NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 773 D 4.6137 8.3493 120.5308 54.1296 41.8912 174.7190 774 V 3.8174 8.1688 124.5625 59.7751 32.8154 174.6255 775 R 3.9354 9.3268 123.0066 56.6839 31.6233 178.5359 776 Q 3.9556 9.0634 122.4207 59.3340 28.8364 179.0255 777 E 4.1972 8.1932 114.9485 58.3153 29.7928 177.0708 778 E 4.7977 8.7839 117.2528 55.2363 31.2882 177.3750 779 L 4.0182 7.9188 121.0284 57.9701 41.5304 179.6787 780 G 3.4631 8.0456 105.2690 47.7624 0.0000 175.6899 781 A 4.0003 7.9880 122.9540 54.6161 18.4197 179.8325 782 V 3.4440 7.8738 117.1032 66.0382 31.4388 178.6769 783 V 3.4305 7.7463 117.9803 64.8144 31.1579 177.7049 784 D 4.3961 7.6001 118.6044 56.8504 40.8854 178.3418 785 K 4.0928 7.8727 119.9737 59.3676 32.1788 179.7357 786 E 4.1686 8.3258 117.6289 56.5531 29.2701 178.7895 *788 A 4.1879 8.0840 123.9658 52.1936 20.8312 179.8564 789 A 3.9859 8.1174 117.8549 55.4811 18.3156 180.0981 790 T 3.7864 8.0057 114.3975 66.9232 68.5659 177.2851 791 S 4.1302 7.9928 116.4087 61.4063 62.8166 176.4677 792 A 3.9944 8.2490 123.5025 55.0433 18.1435 179.5563 793 A 3.9451 8.1992 119.4048 55.3151 18.4306 179.9991 794 I 3.7197 7.9193 118.4396 64.4979 37.0773 178.5214 795 E 3.9830 8.2842 119.5403 59.4173 29.2419 178.8619 796 D 4.2882 8.4249 118.0784 57.1886 41.1959 178.2007 797 A 3.9904 8.0586 121.3785 55.0288 18.4040 179.6944 798 V 3.5225 7.8694 116.7236 66.2000 31.6263 178.4051 799 R 3.9118 8.1940 117.8546 59.5521 29.7554 179.3779 800 R 3.9788 8.1460 116.6863 59.2919 30.0752 178.9560 801 I 3.9255 7.8181 119.0884 64.2456 37.1616 178.0060 802 E 4.3414 8.0645 118.8840 58.3754 30.0308 177.3586 803 D 4.3480 8.0605 119.3965 54.4846 40.2249 175.5738 *806 N 4.5612 8.3247 124.3822 53.3376 41.0989 176.5728 807 Q 4.0378 8.2681 116.9439 58.8794 28.7014 178.7195 808 A 4.0131 7.9080 121.4398 55.0874 18.3034 179.4655 809 R 3.9987 7.5792 115.2721 58.5496 30.1501 177.7167 810 H 4.8224 7.8007 114.0326 55.5625 29.8290 174.9511 811 A 4.6298 7.6463 121.7150 51.8819 20.1351 175.5932 812 S 4.5929 7.5815 108.7267 57.6846 65.9150 172.3627 813 S 4.4431 8.4855 113.5142 58.2764 65.9298 174.4903 814 G 3.8059 8.5616 107.7098 46.3864 0.0000 175.5148 815 V 3.5634 8.4636 117.3708 65.9474 31.5259 178.3284 816 K 3.8850 8.0751 118.7797 59.5393 32.0481 178.2682 817 L 3.9246 7.6807 120.3162 58.0408 42.0444 178.2240 818 E 3.9184 8.1865 119.2361 59.7376 29.5770 179.4127 819 V 3.6749 8.1522 112.5374 64.4215 31.5096 178.4249 820 N 4.5116 8.3476 116.2656 56.0884 38.2271 177.4146 821 E 3.9760 8.3161 120.4066 59.2930 29.5832 179.1608 822 R 3.8756 7.8569 118.3782 59.3262 29.9967 178.7507 823 I 3.6946 7.8542 119.6167 64.4559 37.1906 178.3409 824 L 3.9878 8.2314 120.1702 57.8109 41.3972 179.2132 825 N 4.3006 8.4455 117.2080 56.6942 39.0308 176.8936 826 S 4.1033 8.1054 114.6032 61.6789 62.2525 175.9695 827 C 4.2174 8.1553 118.7406 62.8979 27.8481 176.0493 828 T 4.0374 7.6407 116.8027 66.7624 68.4162 176.0977 829 D 4.5691 8.0849 120.8339 57.1706 40.7882 179.2554 830 L 4.0410 7.8695 118.0010 55.7114 41.8973 178.6182 *832 K 4.2274 8.1084 118.7102 55.8598 34.2821 178.1266 833 A 4.0389 8.0928 120.6051 55.1343 18.0729 179.7921 834 I 3.7142 7.9004 118.5248 64.1607 37.1494 178.4493 835 R 3.8541 7.8767 119.2356 59.5686 29.9588 178.2465 836 L 3.9912 7.9200 119.9968 57.8180 42.0416 178.6717 837 L 3.9264 8.0190 120.5454 58.1359 42.0410 179.1127 838 V 3.6000 8.0668 118.4987 66.3455 31.4313 178.1217 839 T 3.8755 7.9751 115.5069 67.0026 68.2972 176.8554 840 T 4.0101 8.0659 117.9292 66.3163 68.3659 177.0167 841 S 4.2674 8.1566 116.4504 61.5076 63.2327 176.7057 842 T 3.8854 8.1668 119.5426 66.4603 68.1372 176.8883 843 S 4.1576 8.0353 117.2504 61.4319 62.8974 176.3840 844 L 4.0265 8.0763 123.0398 58.2097 41.7466 178.9723 845 Q 4.4260 8.4317 118.0778 59.2188 28.7338 178.9560 846 K 3.9472 8.2346 119.3655 59.5305 31.9891 178.9630 847 E 3.9118 8.2989 119.4348 59.3638 29.6247 178.9663 848 I 3.5702 7.9085 119.8579 64.2718 36.9813 178.6647 849 V 2.0694 7.8753 119.2988 65.5109 31.0755 178.0315 850 E 3.8164 8.1243 117.7722 59.2771 29.4178 178.9417 851 S 4.2714 8.1939 112.7335 60.0527 62.5349 175.2678 852 G 4.0820 7.1991 105.0172 44.3117 0.0000 174.7859 853 R 4.3290 7.6779 119.2233 55.5820 29.7753 178.6589 854 G 3.7137 8.4833 105.8809 46.9654 0.0000 173.9439 855 A 4.3387 8.9523 126.2777 51.6938 18.7106 177.5701 856 A 4.8856 8.0758 119.6944 50.5946 20.5000 178.4067 857 T 4.2967 8.2718 111.0214 61.1011 71.2194 175.8532 858 Q 3.9228 8.5639 119.9665 59.0724 28.5709 178.8763 859 Q 4.2371 8.2139 119.9954 59.5735 29.0386 178.2431 860 E 4.0109 8.1852 119.0615 59.3075 29.2160 179.1866 861 F 3.9893 8.0955 120.0181 61.3199 39.7605 176.5980 862 Y 4.5556 8.4104 116.3366 61.2977 37.5603 178.2688 863 A 4.0812 8.2275 120.4703 55.2445 18.5442 179.3674 864 K 4.0475 8.2903 117.0793 58.1653 33.1131 176.6259 865 N 5.0516 7.9347 117.1440 51.4930 39.4580 176.0962 866 S 4.2078 8.3237 115.6873 62.0754 62.9384 176.0307 867 R 4.0481 7.9610 120.6460 58.7884 29.9844 178.4426 868 W 4.3423 8.3259 127.5724 60.9936 30.6848 177.8144 869 T 3.5756 8.2328 115.4691 66.7766 67.9143 176.4819 870 E 4.0054 8.5037 120.6502 59.3075 29.4313 179.7228 871 G 3.5598 8.1038 105.8220 47.4474 0.0000 175.9532 872 L 3.7988 7.4898 121.3208 57.5895 41.5952 179.4942 873 I 3.5462 7.6477 120.0436 64.2865 37.0654 178.7303 874 S 3.9544 8.1091 114.9089 61.4005 62.9081 176.4150 875 A 3.9454 7.9402 124.5991 54.5903 18.0559 179.6307 876 S 3.9102 8.0679 111.8918 61.2516 62.4218 176.1346 877 K 3.4336 7.8810 122.1480 59.3929 31.7152 178.5410 878 A 3.9925 7.6228 120.7909 55.0875 18.2291 179.8256 879 V 3.6243 7.5718 116.6691 65.9297 31.7068 178.5089 880 G 3.5516 7.9611 105.5199 47.7594 0.0000 175.7675 881 W 4.6257 8.3459 121.9872 59.3244 29.0103 178.8137 882 G 3.6920 8.5239 105.8808 47.8273 0.0000 175.6392 883 A 4.0847 8.1420 123.0725 55.1025 18.4235 179.8454 884 T 3.8462 7.9351 114.0259 66.8203 68.4797 176.8275 885 Q 3.9543 8.4054 120.1433 58.9951 28.7460 178.6194 886 L 3.9392 7.9359 121.2593 58.1659 41.9946 179.2204 887 V 3.5636 7.8282 118.1687 65.9862 31.5165 177.6157 888 E 3.9014 8.2576 118.9048 59.2062 29.5094 178.6967 889 A 3.9627 8.3071 120.7901 55.0118 18.4571 179.5225 890 A 3.9279 8.2528 119.5379 55.1534 18.4471 179.2376 891 D 4.2695 8.3893 116.9004 57.5130 41.2790 178.5684 892 K 3.9621 8.1002 119.0598 59.6478 31.8924 179.7036 893 V 3.5876 7.3978 117.6298 64.3484 31.5227 178.2144 894 V 3.7681 7.7530 118.1685 64.7073 31.6003 176.5012 895 L 4.6397 8.1937 115.9032 54.8238 43.9149 176.3492 896 H 4.9194 7.6299 117.4523 55.8692 29.1382 174.2613 897 T 4.5280 8.5532 114.7577 62.1776 68.8624 174.5300 898 G 3.8181 7.9462 111.5309 46.0226 0.0000 173.6696 899 K 4.4556 8.0025 117.8422 54.9575 33.9424 177.9941 900 Y 4.0959 8.3428 119.7097 61.0751 37.8097 178.3875 901 E 4.0328 8.4037 119.3668 59.6249 29.4812 178.9090 902 E 3.9691 8.0254 119.3513 59.0939 29.6929 178.6349 903 L 3.9859 7.9013 120.0553 58.0337 42.2186 178.9064 904 I 3.6928 7.8012 119.8054 64.3702 36.9996 178.5818 905 V 3.6704 7.9281 119.0836 66.3089 31.3630 177.9224 906 C 4.1857 8.3751 116.4723 62.7328 27.7505 176.2959 907 S 4.1743 8.0683 117.1410 61.6675 62.3907 176.4067 908 H 4.2601 8.1660 118.9946 59.0110 28.4413 177.7520 909 E 4.0461 8.5418 120.7201 59.3865 29.2145 179.3063 910 I 3.7214 7.9521 118.6408 63.8554 38.0511 177.8240 911 A 4.0772 8.1534 123.1010 54.5294 18.2418 179.4995 912 A 4.0068 8.1139 119.3633 55.3793 18.4689 180.0896 913 S 4.1492 8.3651 114.2839 61.8770 63.0001 177.0116 914 T 3.9217 8.2426 112.5060 64.6673 68.6957 176.6264 915 A 4.1263 8.1745 123.4925 54.6938 18.2935 179.2300 916 Q 4.0036 7.8959 117.8955 58.7814 29.1292 177.8007 917 L 3.9331 7.7883 121.6160 57.8786 42.0946 179.0843 918 V 3.5639 7.8533 117.9738 66.0120 31.3110 177.7098 919 A 4.0188 7.6594 118.3870 55.3721 18.6368 179.2081 920 A 4.1467 8.5037 119.5330 55.2695 18.1504 180.1600 921 S 4.3847 8.0203 113.4394 61.5185 63.4774 176.3473 922 K 4.3456 8.3260 119.3597 57.7053 32.2306 178.8825 923 V 3.6419 7.5217 119.4637 66.2321 31.5015 177.1728 924 K 4.2578 7.8577 115.6945 55.9286 32.0882 175.8282 925 A 4.7931 7.6392 121.1744 50.3647 21.4443 177.3386 926 N 4.7919 8.2865 118.9128 51.7675 37.4340 174.1388 927 K 3.7032 8.1275 128.1854 58.4017 31.9176 173.3902 928 H 4.8949 7.2524 114.4718 54.7590 33.5624 173.5531 929 S 4.6190 8.4201 114.8196 58.4797 63.4069 173.4377 930 P 4.5035 0.0000 0.0000 62.7718 29.6422 173.4779 931 H 3.8778 8.2692 119.5566 55.6377 29.2254 176.2559 932 L 4.1718 8.3741 125.5005 57.5773 42.0596 178.7099 933 S 4.1094 8.0662 115.0375 61.7246 62.7916 176.5021 934 R 4.1562 7.9148 122.0375 58.7776 30.0495 177.9124 935 L 3.9679 7.5705 119.3925 58.4610 42.0000 179.1060 936 Q 4.0737 8.2039 117.9284 58.8808 28.1570 178.4149 937 E 4.0738 8.2930 119.7134 59.3274 29.3891 179.0517 938 C 4.2151 8.3933 117.5255 62.7347 28.0865 176.0353 939 S 4.0702 7.9041 114.4319 61.3502 61.9981 176.1849 940 R 3.8961 7.7985 121.0635 59.6534 29.7284 178.6753 941 T 4.0350 7.9770 115.6315 66.5975 68.4154 176.7172 942 V 3.5827 8.0002 120.2962 66.1926 31.4723 177.8079 943 N 4.3503 8.3860 116.1926 56.3418 38.4031 177.2693 944 E 3.9705 8.3428 119.9782 59.5914 29.5711 179.7089 945 R 3.9732 8.3073 117.9892 58.9919 30.0977 179.0014 946 A 3.9837 8.2954 120.7409 55.0375 18.3536 179.5541 947 A 3.9818 8.2487 119.4372 55.1980 18.3159 179.3743 948 N 4.2873 8.0842 115.7153 56.5255 38.9276 177.4427 949 V 3.9648 7.7643 121.3073 65.3491 31.5789 178.1866 950 V 3.5216 7.8631 117.7816 66.0066 31.4166 177.8968 951 A 3.9717 8.1400 120.5411 55.3383 18.2013 179.8535 952 S 4.1001 8.3565 113.8837 61.8007 62.7698 177.1329 953 T 3.7448 8.1074 118.7700 66.3657 68.2157 177.0278 954 K 3.8416 8.1030 120.4396 59.4626 32.1517 179.1586 955 S 4.1221 8.0338 113.4954 61.5159 62.2593 176.5740 956 G 3.4069 8.0196 108.1985 47.6261 0.0000 175.2971 957 Q 3.6242 7.7397 122.4388 58.8662 29.0210 178.4898 958 E 4.1703 8.0932 118.5412 59.5102 29.5094 179.0954 959 Q 4.0023 7.9128 118.2220 58.7121 28.7848 178.4174 960 I 3.9080 7.6434 120.2553 64.3498 37.2127 178.0051 961 E 4.1331 7.9417 118.4103 59.2499 29.3350 177.3333 962 D 4.6459 8.0549 122.6114 54.5642 41.0400 176.0121 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 8.35 4.61 0.00 2.67 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 0.00 774 V 8.17 3.82 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 0.66 0.00 0.00 0.90 0.00 0.00 775 R 9.33 3.94 0.00 1.94 1.95 0.00 3.32 0.00 0.00 3.34 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.61 0.00 776 Q 9.06 3.96 0.00 2.12 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.14 6.92 0.00 0.00 0.00 0.00 0.00 2.47 2.42 0.00 777 E 8.19 4.20 0.00 1.95 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 2.33 2.41 0.00 778 E 8.78 4.80 0.00 1.98 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 2.21 2.28 0.00 779 L 7.92 4.02 0.00 1.86 1.70 0.95 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 780 G 8.05 3.46 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 781 A 7.99 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 0.00 782 V 7.87 3.44 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 1.00 0.00 0.00 0.94 0.00 0.00 783 V 7.75 3.43 1.71 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 0.06 0.00 0.00 0.60 0.00 0.00 784 D 7.60 4.40 0.00 2.64 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 7.87 4.09 0.00 1.96 1.92 0.00 1.50 0.00 0.00 1.62 0.00 0.00 3.01 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.39 1.48 7.81 786 E 8.33 4.17 0.00 1.98 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 0.00 2.33 2.32 0.00 *788 A 8.08 4.19 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 0.00 789 A 8.12 3.99 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 0.00 790 T 8.01 3.79 4.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 791 S 7.99 4.13 0.00 3.84 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 8.25 3.99 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 0.00 793 A 8.20 3.95 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 0.00 794 I 7.92 3.72 2.01 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 0.98 0.91 0.00 0.00 795 E 8.28 3.98 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 2.51 2.46 0.00 796 D 8.42 4.29 0.00 2.86 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 0.00 797 A 8.06 3.99 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 0.00 798 V 7.87 3.52 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 0.99 0.00 0.00 799 R 8.19 3.91 0.00 2.05 1.97 0.00 3.18 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 1.92 0.00 800 R 8.15 3.98 0.00 1.76 2.00 0.00 3.25 0.00 0.00 3.23 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.87 0.00 801 I 7.82 3.93 1.93 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 0.58 0.94 0.00 0.00 802 E 8.06 4.34 0.00 2.09 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 2.50 0.00 803 D 8.06 4.35 0.00 2.89 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 *806 N 8.32 4.56 0.00 2.86 3.00 0.00 0.00 7.10 6.78 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 0.00 807 Q 8.27 4.04 0.00 2.13 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 6.58 0.00 0.00 0.00 0.00 0.00 2.40 2.53 0.00 808 A 7.91 4.01 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 0.00 809 R 7.58 4.00 0.00 1.70 1.93 0.00 3.08 0.00 0.00 3.19 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.70 0.00 810 H 7.80 4.82 0.00 3.25 3.31 0.00 5.63 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 0.00 811 A 7.65 4.63 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 0.00 812 S 7.58 4.59 0.00 3.95 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 0.00 813 S 8.49 4.44 0.00 3.98 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 0.00 814 G 8.56 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 0.00 815 V 8.46 3.56 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 8.39 4.27 0.00 2.86 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 0.00 892 K 8.10 3.96 0.00 1.92 1.81 0.00 1.66 0.00 0.00 1.67 0.00 0.00 3.16 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.67 1.56 7.81 893 V 7.40 3.59 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 0.65 0.00 0.00 -0.22 0.00 0.00 894 V 7.75 3.77 2.20 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 0.85 0.00 0.00 0.97 0.00 0.00 895 L 8.19 4.64 0.00 1.59 1.47 0.96 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 896 H 7.63 4.92 0.00 3.22 2.74 0.00 5.64 0.00 0.00 0.00 0.00 6.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 897 T 8.55 4.53 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 1.20 0.00 0.00 898 G 7.95 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 0.00 899 K 8.00 4.46 0.00 1.81 1.96 0.00 1.66 0.00 0.00 1.81 0.00 0.00 2.99 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.44 1.41 7.81 900 Y 8.34 4.10 0.00 3.22 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 0.00 901 E 8.40 4.03 0.00 2.08 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 2.44 2.49 0.00 902 E 8.03 3.97 0.00 2.03 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 2.29 2.35 0.00 903 L 7.90 3.99 0.00 1.84 1.91 0.95 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 7.80 3.69 2.07 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 0.53 0.95 0.00 0.00 905 V 7.93 3.67 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 1.15 0.00 0.00 1.04 0.00 0.00 906 C 8.38 4.19 0.00 3.08 2.98 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 0.00 907 S 8.07 4.17 0.00 3.97 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 8.17 4.26 0.00 3.38 3.34 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 8.54 4.05 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 2.63 0.00 910 I 7.95 3.72 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 1.02 0.00 0.00 911 A 8.15 4.08 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 0.00 912 A 8.11 4.01 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 0.00 913 S 8.37 4.15 0.00 4.04 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 0.00 914 T 8.24 3.92 4.25 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 1.24 0.00 0.00 915 A 8.17 4.13 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 7.90 4.00 0.00 2.20 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.10 6.75 0.00 0.00 0.00 0.00 0.00 2.35 2.39 0.00 917 L 7.79 3.93 0.00 1.79 1.81 0.85 0.83 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 0.00 918 V 7.85 3.56 2.27 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 0.98 0.00 0.00 0.97 0.00 0.00 919 A 7.66 4.02 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 0.00 920 A 8.50 4.15 1.33 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 0.00 0.00 0.00 921 S 8.02 4.38 0.00 4.11 4.06 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 0.00 0.00 0.00 922 K 8.33 4.35 0.00 2.04 2.12 0.00 1.36 0.00 0.00 1.61 0.00 0.00 2.92 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.71 1.55 7.81 923 V 7.52 3.64 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 0.90 0.00 0.00 1.16 0.00 0.00 924 K 7.86 4.26 0.00 0.79 1.20 0.00 1.35 0.00 0.00 1.43 0.00 0.00 2.87 0.00 0.00 2.65 0.00 0.00 0.00 0.00 0.63 0.21 7.81 925 A 7.64 4.79 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 0.00 926 N 8.29 4.79 0.00 2.73 2.78 0.00 0.00 6.29 7.13 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 0.00 927 K 8.13 3.70 0.00 1.90 1.86 0.00 1.50 0.00 0.00 1.65 0.00 0.00 2.89 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.09 1.25 7.81 928 H 7.25 4.89 0.00 3.14 3.15 0.00 5.63 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 8.42 4.62 0.00 3.97 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 0.00 930 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 2.18 2.12 0.00 931 H 8.27 3.88 0.00 3.49 3.38 0.00 5.80 0.00 0.00 0.00 0.00 6.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 932 L 8.37 4.17 0.00 1.78 1.66 0.97 1.06 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 0.00 933 S 8.07 4.11 0.00 3.96 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 0.00 934 R 7.91 4.16 0.00 1.86 1.90 0.00 3.27 0.00 0.00 3.19 7.13 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 7.57 3.97 0.00 1.96 1.85 0.96 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 936 Q 8.20 4.07 0.00 2.34 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.58 0.00 0.00 0.00 0.00 0.00 2.40 2.65 0.00 937 E 8.29 4.07 0.00 2.15 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 2.59 0.00 938 C 8.39 4.22 0.00 3.19 2.98 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 0.00 939 S 7.90 4.07 0.00 3.94 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 0.00 940 R 7.80 3.90 0.00 1.92 2.10 0.00 3.16 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 1.63 1.68 0.00 941 T 7.98 4.03 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 1.21 0.00 0.00 942 V 8.00 3.58 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 1.12 0.00 0.00 0.99 0.00 0.00 943 N 8.39 4.35 0.00 2.98 2.87 0.00 0.00 7.06 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 0.00 944 E 8.34 3.97 0.00 2.20 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 2.52 0.00 945 R 8.31 3.97 0.00 1.94 1.98 0.00 3.29 0.00 0.00 3.17 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 1.79 0.00 946 A 8.30 3.98 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 8.25 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 0.00 948 N 8.08 4.29 0.00 2.88 2.93 0.00 0.00 6.76 7.70 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 0.00 949 V 7.76 3.96 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 1.36 0.00 0.00 0.99 0.00 0.00 950 V 7.86 3.52 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 1.04 0.00 0.00 0.84 0.00 0.00 951 A 8.14 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 0.00 952 S 8.36 4.10 0.00 3.90 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 8.11 3.74 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 1.28 0.00 0.00 954 K 8.10 3.84 0.00 1.76 1.82 0.00 1.68 0.00 0.00 1.58 0.00 0.00 2.88 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.44 1.66 7.81 955 S 8.03 4.12 0.00 3.86 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 0.00 956 G 8.02 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 7.74 3.62 0.00 1.74 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 6.76 0.00 0.00 0.00 0.00 0.00 2.35 2.45 0.00 958 E 8.09 4.17 0.00 2.23 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 2.46 2.30 0.00 959 Q 7.91 4.00 0.00 2.15 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 7.01 0.00 0.00 0.00 0.00 0.00 2.37 2.53 0.00 960 I 7.64 3.91 2.05 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.60 0.98 0.00 0.00 961 E 7.94 4.13 0.00 2.12 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 2.37 2.47 0.00 962 D 8.05 4.65 0.00 2.79 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 * Residues marked with a * may have inaccurate shift predictions.