NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 775 M 4.4983 8.3049 118.1944 55.1038 31.5330 174.0038 776 Q 4.2953 9.0107 125.3730 54.7506 30.7954 172.5297 777 E 4.2736 7.7570 116.0940 57.6187 32.2810 176.5690 778 A 4.0197 8.6249 126.4437 52.3636 19.6961 181.9129 779 V 3.0533 8.0114 111.3348 62.3276 33.0525 173.7203 780 L 4.7516 8.1785 114.6463 52.5510 46.4360 175.4653 781 Q 4.7835 8.3119 120.1656 53.6420 32.3057 176.0049 782 L 4.2963 8.5724 120.0239 58.7021 41.8777 176.7793 783 I 4.2255 6.7665 115.3457 60.1206 42.6713 174.6495 784 E 4.5889 9.0561 111.4411 56.9167 32.7933 176.0354 785 V 4.0212 7.8329 110.4888 60.7608 33.3744 174.6822 786 Q 3.3161 8.3491 120.6422 57.3201 26.0858 172.7280 787 L 4.1615 8.0816 114.9617 55.0597 39.6420 174.0654 788 A 4.7044 7.1087 120.3502 50.9773 21.7706 177.1258 789 Q 3.9107 8.7383 114.3543 56.8989 26.1744 173.6503 790 E 4.8009 7.5186 115.8702 54.5160 32.5197 175.5518 791 E 4.6023 8.4560 119.5387 54.9069 32.8426 177.0259 792 V 4.1723 8.2723 127.1448 61.6558 31.5088 175.7847 793 T 4.3868 7.5587 108.7081 63.0960 67.8392 174.0234 794 E 4.1439 7.9292 121.9249 55.6394 31.5193 173.6107 795 S 3.6695 8.5365 116.6587 58.0409 61.6955 170.6227 796 P 4.7483 0.0000 0.0000 62.0954 30.9812 176.7125 797 L 3.9238 8.4208 125.6006 56.6829 40.8059 175.3674 798 G 3.2034 8.1579 108.8102 44.8489 0.0000 172.5650 799 G 4.1338 9.1180 115.2911 44.8600 0.0000 172.6257 800 D 4.5968 7.4977 116.9912 49.4913 39.9426 177.8242 801 E 4.0089 8.5196 121.9273 60.9883 29.5732 178.1988 802 N 4.4709 8.2027 116.2294 56.5825 39.0598 176.7248 803 A 4.0791 8.0200 121.9063 54.9841 18.5117 179.4204 804 Q 3.9643 8.5312 117.3773 59.1475 28.4675 179.1365 805 L 4.3858 8.2047 122.1480 58.5826 40.1732 178.8307 806 H 4.3075 8.2273 118.4066 59.0918 29.8475 176.8435 807 A 4.0935 8.0570 122.2222 54.9783 18.5164 179.4920 808 S 4.1812 8.3277 113.1638 60.2353 63.0030 176.0008 809 G 4.2281 7.9502 108.5870 45.5675 0.0000 174.1713 810 Y 4.7490 8.1245 116.5932 59.1171 37.8443 176.4340 811 Y 4.1944 8.3166 121.5997 60.5360 38.6750 177.5317 812 A 4.1186 7.8685 121.1853 55.2321 18.8025 179.3032 813 L 4.0334 7.7838 117.0117 57.7251 41.5488 179.1759 814 F 4.4783 8.0457 119.9090 60.5863 39.2720 176.5680 815 V 4.1724 7.3708 108.4875 61.7159 31.9511 176.1726 816 D 4.4496 8.1551 117.9039 55.4930 41.4307 177.2464 817 T 4.2122 7.6888 117.3658 65.2613 69.5225 177.1712 818 V 3.5360 7.6489 120.2735 65.6963 31.7149 176.1879 819 P 4.3064 0.0000 0.0000 65.3237 31.1812 178.2247 820 D 4.3367 8.0176 116.7966 57.4814 41.2684 177.8718 821 D 4.4121 8.3370 119.5160 57.0195 40.7615 178.9915 822 V 3.6184 7.9580 119.2377 65.9540 31.6801 178.3562 823 K 4.2471 8.5642 118.9650 59.7909 32.2838 179.1787 824 R 3.8996 8.1884 120.1665 59.1572 29.9436 178.0546 825 L 3.9906 8.3399 119.2645 58.3641 41.5620 179.2251 826 Y 4.0360 7.9984 116.1104 61.4529 37.6981 179.0503 827 T 3.9436 8.0303 116.5038 66.8351 68.5867 176.8100 828 E 3.9568 9.0928 120.8786 59.0179 29.4263 179.2312 829 A 3.8939 8.3371 121.2434 54.8821 18.1762 179.3696 830 A 3.9527 7.7688 118.4488 55.7057 18.6137 179.5178 831 T 4.0157 7.4852 111.4336 63.6551 68.8305 175.1202 832 S 3.2808 7.5134 115.8720 59.8204 60.9148 172.7726 833 D 4.4583 7.8346 120.7880 52.7997 38.2815 175.2286 834 F 4.2327 7.5850 122.4110 60.0602 39.3302 176.5910 835 A 4.0524 8.1511 119.9127 55.0966 18.2160 179.2160 836 A 4.0828 7.7979 118.5679 54.7567 18.7628 179.5807 837 L 3.9322 8.1610 117.5826 57.8592 41.6100 179.6577 838 A 3.9908 8.5054 121.2731 55.2150 18.3325 179.6419 839 Q 3.9840 8.0366 116.2413 59.9376 28.5165 179.0315 840 T 3.9038 8.1081 117.4643 66.0494 68.4045 176.6924 841 A 4.0010 8.2671 122.9830 55.6112 18.3785 179.4775 842 H 4.1826 8.6206 115.0142 58.8457 28.6624 178.2811 843 R 3.9289 8.2676 120.2282 59.3465 29.9364 179.1396 844 L 3.9019 8.6397 119.1255 57.5348 41.6117 179.3268 845 K 4.1263 8.5326 120.0873 59.6184 32.0152 179.0983 846 G 3.5957 8.3033 105.8540 48.0276 0.0000 176.2444 847 V 3.5902 8.0615 115.3844 63.8577 31.4884 178.7991 848 F 4.2831 8.6440 118.0566 60.4133 38.6629 177.6071 849 A 4.1768 8.3776 120.6006 55.2332 17.9017 179.4039 850 M 4.0537 8.0792 116.4076 58.7796 32.4939 178.0705 851 L 4.2472 8.1070 117.2858 55.2243 41.8623 176.9484 852 N 4.4015 7.6895 115.9814 54.8344 37.8170 175.0037 853 L 4.4715 8.3771 118.9786 52.6474 41.2207 177.2483 854 V 3.5730 8.0726 123.3619 65.3788 31.8581 175.4637 855 P 4.3295 0.0000 0.0000 65.8972 30.8524 178.4850 856 G 2.5004 7.6519 104.6799 47.1230 0.0000 175.4984 857 K 4.0309 7.9703 122.6711 58.9496 32.0735 178.5407 858 Q 3.9053 8.5134 120.3008 59.1606 28.9129 178.3131 859 L 4.1714 7.7799 119.8372 58.2801 41.6860 179.4517 860 C 4.2129 8.0542 116.4174 62.5607 27.9850 176.1062 861 E 3.9071 8.3405 120.6661 59.8421 29.1329 179.5425 862 T 3.6956 8.0093 115.8759 66.0725 68.3351 176.4555 863 L 3.7429 7.7862 122.7514 58.1737 42.1513 178.9674 864 E 3.9380 8.0941 117.4543 59.6949 29.4058 178.5618 865 H 4.0219 8.1260 119.1584 58.9666 29.8329 177.3217 866 L 4.0031 8.3042 121.1586 57.5825 41.4627 179.5621 867 I 3.6910 7.7309 120.3862 64.0836 36.8182 178.5382 868 R 3.8524 7.6555 116.2512 59.0286 29.3502 178.0665 869 E 4.1115 7.9618 116.5622 55.4750 29.9488 176.4146 870 K 3.4569 7.3435 117.1297 57.6338 30.2694 176.9358 871 D 4.5996 7.9377 119.7302 52.3439 39.2449 175.1490 872 V 3.6967 8.0052 123.9986 65.2696 31.9045 175.1773 873 P 4.3682 0.0000 0.0000 65.9517 30.8489 178.5259 874 G 3.6410 8.5251 105.4033 47.4861 0.0000 175.6771 875 I 3.7443 8.2891 123.0091 64.2889 37.1464 178.4243 876 E 3.8924 8.4910 118.4781 59.0466 29.2659 178.9333 877 K 3.8979 8.1827 120.6100 59.8500 32.2830 178.4834 878 Y 3.7842 8.4593 116.9969 60.7237 37.7408 178.2028 879 I 3.6409 8.1232 121.3721 64.5687 37.1668 178.6359 880 S 4.4842 8.2057 117.4751 61.1826 62.6599 176.4958 881 D 4.8289 8.2308 123.3736 56.8769 40.4679 178.8734 882 I 3.8895 8.2238 120.9170 64.0448 37.0091 178.0272 883 D 4.4308 8.3044 119.3986 57.4098 41.3037 178.4224 884 S 4.1500 8.7625 115.2247 61.5492 62.9002 175.6604 885 Y 4.0293 8.1561 123.0907 60.6692 38.6474 178.2842 886 V 3.7783 8.6343 119.4483 65.9527 31.3867 178.1514 887 K 3.9299 8.1532 117.9860 59.4883 32.0062 179.2047 888 S 4.2474 7.9205 113.2331 60.8292 63.1424 175.7166 889 L 4.3214 7.5501 120.6638 55.6210 41.7941 177.2046 890 L 4.4525 7.3694 125.0784 53.9404 41.8681 176.0507 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 775 M 8.30 4.50 0.00 2.14 2.18 0.00 0.00 0.00 0.00 0.00 -0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.46 2.57 0.00 776 Q 9.01 4.30 0.00 2.02 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.80 0.00 0.00 0.00 0.00 0.00 2.28 2.36 0.00 777 E 7.76 4.27 0.00 2.04 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 2.19 2.34 0.00 778 A 8.62 4.02 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 0.00 779 V 8.01 3.05 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 0.88 0.00 0.00 0.93 0.00 0.00 780 L 8.18 4.75 0.00 1.59 1.54 0.92 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 781 Q 8.31 4.78 0.00 2.08 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 7.07 0.00 0.00 0.00 0.00 0.00 2.24 2.29 0.00 782 L 8.57 4.30 0.00 1.75 1.79 0.92 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 783 I 6.77 4.23 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 1.47 0.34 0.91 0.00 0.00 784 E 9.06 4.59 0.00 2.03 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 2.16 2.26 0.00 785 V 7.83 4.02 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 0.67 0.00 0.00 0.95 0.00 0.00 786 Q 8.35 3.32 0.00 2.24 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.11 6.33 0.00 0.00 0.00 0.00 0.00 2.32 2.36 0.00 787 L 8.08 4.16 0.00 1.82 1.74 0.92 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 0.00 0.00 0.00 0.00 0.00 0.00 788 A 7.11 4.70 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 0.00 789 Q 8.74 3.91 0.00 2.22 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.73 0.00 0.00 0.00 0.00 0.00 2.26 2.36 0.00 790 E 7.52 4.80 0.00 1.82 1.82 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 2.44 2.37 0.00 791 E 8.46 4.60 0.00 1.89 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 2.20 2.26 0.00 792 V 8.27 4.17 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 0.00 793 T 7.56 4.39 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 0.00 794 E 7.93 4.14 0.00 1.97 1.88 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 2.28 2.29 0.00 795 S 8.54 3.67 0.00 4.18 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 0.00 796 P 0.00 4.75 0.00 2.07 1.91 0.00 3.69 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.07 0.00 797 L 8.42 3.92 0.00 1.75 1.70 0.94 0.36 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 0.00 798 G 8.16 3.20 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 799 G 9.12 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 0.00 0.00 0.00 800 D 7.50 4.60 0.00 2.80 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 0.00 801 E 8.52 4.01 0.00 2.12 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 0.00 2.44 2.47 0.00 802 N 8.20 4.47 0.00 2.90 2.88 0.00 0.00 7.58 8.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 803 A 8.02 4.08 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 0.00 804 Q 8.53 3.96 0.00 2.32 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.73 6.76 0.00 0.00 0.00 0.00 0.00 2.40 2.73 0.00 805 L 8.20 4.39 0.00 2.00 2.23 0.88 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.47 0.00 0.00 0.00 0.00 0.00 0.00 806 H 8.23 4.31 0.00 3.10 3.50 0.00 5.77 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 0.00 807 A 8.06 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 0.00 808 S 8.33 4.18 0.00 3.85 4.02 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 0.00 0.00 0.00 809 G 7.95 4.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Y 8.12 4.75 0.00 3.01 2.95 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 0.00 0.00 0.00 811 Y 8.32 4.19 0.00 3.21 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 0.00 812 A 7.87 4.12 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 0.00 813 L 7.78 4.03 0.00 1.59 1.52 0.36 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 814 F 8.05 4.48 0.00 2.91 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 0.00 815 V 7.37 4.17 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 0.73 0.00 0.00 1.10 0.00 0.00 816 D 8.16 4.45 0.00 2.91 2.55 0.00 0.00 0.00 0.00 0.00 0.00 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 T 7.69 4.21 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 1.18 0.00 0.00 818 V 7.65 3.54 2.46 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 1.15 0.00 0.00 0.93 0.00 0.00 819 P 0.00 4.31 0.00 2.18 2.06 0.00 3.80 0.00 0.00 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.05 0.00 820 D 8.02 4.34 0.00 2.78 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 0.00 821 D 8.34 4.41 0.00 2.98 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 0.00 822 V 7.96 3.62 2.32 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 1.16 0.00 0.00 1.13 0.00 0.00 823 K 8.56 4.25 0.00 2.04 2.11 0.00 1.39 0.00 0.00 1.58 0.00 0.00 3.09 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.54 1.67 7.81 824 R 8.19 3.90 0.00 2.19 1.98 0.00 3.13 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 1.64 1.68 0.00 825 L 8.34 3.99 0.00 1.87 1.61 0.93 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 826 Y 8.00 4.04 0.00 3.21 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 0.00 827 T 8.03 3.94 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 0.00 828 E 9.09 3.96 0.00 1.90 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 2.59 2.46 0.00 829 A 8.34 3.89 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 0.00 830 A 7.77 3.95 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 0.00 831 T 7.49 4.02 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 1.18 0.00 0.00 832 S 7.51 3.28 0.00 3.80 3.47 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 0.00 0.00 0.00 0.00 833 D 7.83 4.46 0.00 2.65 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 0.00 0.00 0.00 0.00 834 F 7.58 4.23 0.00 3.13 3.04 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 0.00 0.00 0.00 835 A 8.15 4.05 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 0.00 836 A 7.80 4.08 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 0.00 837 L 8.16 3.93 0.00 1.88 1.79 0.90 0.62 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 0.00 838 A 8.51 3.99 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 0.00 839 Q 8.04 3.98 0.00 2.34 2.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.53 6.77 0.00 0.00 0.00 0.00 0.00 2.55 2.61 0.00 840 T 8.11 3.90 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 1.35 0.00 0.00 841 A 8.27 4.00 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 0.00 842 H 8.62 4.18 0.00 3.46 3.35 0.00 5.65 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 843 R 8.27 3.93 0.00 2.15 1.97 0.00 3.18 0.00 0.00 3.36 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.70 0.00 844 L 8.64 3.90 0.00 1.98 1.95 1.05 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 845 K 8.53 4.13 0.00 1.87 2.13 0.00 1.75 0.00 0.00 1.71 0.00 0.00 2.97 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.50 1.52 7.81 846 G 8.30 3.60 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 0.00 0.00 0.00 847 V 8.06 3.59 1.84 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 0.82 0.00 0.00 0.70 0.00 0.00 848 F 8.64 4.28 0.00 3.22 3.22 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 0.00 849 A 8.38 4.18 1.46 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 0.00 850 M 8.08 4.05 0.00 2.10 2.19 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.85 2.67 0.00 851 L 8.11 4.25 0.00 1.83 1.71 0.37 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 852 N 7.69 4.40 0.00 2.87 2.98 0.00 0.00 7.27 9.15 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 0.00 853 L 8.38 4.47 0.00 2.06 1.68 1.11 0.95 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 0.00 854 V 8.07 3.57 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 0.88 0.00 0.00 0.95 0.00 0.00 855 P 0.00 4.33 0.00 2.20 2.28 0.00 3.69 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 2.19 2.12 0.00 856 G 7.65 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 0.00 0.00 0.00 857 K 7.97 4.03 0.00 1.94 2.09 0.00 1.67 0.00 0.00 1.58 0.00 0.00 2.92 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.45 1.49 7.81 858 Q 8.51 3.91 0.00 2.32 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.56 0.00 0.00 0.00 0.00 0.00 2.33 2.43 0.00 859 L 7.78 4.17 0.00 1.74 1.72 0.13 0.50 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 0.00 860 C 8.05 4.21 0.00 3.17 3.26 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 0.00 861 E 8.34 3.91 0.00 2.15 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 2.33 2.57 0.00 862 T 8.01 3.70 3.21 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 0.00 0.00 0.00 0.79 0.00 0.00 863 L 7.79 3.74 0.00 1.86 1.66 0.95 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 864 E 8.09 3.94 0.00 2.14 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 0.00 2.42 2.24 0.00 865 H 8.13 4.02 0.00 3.36 3.34 0.00 5.78 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 866 L 8.30 4.00 0.00 1.73 1.63 0.49 0.72 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 0.00 867 I 7.73 3.69 2.01 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 1.72 1.28 0.93 0.00 0.00 868 R 7.66 3.85 0.00 1.85 2.11 0.00 2.99 0.00 0.00 3.10 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 1.70 0.00 869 E 7.96 4.11 0.00 1.92 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 2.42 2.50 0.00 870 K 7.34 3.46 0.00 1.80 1.70 0.00 1.10 0.00 0.00 0.63 0.00 0.00 2.13 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.10 1.28 7.81 871 D 7.94 4.60 0.00 2.65 2.53 0.00 0.00 0.00 0.00 0.00 0.00 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 8.01 3.70 2.16 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 1.18 0.00 0.00 1.07 0.00 0.00 873 P 0.00 4.37 0.00 2.33 2.33 0.00 3.69 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 2.31 2.07 0.00 874 G 8.53 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 I 8.29 3.74 2.12 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 1.61 0.88 0.97 0.00 0.00 876 E 8.49 3.89 0.00 2.26 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.41 2.56 0.00 877 K 8.18 3.90 0.00 2.20 2.10 0.00 1.55 0.00 0.00 1.59 0.00 0.00 2.95 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.46 1.67 7.81 878 Y 8.46 3.78 0.00 3.17 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 0.00 879 I 8.12 3.64 1.73 0.00 0.00 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.90 -0.06 0.00 0.00 880 S 8.21 4.48 0.00 4.02 4.02 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 0.00 0.00 0.00 881 D 8.23 4.83 0.00 2.58 2.42 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 0.00 882 I 8.22 3.89 2.07 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.70 1.14 0.00 0.00 883 D 8.30 4.43 0.00 3.11 3.07 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 0.00 884 S 8.76 4.15 0.00 4.08 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 0.00 885 Y 8.16 4.03 0.00 3.35 3.23 0.00 0.00 0.00 0.00 0.00 0.00 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 V 8.63 3.78 2.43 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 0.87 0.00 0.00 1.40 0.00 0.00 887 K 8.15 3.93 0.00 2.06 1.85 0.00 1.77 0.00 0.00 2.10 0.00 0.00 3.09 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.46 1.43 7.81 888 S 7.92 4.25 0.00 3.96 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 0.00 889 L 7.55 4.32 0.00 1.83 2.10 0.39 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 890 L 7.37 4.45 0.00 1.47 1.38 0.62 -0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00