0.00 871 G 8.85 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 0.00 0.00 0.00 872 V 6.93 4.54 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 1.24 0.00 0.00 0.98 0.00 0.00 873 P 0.00 4.23 0.00 2.15 2.09 0.00 3.72 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 2.17 0.00 874 T 7.87 3.89 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 1.25 0.00 0.00 875 T 7.92 3.84 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 0.00 876 Q 8.23 4.29 0.00 2.18 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.81 0.00 0.00 0.00 0.00 0.00 2.38 2.26 0.00 877 R 7.97 3.85 0.00 1.92 2.05 0.00 3.14 0.00 0.00 3.16 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.66 0.00 878 L 8.12 3.96 0.00 1.70 1.69 0.94 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 879 C 8.39 4.09 0.00 3.04 2.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 880 Q 8.00 3.73 0.00 2.17 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.80 0.00 0.00 0.00 0.00 0.00 2.40 2.57 0.00 881 E 8.24 3.94 0.00 2.17 1.97 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 2.32 2.49 0.00 882 I 7.85 3.67 1.91 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 8.43 3.92 0.00 2.06 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 2.36 2.41 0.00 884 S 8.19 4.15 0.00 3.90 3.91 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 0.00 885 A 8.06 4.00 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 0.00 886 L 8.30 3.97 0.00 1.83 1.74 0.93 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 887 K 8.11 4.07 0.00 1.90 1.88 0.00 1.70 0.00 0.00 1.71 0.00 0.00 3.05 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.48 1.71 7.81 888 R 7.51 4.28 0.00 1.94 1.96 0.00 3.27 0.00 0.00 3.22 7.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.92 0.00 889 Q 7.99 3.63 0.00 2.22 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.83 0.00 0.00 0.00 0.00 0.00 2.28 2.42 0.00 890 T 7.70 4.04 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 1.29 0.00 0.00 891 P 0.00 4.65 0.00 2.26 2.16 0.00 3.77 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 1.95 0.00 892 V 8.36 3.54 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 1.06 0.00 0.00 0.96 0.00 0.00 893 E 8.28 3.90 0.00 2.21 1.95 0.00 0.00 0.00 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 2.42 0.00 894 D 8.01 4.58 0.00 2.85 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 0.00 895 L 7.70 4.77 0.00 1.80 1.66 0.92 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 896 E 7.82 3.91 0.00 2.07 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 2.37 0.00 897 P 0.00 4.24 0.00 2.19 2.09 0.00 3.59 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.18 0.00 898 E 8.09 4.03 0.00 2.17 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 0.00 2.54 2.45 0.00 899 I 8.15 3.86 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 0.75 0.91 0.00 0.00 900 L 8.29 4.00 0.00 1.86 1.72 0.92 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 901 E 8.29 3.94 0.00 2.18 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 2.30 2.31 0.00 902 L 8.20 3.96 0.00 1.83 1.82 0.92 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 903 L 8.27 3.96 0.00 1.85 1.71 0.92 0.81 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 0.00 904 D 8.15 4.33 0.00 2.72 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 0.00 905 E 8.29 3.94 0.00 2.24 2.12 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 2.31 2.40 0.00 906 L 8.23 4.06 0.00 1.86 1.71 0.93 0.65 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 0.00 907 T 7.79 3.87 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 1.21 0.00 0.00 908 K 7.83 4.04 0.00 1.92 1.86 0.00 1.79 0.00 0.00 1.58 0.00 0.00 2.91 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.46 1.57 7.81 909 V 8.07 3.60 2.21 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 1.14 0.00 0.00 0.98 0.00 0.00 910 E 8.49 3.96 0.00 2.21 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 0.00 2.34 2.48 0.00 911 S 7.99 4.05 0.00 3.91 3.98 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 0.00 0.00 0.00 912 A 8.16 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 8.16 3.53 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 1.09 0.00 0.00 1.00 0.00 0.00 914 K 8.21 4.04 0.00 2.06 1.84 0.00 1.71 0.00 0.00 1.68 0.00 0.00 2.97 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.46 1.62 7.81 915 Q 7.94 3.99 0.00 2.08 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.10 6.81 0.00 0.00 0.00 0.00 0.00 2.29 2.23 0.00 916 V 8.00 3.75 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 0.65 0.00 0.00 0.90 0.00 0.00 917 L 7.88 4.14 0.00 1.71 1.65 0.92 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 918 S 7.74 4.14 0.00 3.98 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 0.00 919 Q 7.68 4.07 0.00 2.07 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 6.71 0.00 0.00 0.00 0.00 0.00 2.21 2.30 0.00 920 L 7.25 4.49 0.00 1.39 1.40 -0.20 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 921 S 7.90 4.38 0.00 3.97 3.91 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 0.00 922 A 8.46 4.31 1.22 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 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.