NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- -2 S 4.4730 8.1933 116.7945 58.4695 64.5401 174.4788 -1 S 3.7572 8.3544 117.0814 60.3993 63.3135 174.4150 *838 P 4.4056 0.0000 0.0000 62.3701 34.2775 178.1476 839 L 3.9959 8.0017 117.8199 57.9749 41.3577 179.4972 840 L 4.0120 7.5208 118.3378 57.7301 41.5087 179.5193 841 K 3.9576 7.8240 118.5319 59.3990 31.7803 179.3757 842 S 4.0698 8.1408 113.1539 61.4487 62.5828 176.0329 843 A 4.0853 7.5886 122.1411 54.3064 17.9844 178.9620 844 E 3.9762 8.0372 117.7145 58.7661 29.6380 178.8144 845 R 3.9301 7.7340 119.2904 59.3433 30.1024 178.2118 846 E 4.1041 7.9403 118.5074 58.9580 29.2527 179.2993 847 K 3.8812 7.9320 119.5362 59.6631 32.2902 178.7414 848 E 3.9379 7.8571 118.6536 59.6777 29.2830 179.3307 849 M 3.9333 8.5189 118.9115 58.3683 31.3768 178.7223 850 A 3.9095 7.7915 120.8026 54.9941 18.4144 179.6671 851 S 4.2943 8.4005 112.1743 61.6227 62.4040 176.3346 852 M 4.0317 8.2972 122.0388 57.9424 31.5208 178.1389 853 K 3.5955 7.8943 117.9304 57.8328 32.6855 177.2277 854 E 4.3949 7.4522 119.1284 58.5014 30.4256 177.2793 855 E 4.0542 7.9368 118.7486 59.4253 29.4904 178.9317 856 F 4.2372 8.5894 117.7832 61.3032 38.9134 177.7346 857 T 3.9317 8.0857 114.2997 66.8203 68.3449 176.4858 858 R 3.9161 7.9578 120.0428 59.5077 30.1538 178.6303 859 L 4.0198 8.4188 119.2164 57.4577 41.5681 179.2320 860 K 3.8428 8.1631 118.6652 59.8730 32.0440 179.0574 861 E 3.9525 7.9282 118.1841 59.3823 29.5938 179.2440 862 A 4.1182 8.2008 120.3031 54.1680 18.3013 179.5036 863 L 3.8830 7.9609 119.4784 58.3993 42.4989 178.5064 864 E 3.9949 8.2320 118.5262 59.4106 29.3325 179.6851 865 K 3.8999 8.0612 119.4492 59.4339 32.3658 178.5176 866 S 4.0944 7.8002 113.0312 61.8619 62.2536 176.2466 867 E 4.0149 8.6253 121.0916 59.3033 29.0523 179.1923 868 A 4.0809 7.9797 120.3670 54.6822 18.4362 179.7299 869 R 3.8581 8.0470 117.7098 59.3813 30.1830 178.5497 870 R 3.9101 8.3444 118.3878 59.6025 30.1984 179.1107 871 K 4.0931 7.9903 117.7535 59.3486 31.4988 179.1616 872 E 4.0988 7.9994 119.6056 59.1892 29.6377 178.7979 873 L 3.9776 7.9479 118.8945 57.8781 41.5927 178.9458 874 E 3.9614 8.6272 119.1148 59.7300 29.3593 179.4563 875 E 4.2218 8.1646 114.4422 58.0453 29.8966 177.8702 876 K 4.4183 7.5574 118.1044 57.2776 33.2520 178.0084 877 M 4.1322 8.0836 119.3462 57.7303 31.6296 178.8241 878 V 3.5800 7.3979 117.5845 66.0092 31.6838 178.2995 879 S 4.0909 7.9236 114.3392 61.8610 62.8738 175.5591 880 L 3.8570 7.6244 122.7934 58.5541 41.7893 178.4655 881 L 3.9877 8.2856 119.6317 58.6131 41.9006 179.2584 882 Q 4.0038 7.9329 119.3151 58.7604 28.8946 177.6700 883 E 3.9336 8.3302 120.7584 59.0424 29.7595 178.5578 884 K 3.9407 8.6034 120.0184 59.6155 32.0501 178.5345 885 N 4.4184 8.1572 116.6390 56.2070 38.4435 177.2009 886 D 4.3784 7.9517 120.5635 57.2507 40.4677 178.6400 887 L 4.1233 8.3627 119.4131 56.9722 41.3493 179.3326 888 Q 3.9641 7.7915 119.8919 59.1783 29.1201 177.9651 889 L 4.0263 7.7451 119.7737 57.6796 41.4234 179.5471 890 Q 4.0143 8.2278 118.4275 58.7119 28.5560 178.4479 891 V 3.6290 7.4901 118.5912 66.3279 31.5922 177.8808 892 Q 3.9730 7.9201 117.2493 59.2418 28.3454 179.2765 893 A 4.1359 8.1138 121.1693 53.9699 17.8129 178.3051 894 E 4.5902 7.7638 115.1183 56.4474 30.0402 177.5565 895 Q 4.3879 8.1571 119.3899 57.9377 29.2588 177.8727 896 D 4.3551 8.0052 120.1608 57.5461 41.0022 178.5391 897 N 4.3750 7.8582 116.7513 55.9672 38.4601 177.0598 898 L 3.8985 7.4614 122.1320 58.3832 42.0375 178.9921 899 A 4.1434 7.7225 118.8393 54.5404 18.2072 179.4644 900 D 4.2782 8.0139 117.3744 57.4830 40.5842 178.4141 901 A 4.1790 8.0608 120.1095 53.9820 18.1553 179.0337 902 E 4.1190 8.0582 117.6129 58.4174 29.6683 178.1393 903 E 4.1518 7.9646 116.9626 58.3741 29.9937 179.0507 904 R 4.0863 7.7772 119.7852 59.2405 30.2196 178.4726 905 C 4.2374 7.9290 116.1429 62.1303 27.8578 174.7709 906 D 4.7192 7.4631 117.3258 54.2354 40.9274 177.4658 907 Q 4.2614 7.5751 120.3901 58.5152 29.5839 177.3179 908 L 4.1096 7.7178 119.8138 58.2632 41.6813 179.8385 909 I 3.7091 7.8894 119.3394 64.2366 37.0437 178.5812 910 K 3.9538 7.9280 118.8365 59.6448 31.9738 178.9738 911 N 4.3570 8.2519 116.7258 55.9457 38.3334 177.2519 912 K 3.8644 8.2235 121.2341 59.7667 32.0768 178.7440 913 I 3.7178 7.7766 118.6388 63.8170 37.6583 177.1832 914 Q 4.3004 8.2008 117.5896 56.8792 28.7078 177.4501 915 L 4.2895 7.7011 120.1749 56.8970 42.4094 178.4196 916 E 4.0336 8.4224 118.3501 59.0090 29.2789 178.8396 917 A 4.3021 7.6093 118.6715 53.5721 19.1166 179.1032 918 K 4.0236 7.6716 118.0517 59.3257 32.0474 179.0274 919 V 3.6606 8.2020 119.4735 65.5358 31.4648 177.7321 920 K 3.8346 7.6326 118.5017 58.7269 32.3954 177.4579 921 E 4.2707 7.7225 117.5273 58.9745 30.1182 177.4136 922 M 4.0672 7.6893 117.2650 58.6767 31.9492 177.9549 923 N 4.3735 8.5246 117.1417 56.0575 38.5789 177.1585 924 K 4.1164 7.9279 118.7339 58.2348 32.0066 178.6185 925 R 4.2490 7.8768 117.3049 57.2346 30.3892 178.3565 926 L 4.0429 7.9345 120.9067 57.8258 42.1953 178.2961 927 E 4.1956 7.7834 120.4671 59.0070 29.7466 178.6118 928 D 4.4144 7.9390 118.9614 57.0762 40.7334 178.3563 929 E 3.9900 7.8139 119.0558 59.1318 29.0926 178.7120 930 E 3.9957 8.2165 118.8673 59.4340 29.4281 179.1403 931 E 4.0857 8.2117 118.4172 59.2017 29.5486 178.7788 932 M 4.1467 8.0204 117.7895 57.7410 32.2606 177.8042 933 N 4.2731 7.8881 117.2140 56.7296 39.1130 176.7061 934 A 4.1023 7.9189 121.9912 54.9977 18.3313 179.2921 935 E 3.8657 8.0363 117.8584 59.4152 29.7651 179.0948 936 L 3.9973 7.8104 118.6240 58.0135 41.5839 179.4353 937 T 3.7914 8.5055 115.9125 66.3869 68.3617 176.1693 938 A 3.9741 8.1911 122.7487 55.6015 18.2964 179.7575 939 K 3.8812 8.3419 117.8586 59.1018 32.1973 178.7825 940 K 3.8930 8.3926 120.5507 59.6962 32.0590 179.0145 941 R 3.8954 8.2518 118.2469 59.3014 29.5964 178.9516 942 K 3.8696 8.2573 118.5164 59.5198 31.8813 178.8488 943 L 4.1863 7.6961 118.8632 56.8978 41.8174 178.6870 944 E 3.9956 8.1114 118.6661 59.8289 29.4802 179.2242 945 D 4.3346 8.7449 118.9132 57.2396 40.8138 178.6373 946 E 3.9551 7.8154 119.0442 59.4125 29.7877 178.5114 947 C 4.1794 8.7763 117.5243 62.6893 28.2186 176.1696 948 S 4.0617 8.3696 115.0968 61.4790 62.1537 175.9717 949 E 4.0084 8.1713 121.2892 59.4949 29.1302 179.4706 950 L 4.0543 8.0569 119.0452 57.6341 41.7600 179.6105 951 K 4.0234 8.0776 118.4615 59.4009 31.8479 179.6683 952 R 3.9755 7.8443 118.1488 59.1230 29.9686 178.8361 953 D 4.3191 8.0607 118.5282 57.3070 40.8399 178.4654 954 I 3.6520 7.7893 120.4153 64.6245 37.2888 177.7832 955 D 4.2509 7.9817 118.0951 57.6688 40.9406 177.6839 956 D 4.4151 8.1735 118.4156 57.4997 41.0318 178.8854 957 L 4.0964 7.9033 120.3513 58.2609 42.1664 178.7612 958 E 4.1134 8.6108 118.2260 58.4787 29.1243 178.4652 959 L 4.3306 7.5972 117.5447 55.9110 42.1957 177.9557 960 T 4.1999 7.6162 108.2394 62.9393 69.2051 175.7190 961 L 4.3983 7.8489 120.3655 55.2262 42.7257 175.9209 962 A 4.3334 7.5909 125.7037 52.1083 19.1714 175.8660 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 -2 S 8.19 4.47 0.00 3.90 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 -1 S 8.35 3.76 0.00 3.96 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 *838 P 0.00 4.41 0.00 2.20 2.13 0.00 3.67 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.11 0.00 839 L 8.00 4.00 0.00 1.85 1.73 0.95 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 840 L 7.52 4.01 0.00 1.77 1.70 0.92 0.64 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 0.00 841 K 7.82 3.96 0.00 1.88 1.86 0.00 1.66 0.00 0.00 1.57 0.00 0.00 2.88 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.46 1.45 7.81 842 S 8.14 4.07 0.00 4.04 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 843 A 7.59 4.09 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 0.00 844 E 8.04 3.98 0.00 2.23 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 2.30 2.30 0.00 845 R 7.73 3.93 0.00 1.87 2.05 0.00 3.14 0.00 0.00 3.16 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.65 0.00 846 E 7.94 4.10 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 2.54 2.45 0.00 847 K 7.93 3.88 0.00 1.94 1.95 0.00 1.63 0.00 0.00 1.64 0.00 0.00 2.93 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.42 1.46 7.81 848 E 7.86 3.94 0.00 2.15 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 2.32 2.34 0.00 849 M 8.52 3.93 0.00 1.94 2.20 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.49 0.00 850 A 7.79 3.91 1.32 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 0.00 0.00 0.00 851 S 8.40 4.29 0.00 3.86 3.96 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 M 8.30 4.03 0.00 1.71 2.10 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.60 0.00 853 K 7.89 3.60 0.00 1.66 1.69 0.00 1.65 0.00 0.00 1.55 0.00 0.00 2.95 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.38 1.31 7.81 854 E 7.45 4.39 0.00 2.38 1.89 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 2.22 2.32 0.00 855 E 7.94 4.05 0.00 2.23 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 2.37 2.55 0.00 856 F 8.59 4.24 0.00 2.96 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 0.00 857 T 8.09 3.93 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 1.24 0.00 0.00 858 R 7.96 3.92 0.00 2.12 2.08 0.00 3.11 0.00 0.00 3.19 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.69 0.00 859 L 8.42 4.02 0.00 1.69 1.68 1.00 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 860 K 8.16 3.84 0.00 2.03 2.05 0.00 1.86 0.00 0.00 1.68 0.00 0.00 2.92 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.46 1.48 7.81 861 E 7.93 3.95 0.00 2.09 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 2.33 0.00 862 A 8.20 4.12 1.32 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 0.00 0.00 0.00 863 L 7.96 3.88 0.00 1.89 1.83 0.94 0.65 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 0.00 864 E 8.23 3.99 0.00 2.18 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 2.34 2.34 0.00 865 K 8.06 3.90 0.00 1.94 1.94 0.00 1.66 0.00 0.00 1.57 0.00 0.00 2.92 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.43 1.44 7.81 866 S 7.80 4.09 0.00 4.14 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 0.00 867 E 8.63 4.01 0.00 2.01 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 2.46 0.00 868 A 7.98 4.08 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 0.00 869 R 8.05 3.86 0.00 2.05 2.13 0.00 3.16 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 1.62 1.71 0.00 870 R 8.34 3.91 0.00 1.99 1.97 0.00 3.18 0.00 0.00 3.27 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.76 0.00 871 K 7.99 4.09 0.00 1.82 1.86 0.00 1.66 0.00 0.00 1.57 0.00 0.00 2.91 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.46 1.62 7.81 872 E 8.00 4.10 0.00 2.12 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 2.30 2.34 0.00 873 L 7.95 3.98 0.00 1.90 1.69 0.92 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 874 E 8.63 3.96 0.00 2.09 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 2.34 2.35 0.00 875 E 8.16 4.22 0.00 2.13 2.29 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 2.46 2.34 0.00 876 K 7.56 4.42 0.00 1.79 1.86 0.00 1.68 0.00 0.00 1.65 0.00 0.00 2.93 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.52 1.59 7.81 877 M 8.08 4.13 0.00 2.04 2.11 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 2.86 0.00 878 V 7.40 3.58 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 0.00 879 S 7.92 4.09 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 0.00 880 L 7.62 3.86 0.00 1.94 1.63 0.92 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 881 L 8.29 3.99 0.00 1.89 1.73 0.92 0.43 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 0.00 882 Q 7.93 4.00 0.00 2.27 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.61 0.00 0.00 0.00 0.00 0.00 2.35 2.40 0.00 883 E 8.33 3.93 0.00 2.24 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 2.30 2.35 0.00 884 K 8.60 3.94 0.00 1.77 1.92 0.00 1.70 0.00 0.00 1.65 0.00 0.00 2.93 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.44 1.63 7.81 885 N 8.16 4.42 0.00 2.91 2.84 0.00 0.00 6.97 7.69 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 0.00 886 D 7.95 4.38 0.00 2.79 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 0.00 887 L 8.36 4.12 0.00 1.81 1.71 0.92 0.69 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 0.00 888 Q 7.79 3.96 0.00 2.29 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.80 0.00 0.00 0.00 0.00 0.00 2.35 2.44 0.00 889 L 7.75 4.03 0.00 1.84 1.70 0.92 1.18 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 0.00 890 Q 8.23 4.01 0.00 2.11 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.10 6.79 0.00 0.00 0.00 0.00 0.00 2.38 2.36 0.00 891 V 7.49 3.63 2.31 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 1.03 0.00 0.00 0.95 0.00 0.00 892 Q 7.92 3.97 0.00 2.08 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.58 0.00 0.00 0.00 0.00 0.00 2.39 2.54 0.00 893 A 8.11 4.14 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 0.00 894 E 7.76 4.59 0.00 1.92 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 2.35 2.44 0.00 895 Q 8.16 4.39 0.00 2.20 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.73 6.83 0.00 0.00 0.00 0.00 0.00 2.34 2.39 0.00 896 D 8.01 4.36 0.00 2.79 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 0.00 897 N 7.86 4.38 0.00 2.85 2.86 0.00 0.00 6.71 6.46 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 0.00 898 L 7.46 3.90 0.00 2.09 1.88 0.92 1.17 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 0.00 899 A 7.72 4.14 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 0.00 900 D 8.01 4.28 0.00 2.87 2.72 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 0.00 0.00 0.00 0.00 901 A 8.06 4.18 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 0.00 902 E 8.06 4.12 0.00 2.12 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 2.36 2.45 0.00 903 E 7.96 4.15 0.00 2.15 2.34 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 2.28 2.34 0.00 904 R 7.78 4.09 0.00 1.94 2.01 0.00 3.12 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 1.64 1.66 0.00 905 C 7.93 4.24 0.00 3.11 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 0.00 906 D 7.46 4.72 0.00 2.63 2.68 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 7.58 4.26 0.00 2.37 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.36 6.71 0.00 0.00 0.00 0.00 0.00 2.29 2.42 0.00 908 L 7.72 4.11 0.00 1.95 1.73 0.95 0.87 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 0.00 909 I 7.89 3.71 1.96 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 0.65 0.91 0.00 0.00 910 K 7.93 3.95 0.00 1.94 1.86 0.00 1.67 0.00 0.00 1.82 0.00 0.00 2.94 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.53 1.53 7.81 911 N 8.25 4.36 0.00 2.92 2.86 0.00 0.00 6.68 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 0.00 912 K 8.22 3.86 0.00 2.05 1.81 0.00 1.63 0.00 0.00 1.57 0.00 0.00 2.96 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.44 1.46 7.81 913 I 7.78 3.72 2.00 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 1.18 0.95 0.00 0.00 914 Q 8.20 4.30 0.00 2.30 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.40 0.00 0.00 0.00 0.00 0.00 2.36 2.39 0.00 915 L 7.70 4.29 0.00 1.76 1.69 0.92 0.63 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 0.00 916 E 8.42 4.03 0.00 2.07 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 2.34 2.49 0.00 917 A 7.61 4.30 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 0.00 918 K 7.67 4.02 0.00 2.04 1.98 0.00 1.52 0.00 0.00 1.57 0.00 0.00 2.97 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.43 1.49 7.81 919 V 8.20 3.66 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 0.00 920 K 7.63 3.83 0.00 2.00 1.84 0.00 1.84 0.00 0.00 1.63 0.00 0.00 2.98 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.46 1.46 7.81 921 E 7.72 4.27 0.00 2.20 1.90 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 2.25 2.44 0.00 922 M 7.69 4.07 0.00 2.15 2.24 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 2.60 2.58 0.00 923 N 8.52 4.37 0.00 2.95 2.85 0.00 0.00 6.93 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 0.00 924 K 7.93 4.12 0.00 1.76 1.85 0.00 1.67 0.00 0.00 1.82 0.00 0.00 2.94 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.51 1.46 7.81 925 R 7.88 4.25 0.00 1.89 1.96 0.00 3.12 0.00 0.00 3.22 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.78 0.00 926 L 7.93 4.04 0.00 2.00 1.65 0.92 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 927 E 7.78 4.20 0.00 2.29 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 2.30 2.21 0.00 928 D 7.94 4.41 0.00 2.87 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 0.00 929 E 7.81 3.99 0.00 2.34 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 2.30 2.39 0.00 930 E 8.22 4.00 0.00 2.25 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 2.33 2.56 0.00 931 E 8.21 4.09 0.00 2.04 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 2.31 0.00 932 M 8.02 4.15 0.00 2.29 2.05 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.58 0.00 933 N 7.89 4.27 0.00 2.98 2.84 0.00 0.00 6.91 9.28 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 0.00 934 A 7.92 4.10 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 0.00 935 E 8.04 3.87 0.00 2.00 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 2.30 2.35 0.00 936 L 7.81 4.00 0.00 1.96 1.69 0.92 0.80 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 0.00 937 T 8.51 3.79 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 0.00 938 A 8.19 3.97 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 0.00 939 K 8.34 3.88 0.00 2.04 1.81 0.00 1.65 0.00 0.00 1.57 0.00 0.00 2.94 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.43 1.44 7.81 940 K 8.39 3.89 0.00 1.92 1.98 0.00 1.68 0.00 0.00 1.65 0.00 0.00 2.93 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.44 1.49 7.81 941 R 8.25 3.90 0.00 2.01 1.95 0.00 3.21 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 1.79 1.66 0.00 942 K 8.26 3.87 0.00 1.89 1.90 0.00 1.65 0.00 0.00 1.65 0.00 0.00 2.93 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.47 1.51 7.81 943 L 7.70 4.19 0.00 1.81 1.70 0.96 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 944 E 8.11 4.00 0.00 2.20 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 2.33 2.37 0.00 945 D 8.74 4.33 0.00 2.64 2.72 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 0.00 0.00 0.00 0.00 946 E 7.82 3.96 0.00 2.21 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 2.30 2.34 0.00 947 C 8.78 4.18 0.00 2.96 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 0.00 948 S 8.37 4.06 0.00 3.88 4.08 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 0.00 0.00 0.00 949 E 8.17 4.01 0.00 2.16 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 2.50 0.00 950 L 8.06 4.05 0.00 1.84 1.71 0.96 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 951 K 8.08 4.02 0.00 2.00 1.86 0.00 1.66 0.00 0.00 1.65 0.00 0.00 2.93 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.46 1.71 7.81 952 R 7.84 3.98 0.00 2.05 1.97 0.00 3.12 0.00 0.00 3.17 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.79 0.00 953 D 8.06 4.32 0.00 2.88 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 0.00 954 I 7.79 3.65 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 1.41 0.80 0.91 0.00 0.00 955 D 7.98 4.25 0.00 2.95 2.80 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 0.00 956 D 8.17 4.42 0.00 2.79 2.75 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 0.00 0.00 0.00 957 L 7.90 4.10 0.00 1.97 1.87 0.92 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 958 E 8.61 4.11 0.00 2.12 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 2.33 2.60 0.00 959 L 7.60 4.33 0.00 1.79 1.71 0.97 0.69 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 0.00 960 T 7.62 4.20 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 1.25 0.00 0.00 961 L 7.85 4.40 0.00 1.63 1.75 0.92 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 962 A 7.59 4.33 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 * Residues marked with a * may have inaccurate shift predictions.