NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 773 D 4.5231 8.3644 120.1907 53.5973 42.0791 174.8643 774 V 3.4800 8.3462 127.3118 62.1457 32.1954 174.2197 775 R 4.0065 8.7476 126.6613 56.2099 31.8653 176.6324 776 Q 3.9610 9.0138 123.8526 59.4257 28.9965 177.9530 777 E 4.2440 8.1604 115.3158 57.7033 30.0013 176.3498 778 E 4.6937 8.5034 116.8988 56.3181 30.9938 177.4544 779 L 4.0186 7.9705 121.4068 57.7996 41.5661 179.5227 780 G 3.3875 8.1410 104.7190 47.7954 0.0000 175.2742 781 A 3.9718 7.9171 123.3116 54.7478 18.4357 179.7429 782 V 3.4866 7.7398 116.9749 66.0305 31.3668 178.6872 783 V 3.5670 7.7249 118.4247 64.6012 31.2327 177.9194 784 D 4.3854 7.6574 118.9215 56.9670 40.8865 178.2681 785 K 4.1089 8.0521 120.1117 59.3493 32.1146 179.7820 786 E 4.0785 8.3380 117.0227 56.6254 29.2507 178.8322 *788 A 4.1632 8.0273 123.4695 52.2331 20.7202 179.8168 789 A 3.9992 8.2010 117.8205 55.5751 18.2912 180.0821 790 T 3.8017 8.1277 114.4422 66.9229 68.5294 177.2419 791 S 4.1126 8.0124 116.3958 61.4228 62.8328 176.5018 792 A 3.9739 8.4495 123.8090 55.0739 18.1750 179.5618 793 A 4.0999 8.4364 119.7544 55.3437 18.3310 179.9992 794 I 3.7495 7.9815 118.5473 64.4716 37.1048 178.5065 795 E 3.9704 8.2240 119.5810 59.4367 29.3029 179.0532 796 D 4.3348 8.3696 118.8667 57.2528 40.7768 178.7359 797 A 3.9845 8.1014 121.2452 55.0771 18.3827 179.7984 798 V 3.5204 7.9744 116.8539 66.1793 31.6253 178.3843 799 R 3.9084 8.1359 117.7590 59.4244 29.7441 179.2139 800 R 3.9357 8.2261 116.5481 59.3800 30.1511 178.9664 801 I 3.8718 7.8160 118.5265 64.5229 37.2124 178.0923 802 E 4.3274 8.1143 118.2247 58.3491 29.8918 177.3569 803 D 4.3931 8.0189 119.1906 53.4939 40.6662 175.6306 *806 N 4.5436 8.3271 124.8351 53.4167 40.9586 176.6502 807 Q 4.0902 8.1631 116.6685 58.4246 28.5104 178.6787 808 A 3.9684 7.8461 121.8155 55.1330 18.4277 179.3927 809 R 4.0156 7.3533 112.9747 58.4149 30.2462 176.9647 810 H 4.8919 7.8428 113.0157 55.3075 30.5424 174.0630 811 A 4.6508 7.7832 121.4576 50.8137 19.2320 175.4449 812 S 4.5577 7.5125 111.1027 59.7346 64.6947 174.9872 813 S 4.3064 8.5847 113.1000 58.6093 64.7438 173.6717 814 G 3.8813 8.5157 109.3023 45.0604 0.0000 173.7965 815 V 3.5940 8.3149 116.3007 65.9905 31.0368 178.2406 816 K 3.8797 8.0627 118.8531 59.4382 32.1084 177.9846 817 L 3.9197 7.9395 119.8144 58.2944 41.8400 178.1007 818 E 3.9134 8.1708 118.8913 59.9088 29.5154 179.4581 819 V 3.6448 8.3589 112.3797 64.4234 31.5414 178.4386 820 N 4.4724 8.6349 116.6800 56.2098 38.3082 177.3729 821 E 3.9840 8.3556 120.2001 59.3816 29.6477 179.4656 822 R 3.9365 7.7318 118.2055 59.2735 30.0828 179.2475 823 I 3.7045 7.8964 119.4399 64.5129 37.1998 178.5133 824 L 3.9955 8.2933 120.2021 57.7915 41.4018 179.2075 825 N 4.3331 8.3507 117.0646 56.8116 38.9089 177.1999 826 S 4.1660 8.0596 116.4404 61.7885 62.6537 176.4872 827 C 4.2026 8.1299 118.8158 62.8939 27.8619 176.0352 828 T 4.0354 7.6489 116.7624 66.8298 68.5167 176.2675 829 D 4.5517 8.2297 120.7599 56.9527 40.7029 178.4642 830 L 4.1201 7.7938 118.4417 55.8008 42.0197 178.5061 *832 K 4.2286 8.0847 118.8075 55.8801 34.2893 178.1066 833 A 4.0566 7.8958 120.2680 55.0798 18.0896 179.7631 834 I 3.7615 7.8853 118.5817 64.1768 37.1612 178.4913 835 R 3.8662 7.8544 119.3261 59.4140 29.9427 178.2323 836 L 3.9742 7.8546 119.7714 57.8018 41.9912 178.5007 837 L 3.9189 7.9227 120.4003 58.3094 42.0579 179.2509 838 V 3.5677 8.1320 118.4420 66.2756 31.4856 178.1304 839 T 3.8977 7.9956 115.5468 66.9983 68.2949 176.8948 840 T 3.9505 8.4229 118.1490 66.4546 68.3397 176.8572 841 S 4.1354 8.3163 115.5260 61.6776 62.3414 176.3643 842 T 3.8906 8.0778 118.4871 66.6940 68.1535 176.8736 843 S 4.1363 8.0787 117.0562 61.4121 62.8087 176.4691 844 L 4.0026 8.1046 122.9842 58.2777 41.8930 178.9365 845 Q 4.3741 8.4067 118.0927 59.1720 28.6305 179.0674 846 K 4.0176 8.4280 119.6363 59.6090 32.1386 179.0507 847 E 3.8919 8.4180 119.5100 59.2482 29.3068 178.8679 848 I 3.6128 8.0154 120.0978 64.2254 37.1584 178.6481 849 V 2.2210 7.7115 119.0470 65.5325 31.1030 178.0339 850 E 3.8445 8.0104 117.7974 58.9837 29.4097 178.7482 851 S 4.4559 7.8670 111.8452 59.1305 63.6827 175.2847 852 G 3.9587 6.8714 106.2730 44.4291 0.0000 174.7302 853 R 4.2821 7.7894 118.3296 55.0276 29.7629 179.3049 854 G 3.7954 8.4696 106.4755 46.8873 0.0000 174.9351 855 A 4.2574 9.0215 126.6588 52.2246 19.3162 178.3885 856 A 4.4862 8.1704 119.4982 51.3927 19.6853 178.0235 857 T 4.3436 8.2807 110.9070 60.9452 71.3774 175.9855 858 Q 3.9606 8.5082 119.6329 59.0350 28.6183 178.5603 859 Q 4.1868 8.3070 120.1072 59.6185 29.0324 178.4482 860 E 4.0214 8.2306 119.2198 59.3115 29.4559 179.1374 861 F 4.0054 8.3472 120.6128 61.5125 39.2510 176.7724 862 Y 4.5313 8.3596 116.1749 60.6081 37.7925 178.1258 863 A 4.3170 8.3118 120.7506 55.3657 18.6221 179.6974 864 K 4.0775 8.4886 115.8788 58.2417 32.7293 178.0880 865 N 4.9361 8.0009 117.9126 51.9340 39.1700 176.8070 866 S 4.2520 8.2134 117.7622 62.1867 62.9537 175.7713 867 R 4.0598 7.9784 120.8037 58.6398 30.0403 178.5815 868 W 4.2725 8.2710 127.6639 60.9466 30.6218 177.9832 869 T 3.6002 8.2231 115.6620 66.6424 67.8471 176.6258 870 E 4.1162 8.5364 120.7924 59.1824 29.4399 179.6486 871 G 3.5344 8.0242 105.9697 47.4360 0.0000 175.9718 872 L 3.8022 7.3987 120.9604 57.5415 41.6150 179.4461 873 I 3.4934 7.5913 119.7679 64.2805 37.1630 178.3677 874 S 3.8842 8.0394 113.6115 61.4590 62.3945 176.1438 875 A 3.9459 7.8923 123.3593 54.9735 18.0526 179.6086 876 S 3.8998 8.1967 112.0688 61.3127 62.4854 176.1499 877 K 3.4494 7.8813 122.1443 59.4313 31.7749 178.5798 878 A 3.9540 7.5492 120.4361 54.9757 18.2523 179.8491 879 V 3.7836 7.0818 118.1439 65.3873 31.7200 178.4654 880 G 3.6202 8.0492 105.5243 47.8252 0.0000 175.7797 881 W 4.6286 8.3418 121.8519 59.2501 29.0135 178.9306 882 G 3.6471 8.4381 105.8621 47.6062 0.0000 175.7294 883 A 4.0287 8.2027 123.0883 55.3185 18.4820 179.8027 884 T 3.8532 7.8701 113.9491 66.8535 68.4377 176.8404 885 Q 3.9747 8.3437 119.9854 58.8918 28.7349 178.5949 886 L 3.9376 7.9490 121.2281 58.2421 42.0747 179.1585 887 V 3.5693 7.9394 118.1525 65.9863 31.4690 177.6139 888 E 3.8895 8.3900 118.8715 59.1179 29.6020 178.6470 889 A 3.9542 8.4052 121.0346 55.0008 18.3970 179.4470 890 A 3.9039 8.1831 119.4102 55.2603 18.4728 179.0364 891 D 4.2830 8.2008 116.6692 57.6669 41.2270 178.8049 892 K 3.9924 8.0594 118.8168 59.5669 31.8757 179.8267 893 V 3.7662 7.2846 119.0373 63.9635 31.3682 178.3496 894 V 3.7253 7.7837 118.2189 64.9571 31.6320 176.6235 895 L 4.6267 8.2009 114.9104 54.8148 43.2444 176.1393 896 H 4.6881 7.5593 119.3771 55.4511 30.1798 174.3248 897 T 4.5552 8.5184 112.9055 62.1727 69.0686 174.7537 898 G 3.8251 7.9671 110.8919 45.9462 0.0000 173.6661 899 K 4.3306 8.0723 118.4891 55.3734 33.6347 178.2202 900 Y 4.0974 8.4109 119.8424 61.1282 37.7909 178.5863 901 E 4.0669 8.3139 119.3467 59.3973 29.4975 178.7926 902 E 4.0017 8.0368 119.5147 58.9518 29.6731 178.6246 903 L 3.9722 7.7883 120.2072 58.0230 42.2704 178.8013 904 I 3.6972 7.7467 119.5660 64.2780 36.9579 178.6075 905 V 3.6371 7.8333 119.0330 66.3830 31.4725 177.9601 906 C 4.1535 8.3361 116.4171 62.7976 27.7206 176.3927 907 S 4.1786 8.0776 117.0974 61.7101 62.3916 176.3495 908 H 4.2706 8.1339 118.9387 58.9835 28.4022 177.7673 909 E 4.0307 8.5541 120.7330 59.3966 29.2486 179.2798 910 I 3.7423 8.0143 118.5715 63.8416 38.0397 177.8433 911 A 4.0881 8.1651 123.1669 54.4465 18.1639 179.4986 912 A 4.0061 8.1082 119.7376 55.2194 18.3160 180.0352 913 S 4.1322 8.4465 113.5906 61.7692 62.9588 176.8850 914 T 3.8950 8.2401 113.2908 64.3848 68.5923 176.6124 915 A 4.0979 8.1953 123.6900 54.9571 18.2756 179.3918 916 Q 3.9496 8.0644 118.3235 59.0204 29.1085 178.1239 917 L 3.8858 7.7916 121.4621 57.9609 42.0644 179.0163 918 V 3.5977 7.9494 118.0406 65.8771 31.2987 177.8716 919 A 3.9741 8.0706 120.1972 55.3041 18.0970 179.5236 920 A 4.0042 7.9952 117.9253 55.3627 18.4185 179.7765 921 S 4.4007 8.0435 113.1883 61.6184 63.2684 176.3961 922 K 4.1230 8.5638 122.5772 59.0806 31.6093 178.7089 923 V 3.6061 7.3369 118.7669 66.0692 31.3663 177.0938 924 K 4.1960 8.0753 115.3366 56.0918 31.8841 176.1891 925 A 4.7535 7.6661 122.0183 51.1438 21.4278 178.3780 926 N 4.9305 8.1945 115.3123 53.5162 40.1523 174.8367 927 K 3.7649 7.9132 118.0596 58.0516 32.0568 174.4604 928 H 5.0482 7.5525 114.0348 54.7111 33.0452 173.2216 929 S 4.4313 8.3674 114.3666 58.2596 63.5829 173.3987 930 P 4.4975 0.0000 0.0000 63.0607 28.8067 173.5227 931 H 3.8710 8.1255 118.8349 55.6313 28.2627 176.0005 932 L 4.1810 8.1998 126.2011 57.5429 41.9110 179.0246 933 S 4.1078 8.0105 114.2842 61.2599 63.0228 176.0353 934 R 4.2231 7.9441 123.4410 58.4305 29.7510 178.0093 935 L 3.9537 7.5870 118.6840 58.3920 42.1653 178.9262 936 Q 4.0227 8.3519 118.0560 58.8048 28.4211 178.7746 937 E 3.9392 8.6765 120.0062 59.7603 29.6134 178.9125 938 C 4.0347 8.3414 117.0216 63.1422 28.1963 176.3638 939 S 4.1275 8.3346 114.5850 61.2192 61.8654 176.3429 940 R 3.9221 7.8421 120.3364 59.6350 29.8887 178.9911 941 T 4.0077 7.8102 115.3513 66.8132 68.3975 176.7449 942 V 3.6297 7.8641 119.9077 66.0551 31.5109 177.7586 943 N 4.3306 8.2535 116.1656 56.3873 38.4120 177.2843 944 E 3.9640 8.4688 120.1417 59.5807 29.5912 179.6636 945 R 3.9548 8.5603 118.2466 59.0716 30.0495 179.0761 946 A 3.9621 8.3531 120.7395 55.1239 18.3921 179.5902 947 A 4.0051 8.0583 119.2759 55.2331 18.3287 179.6866 948 N 4.2906 8.1698 115.3505 56.3518 38.6070 177.7728 949 V 3.5680 7.8152 119.7749 65.9238 31.5297 178.2994 950 V 3.5452 7.8417 117.7795 65.9547 31.3842 177.8556 951 A 3.9699 8.1510 120.5906 55.3841 18.1729 179.8549 952 S 4.1189 8.3147 113.7067 61.7140 62.7560 177.1506 953 T 3.7628 8.0144 118.6562 66.3631 68.3655 176.8332 954 K 3.8229 8.1890 120.6755 59.6294 32.2705 179.1790 955 S 4.4220 7.4513 114.6477 60.7488 62.2381 176.4576 956 G 3.4123 8.0632 108.3653 47.8301 0.0000 175.4464 957 Q 3.6107 7.6104 121.1961 58.6562 28.7085 177.8682 958 E 4.0225 7.9194 119.2509 59.4505 29.4756 178.9704 959 Q 4.0114 7.9034 117.3565 59.4871 28.7399 179.6716 960 I 3.8069 7.4937 118.6749 63.8241 37.0381 177.1212 961 E 4.5327 8.0022 118.4865 56.1485 29.5614 176.0124 962 D 4.5595 8.1963 125.8003 54.4975 41.4003 175.9049 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 773 D 8.36 4.52 0.00 2.65 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 0.00 774 V 8.35 3.48 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 0.79 0.00 0.00 0.89 0.00 0.00 775 R 8.75 4.01 0.00 2.01 1.83 0.00 3.37 0.00 0.00 3.26 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.57 0.00 776 Q 9.01 3.96 0.00 2.09 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.88 6.97 0.00 0.00 0.00 0.00 0.00 2.56 2.39 0.00 777 E 8.16 4.24 0.00 1.96 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 2.31 2.41 0.00 778 E 8.50 4.69 0.00 2.12 1.87 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 2.20 2.28 0.00 779 L 7.97 4.02 0.00 1.83 1.69 0.99 0.69 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 0.00 780 G 8.14 3.39 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 0.00 781 A 7.92 3.97 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 0.00 782 V 7.74 3.49 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 0.94 0.00 0.00 0.88 0.00 0.00 783 V 7.72 3.57 1.66 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 0.04 0.00 0.00 0.62 0.00 0.00 784 D 7.66 4.39 0.00 2.80 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 0.00 785 K 8.05 4.11 0.00 1.92 1.88 0.00 1.50 0.00 0.00 1.62 0.00 0.00 3.01 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.40 1.48 7.81 786 E 8.34 4.08 0.00 2.05 1.81 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 2.32 2.32 0.00 *788 A 8.03 4.16 1.36 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 0.00 789 A 8.20 4.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 T 8.13 3.80 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 1.17 0.00 0.00 791 S 8.01 4.11 0.00 3.98 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 0.00 792 A 8.45 3.97 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.44 4.10 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 0.00 794 I 7.98 3.75 2.02 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 1.52 0.71 0.91 0.00 0.00 795 E 8.22 3.97 0.00 2.12 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 2.49 0.00 796 D 8.37 4.33 0.00 2.85 2.73 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.10 3.98 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 0.00 798 V 7.97 3.52 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 1.03 0.00 0.00 0.95 0.00 0.00 799 R 8.14 3.91 0.00 2.05 1.96 0.00 3.19 0.00 0.00 3.17 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.89 0.00 800 R 8.23 3.94 0.00 1.79 2.00 0.00 3.18 0.00 0.00 3.23 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.79 0.00 801 I 7.82 3.87 1.94 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 0.59 0.93 0.00 0.00 802 E 8.11 4.33 0.00 2.07 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 2.35 2.49 0.00 803 D 8.02 4.39 0.00 2.80 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 *806 N 8.33 4.54 0.00 2.76 2.92 0.00 0.00 7.11 7.07 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 0.00 807 Q 8.16 4.09 0.00 2.11 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 6.59 0.00 0.00 0.00 0.00 0.00 2.38 2.61 0.00 808 A 7.85 3.97 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 0.00 809 R 7.35 4.02 0.00 1.89 2.01 0.00 3.07 0.00 0.00 3.21 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.82 0.00 810 H 7.84 4.89 0.00 3.21 3.25 0.00 5.62 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 811 A 7.78 4.65 1.26 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 0.00 0.00 812 S 7.51 4.56 0.00 3.95 3.83 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 0.00 813 S 8.58 4.31 0.00 3.81 3.78 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 0.00 814 G 8.52 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 0.00 815 V 8.31 3.59 2.09 0.00 0.00 0.00 0.00 0.00 0.00 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0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 891 D 8.20 4.28 0.00 2.88 2.89 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 0.00 892 K 8.06 3.99 0.00 1.78 1.81 0.00 1.68 0.00 0.00 1.68 0.00 0.00 3.09 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.62 1.56 7.81 893 V 7.28 3.77 1.79 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 0.87 0.00 0.00 -0.22 0.00 0.00 894 V 7.78 3.73 2.13 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 0.84 0.00 0.00 0.98 0.00 0.00 895 L 8.20 4.63 0.00 1.52 1.45 0.95 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 896 H 7.56 4.69 0.00 3.21 2.89 0.00 5.64 0.00 0.00 0.00 0.00 6.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 897 T 8.52 4.56 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 1.21 0.00 0.00 898 G 7.97 3.83 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 0.00 0.00 0.00 899 K 8.07 4.33 0.00 1.82 1.94 0.00 1.68 0.00 0.00 1.82 0.00 0.00 3.10 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.48 1.43 7.81 900 Y 8.41 4.10 0.00 3.04 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 0.00 901 E 8.31 4.07 0.00 2.09 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 0.00 2.44 2.48 0.00 902 E 8.04 4.00 0.00 2.04 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 2.29 2.35 0.00 903 L 7.79 3.97 0.00 1.83 1.93 0.94 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 904 I 7.75 3.70 2.09 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 1.42 0.79 0.95 0.00 0.00 905 V 7.83 3.64 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 1.15 0.00 0.00 0.98 0.00 0.00 906 C 8.34 4.15 0.00 3.14 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 0.00 907 S 8.08 4.18 0.00 3.96 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 0.00 908 H 8.13 4.27 0.00 3.40 3.33 0.00 5.62 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 0.00 909 E 8.55 4.03 0.00 2.03 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 0.00 2.37 2.60 0.00 910 I 8.01 3.74 1.99 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 1.47 1.38 1.01 0.00 0.00 911 A 8.17 4.09 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 0.00 912 A 8.11 4.01 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 S 8.45 4.13 0.00 4.05 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 0.00 914 T 8.24 3.90 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 0.00 915 A 8.20 4.10 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 0.00 916 Q 8.06 3.95 0.00 2.20 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.13 6.76 0.00 0.00 0.00 0.00 0.00 2.35 2.38 0.00 917 L 7.79 3.89 0.00 1.80 1.78 0.84 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 918 V 7.95 3.60 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 1.06 0.00 0.00 1.01 0.00 0.00 919 A 8.07 3.97 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 0.00 920 A 8.00 4.00 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 0.00 921 S 8.04 4.40 0.00 4.11 4.05 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 0.00 922 K 8.56 4.12 0.00 2.03 2.03 0.00 1.71 0.00 0.00 1.61 0.00 0.00 2.90 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.48 1.49 7.81 923 V 7.34 3.61 2.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.90 0.00 0.00 1.12 0.00 0.00 924 K 8.08 4.20 0.00 1.02 1.31 0.00 1.38 0.00 0.00 1.42 0.00 0.00 2.86 0.00 0.00 2.62 0.00 0.00 0.00 0.00 0.47 0.21 7.81 925 A 7.67 4.75 1.27 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 0.00 0.00 926 N 8.19 4.93 0.00 2.62 2.64 0.00 0.00 7.09 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 0.00 927 K 7.91 3.76 0.00 1.90 1.85 0.00 1.48 0.00 0.00 1.66 0.00 0.00 2.77 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.13 1.23 7.81 928 H 7.55 5.05 0.00 3.13 3.15 0.00 5.62 0.00 0.00 0.00 0.00 6.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 929 S 8.37 4.43 0.00 3.98 3.80 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 0.00 0.00 0.00 0.00 930 P 0.00 4.50 0.00 2.11 2.11 0.00 3.87 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.13 0.00 931 H 8.13 3.87 0.00 3.37 3.39 0.00 5.81 0.00 0.00 0.00 0.00 6.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 932 L 8.20 4.18 0.00 1.77 1.67 0.96 0.70 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 0.00 933 S 8.01 4.11 0.00 4.12 4.13 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 0.00 934 R 7.94 4.22 0.00 1.95 2.09 0.00 3.35 0.00 0.00 2.97 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.59 0.00 935 L 7.59 3.95 0.00 1.87 1.85 0.97 0.92 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 0.00 936 Q 8.35 4.02 0.00 2.34 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.59 0.00 0.00 0.00 0.00 0.00 2.40 2.61 0.00 937 E 8.68 3.94 0.00 2.17 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 2.53 0.00 938 C 8.34 4.03 0.00 3.17 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 0.00 939 S 8.33 4.13 0.00 3.90 3.97 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 0.00 940 R 7.84 3.92 0.00 2.12 1.97 0.00 3.20 0.00 0.00 3.17 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.85 0.00 941 T 7.81 4.01 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 0.00 942 V 7.86 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 1.12 0.00 0.00 0.95 0.00 0.00 943 N 8.25 4.33 0.00 3.04 2.86 0.00 0.00 7.05 6.96 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 0.00 944 E 8.47 3.96 0.00 2.14 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 2.65 0.00 945 R 8.56 3.95 0.00 1.91 1.98 0.00 3.29 0.00 0.00 3.17 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 1.80 0.00 946 A 8.35 3.96 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 0.00 947 A 8.06 4.01 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 0.00 948 N 8.17 4.29 0.00 2.95 2.87 0.00 0.00 6.54 7.19 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 0.00 949 V 7.82 3.57 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 1.00 0.00 0.00 0.95 0.00 0.00 950 V 7.84 3.55 2.19 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 1.05 0.00 0.00 0.85 0.00 0.00 951 A 8.15 3.97 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 0.00 952 S 8.31 4.12 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 0.00 953 T 8.01 3.76 4.38 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 1.28 0.00 0.00 954 K 8.19 3.82 0.00 1.89 1.83 0.00 1.67 0.00 0.00 1.57 0.00 0.00 2.90 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.45 1.62 7.81 955 S 7.45 4.42 0.00 3.86 3.87 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 0.00 956 G 8.06 3.41 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 0.00 957 Q 7.61 3.61 0.00 1.67 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.90 0.00 0.00 0.00 0.00 0.00 2.36 2.47 0.00 958 E 7.92 4.02 0.00 2.24 1.94 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 2.29 2.59 0.00 959 Q 7.90 4.01 0.00 2.09 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.77 0.00 0.00 0.00 0.00 0.00 2.36 2.55 0.00 960 I 7.49 3.81 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 0.63 0.99 0.00 0.00 961 E 8.00 4.53 0.00 2.05 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 2.33 2.56 0.00 962 D 8.20 4.56 0.00 2.73 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 * Residues marked with a * may have inaccurate shift predictions.