NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 803 K 4.2890 8.3149 120.0020 56.2785 33.3268 175.2416 804 E 3.9266 8.8125 118.8016 56.1045 29.9957 174.1311 805 N 4.9767 9.2578 120.2373 52.7038 42.0569 173.4849 806 K 5.1724 8.6622 122.5068 54.7262 37.0343 175.1026 807 K 4.8167 8.9015 120.5913 54.7704 35.4383 175.4940 808 L 4.9809 8.3084 122.5383 53.0408 44.2227 175.5834 809 L 5.1753 8.9137 124.3327 52.6264 44.9748 175.7025 810 C 4.4215 9.1009 123.5074 59.6603 32.0459 174.5871 811 R 3.8153 8.5437 126.9349 59.4526 29.8439 177.9387 812 K 4.0046 8.1107 119.3545 58.9013 32.4025 177.0754 813 C 4.4861 7.9780 109.7797 57.1241 30.6852 173.5610 814 K 3.9783 8.0285 118.5535 57.4335 29.7383 175.2874 815 A 4.5582 7.8372 119.3232 50.7317 20.5962 177.5281 816 L 4.1260 8.6342 122.4286 56.0134 42.2104 175.7462 817 A 4.8665 8.9038 128.3746 53.0346 20.4879 176.1564 818 C 4.4870 6.9324 106.8652 58.1939 32.8977 171.3738 819 Y 5.2307 8.0626 115.1794 56.3500 40.8161 177.6559 820 T 3.8926 8.7741 111.9779 64.1204 69.1322 176.5988 821 A 4.0814 7.8766 125.0220 54.7570 18.6501 177.7536 822 D 4.7413 8.1934 114.4517 54.2351 41.1647 175.6862 823 V 4.5718 7.4315 120.3437 62.1464 32.6481 175.5365 824 R 4.8846 8.8046 125.9361 54.3967 34.0280 174.3644 825 V 4.0892 8.5689 123.4258 61.1668 33.6911 174.2954 826 I 4.4455 8.2752 128.8578 59.9996 39.1495 175.7737 827 E 3.7964 9.3856 125.3200 57.4307 27.0582 175.1842 828 E 3.7655 8.4148 113.5055 56.9930 27.4073 175.4048 829 S 4.5848 7.5368 110.2372 57.7612 65.4321 173.6312 830 H 5.0815 7.9387 118.2389 54.1458 31.4922 173.3521 831 Y 4.7932 8.3233 118.2796 56.3738 41.4682 174.5100 832 T 4.9769 8.5131 117.2355 59.1071 71.6903 172.2217 833 V 4.8021 8.0000 122.6437 60.8718 33.6763 175.0042 834 L 4.3846 9.0156 128.3121 55.0194 42.6546 176.6624 835 G 4.2734 8.9081 108.8156 45.0161 0.0000 173.9358 836 D 4.6197 8.8823 120.1541 56.0519 42.0672 178.9712 837 A 4.2430 8.2124 121.1046 55.2160 18.2845 179.1639 838 F 4.4351 8.4826 118.6395 61.4788 39.2781 177.2230 839 K 3.3492 7.7686 116.9159 58.7454 31.8175 178.5339 840 E 4.0189 7.8025 117.6147 58.5134 29.6803 178.0385 841 C 4.4742 8.0885 116.8048 60.1648 28.4336 172.7998 842 F 5.2892 6.7161 113.6964 55.0180 41.0227 174.3649 843 V 4.4918 8.9597 113.1056 59.7328 34.8495 174.5827 844 S 5.4432 8.6313 117.4805 57.0961 64.6479 173.4485 845 R 4.8170 8.9701 123.6930 54.0284 35.0177 172.4370 846 P 4.4476 0.0000 0.0000 63.1714 31.7667 175.3049 847 H 4.4520 8.6640 125.5290 54.8419 30.6331 173.0767 848 P 4.4594 0.0000 0.0000 65.3758 31.2138 177.2350 849 K 4.5408 7.8052 119.8161 52.9562 31.7327 172.9887 850 P 4.5154 0.0000 0.0000 64.2829 32.2617 176.0879 851 K 4.7534 8.3542 120.4593 55.4483 37.6096 174.5542 852 Q 4.8735 8.6780 122.0652 54.4174 31.3502 174.2745 853 F 5.1012 7.6058 120.6129 55.3393 42.7867 179.8025 854 S 3.6900 8.7616 118.3208 60.1724 62.4150 173.4281 855 S 4.4846 8.5572 122.6921 58.8882 63.6091 173.0316 856 F 5.3851 7.6432 120.1362 54.9677 42.1203 174.4938 857 E 4.5707 8.4090 120.1721 53.8699 31.5613 174.4049 858 K 4.0803 9.0606 130.2165 57.1855 32.6233 176.9760 859 R 4.7219 8.7078 126.6246 57.4299 32.8833 175.7331 860 A 5.0058 7.6613 118.3482 51.5204 23.0103 174.8897 861 K 4.9952 8.8875 117.9387 54.7287 35.3425 176.0034 862 I 4.9870 7.9701 116.0590 59.3094 40.5275 174.4461 863 F 5.0380 8.9067 121.6342 55.2139 43.8547 173.7303 864 C 2.7728 7.8402 120.8850 59.4280 31.7311 174.2202 865 A 4.1927 8.5228 127.8853 53.3959 18.2184 177.8856 866 R 4.0714 7.8440 114.9055 55.2865 31.9198 177.5286 867 Q 3.5263 8.8136 115.3781 60.4743 28.0786 177.2009 868 N 4.7094 8.9736 110.1092 53.3030 39.0832 175.5339 869 C 4.1034 6.8935 119.7277 56.7208 31.8807 173.0851 870 S 4.0798 7.8681 115.7801 58.6609 60.8697 172.3143 871 H 4.4643 7.9036 119.3520 55.8015 31.1692 173.5879 872 D 4.4965 8.8282 125.4239 55.0359 41.1399 175.5089 873 W 4.6377 10.3338 126.5832 55.3069 31.2004 177.0752 874 G 4.1746 6.4333 108.5476 45.5792 0.0000 171.4485 875 I 5.1915 8.3916 119.2403 59.4028 42.1786 173.4948 876 H 5.1249 9.1638 121.1606 54.6012 32.9667 172.7430 877 V 5.1356 8.5212 117.3125 58.6377 36.8302 173.5928 878 K 4.8828 8.6077 121.9027 55.2295 34.2950 174.2222 879 Y 5.0466 8.8753 129.3060 55.4665 41.1930 175.1812 880 K 3.6170 8.7449 129.0302 58.1989 30.6923 176.7269 881 T 4.0448 8.1857 117.6199 62.7860 68.6764 173.9117 882 F 5.0632 8.1253 121.3726 56.0367 41.8777 174.2574 883 E 5.2658 8.9039 120.6264 54.8804 31.9158 175.2200 884 I 4.8895 8.5113 118.0334 58.1623 41.1630 173.0765 885 P 4.6668 0.0000 0.0000 62.3120 33.5373 175.0746 886 V 4.7472 8.8972 121.4654 61.2936 34.0197 174.4855 887 I 5.1557 8.6147 122.2849 59.6293 39.9439 175.1518 888 K 4.9070 8.6013 122.7458 55.1681 34.1368 176.8246 889 I 3.0547 7.8143 125.5808 63.5974 37.7425 177.0229 890 E 4.0673 7.8377 118.9130 57.8938 29.6581 177.2634 891 S 4.3801 8.0340 113.4290 58.8216 63.4481 173.1757 892 F 5.1183 7.5387 118.1758 55.4169 42.2491 174.6510 893 V 4.2728 8.8062 119.6503 61.1840 34.2282 174.2100 894 V 4.4358 8.3084 127.8807 61.4436 33.1513 173.9545 895 E 5.0307 9.0871 129.0062 53.9915 32.6949 174.1205 896 D 4.5615 8.8490 127.5858 54.4575 41.5582 177.1485 897 I 3.7051 8.1160 127.8240 63.9263 37.2688 176.8530 898 A 4.6189 8.5180 121.3272 52.1490 19.1088 177.3031 899 T 4.4834 7.6375 103.8719 60.1344 70.4129 175.3732 900 G 3.9268 8.3776 109.5708 44.0224 0.0000 173.5223 901 V 3.6759 7.4010 120.6984 63.3553 32.2578 174.7295 902 Q 5.2024 8.6027 126.9239 54.8241 30.8887 175.2624 903 T 4.5463 8.8868 118.3485 61.8329 73.4246 172.6486 904 L 4.7079 7.9997 123.5081 53.0094 43.9682 175.5560 905 Y 4.6644 8.0584 120.0585 56.2498 40.8125 176.5351 906 S 4.3408 8.7075 117.6096 59.4767 63.4090 174.4460 907 K 4.7074 7.5067 118.5750 53.8177 35.6542 177.0494 908 W 4.1407 8.9808 122.4307 59.9725 29.1174 178.6553 909 K 4.1543 8.2571 115.9805 58.9005 31.5820 177.3580 910 D 4.5089 8.0493 117.3179 54.7974 41.2897 176.0407 911 F 3.7884 7.6344 121.8959 56.7189 38.9892 174.8014 912 H 4.5909 8.6302 126.8877 54.2125 28.8331 174.1538 913 F 4.6795 7.4738 118.5220 54.8297 40.7270 173.3383 914 E 3.7696 8.7539 121.1909 56.4986 28.7241 176.6809 915 K 3.9339 7.6957 127.5686 54.6359 31.1269 175.0886 916 I 3.9120 7.6259 123.7764 60.1463 38.2959 173.6528 917 P 4.7713 0.0000 0.0000 62.2279 32.0904 176.0498 918 F 4.2259 8.7371 126.2052 58.2895 40.3181 174.1872 919 D 4.5795 7.4276 123.9636 51.0193 43.7810 174.1057 920 P 4.1946 0.0000 0.0000 65.7105 31.3022 178.3974 921 A 4.1917 8.0193 120.1299 54.0154 18.1474 178.5866 922 E 3.9066 7.9790 116.6290 58.2749 30.0341 177.5439 923 M 4.3638 7.5916 117.7524 57.0268 32.7926 177.9740 924 S 4.3975 8.0345 113.2613 60.3924 63.2162 175.8394 925 K 4.1526 7.5013 122.3868 58.4735 32.1727 177.7187 926 L 4.3797 7.7877 116.9946 55.6562 42.1979 177.4297 927 E 4.5125 8.1976 116.8015 56.5377 30.5533 175.5726 928 H 4.5617 7.9117 120.3481 55.7944 29.1847 173.8166 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 803 K 8.31 4.29 0.00 1.91 1.82 0.00 1.61 0.00 0.00 1.74 0.00 0.00 3.03 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.36 1.53 7.81 804 E 8.81 3.93 0.00 2.11 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 2.33 0.00 805 N 9.26 4.98 0.00 2.85 2.67 0.00 0.00 6.66 6.75 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 0.00 806 K 8.66 5.17 0.00 1.75 1.69 0.00 1.94 0.00 0.00 1.89 0.00 0.00 2.98 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.44 1.48 7.81 807 K 8.90 4.82 0.00 1.63 1.55 0.00 1.61 0.00 0.00 1.64 0.00 0.00 3.00 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.51 1.49 7.81 808 L 8.31 4.98 0.00 1.31 0.89 0.71 -0.03 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 0.00 809 L 8.91 5.18 0.00 1.53 1.56 0.93 0.82 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 0.00 810 C 9.10 4.42 0.00 3.60 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 0.00 811 R 8.54 3.82 0.00 1.99 1.77 0.00 3.33 0.00 0.00 3.17 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.54 0.00 812 K 8.11 4.00 0.00 1.44 1.77 0.00 1.85 0.00 0.00 1.78 0.00 0.00 3.01 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.39 1.37 7.81 813 C 7.98 4.49 0.00 3.13 3.05 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 0.00 814 K 8.03 3.98 0.00 1.96 1.97 0.00 1.68 0.00 0.00 1.69 0.00 0.00 3.00 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.50 1.36 7.81 815 A 7.84 4.56 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 0.00 816 L 8.63 4.13 0.00 1.63 1.62 0.56 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 817 A 8.90 4.87 1.02 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 0.00 0.00 818 C 6.93 4.49 0.00 2.71 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 0.00 819 Y 8.06 5.23 0.00 3.09 2.81 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 0.00 820 T 8.77 3.89 4.01 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 0.00 0.00 1.06 0.00 0.00 821 A 7.88 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 0.00 822 D 8.19 4.74 0.00 2.73 2.84 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 0.00 823 V 7.43 4.57 2.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.00 0.00 0.98 0.00 0.00 824 R 8.80 4.88 0.00 1.89 1.87 0.00 3.45 0.00 0.00 3.07 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.66 0.00 825 V 8.57 4.09 1.73 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 0.15 0.00 0.00 0.52 0.00 0.00 826 I 8.28 4.45 1.69 0.00 0.00 -0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 0.22 0.44 0.00 0.00 827 E 9.39 3.80 0.00 2.07 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 2.26 2.21 0.00 828 E 8.41 3.77 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 2.16 2.24 0.00 829 S 7.54 4.58 0.00 3.84 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 0.00 830 H 7.94 5.08 0.00 3.10 3.19 0.00 5.55 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 831 Y 8.32 4.79 0.00 2.12 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 0.00 0.00 0.00 832 T 8.51 4.98 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 1.22 0.00 0.00 833 V 8.00 4.80 1.08 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 0.37 0.00 0.00 0.36 0.00 0.00 834 L 9.02 4.38 0.00 1.54 1.60 0.86 1.07 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 0.00 835 G 8.91 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 0.00 0.00 0.00 836 D 8.88 4.62 0.00 2.78 2.77 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.21 4.24 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 F 8.48 4.44 0.00 3.24 3.29 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 0.00 839 K 7.77 3.35 0.00 1.85 1.63 0.00 1.82 0.00 0.00 1.76 0.00 0.00 3.21 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.59 1.67 7.81 840 E 7.80 4.02 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 2.31 2.31 0.00 841 C 8.09 4.47 0.00 3.19 3.36 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 0.00 842 F 6.72 5.29 0.00 2.97 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 0.00 843 V 8.96 4.49 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 0.61 0.00 0.00 1.01 0.00 0.00 844 S 8.63 5.44 0.00 4.07 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 0.00 845 R 8.97 4.82 0.00 2.09 1.86 0.00 3.24 0.00 0.00 3.06 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.68 0.00 846 P 0.00 4.45 0.00 1.97 2.08 0.00 3.72 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.18 0.00 847 H 8.66 4.45 0.00 3.22 3.24 0.00 5.76 0.00 0.00 0.00 0.00 6.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 848 P 0.00 4.46 0.00 2.25 2.19 0.00 3.44 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 2.01 1.95 0.00 849 K 7.81 4.54 0.00 1.92 1.91 0.00 1.64 0.00 0.00 1.81 0.00 0.00 3.09 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.43 1.53 7.81 850 P 0.00 4.52 0.00 2.12 2.14 0.00 3.91 0.00 0.00 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.05 0.00 851 K 8.35 4.75 0.00 1.93 1.93 0.00 1.75 0.00 0.00 1.65 0.00 0.00 2.84 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.42 1.61 7.81 852 Q 8.68 4.87 0.00 1.98 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.43 6.81 0.00 0.00 0.00 0.00 0.00 2.17 2.53 0.00 853 F 7.61 5.10 0.00 3.18 3.13 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 0.00 854 S 8.76 3.69 0.00 3.96 3.27 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 0.00 855 S 8.56 4.48 0.00 3.36 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 0.00 856 F 7.64 5.39 0.00 2.17 2.54 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.41 4.57 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 2.24 2.44 0.00 858 K 9.06 4.08 0.00 2.05 1.90 0.00 1.49 0.00 0.00 1.29 0.00 0.00 3.04 0.00 0.00 3.37 0.00 0.00 0.00 0.00 1.41 1.54 7.81 859 R 8.71 4.72 0.00 1.89 1.98 0.00 3.27 0.00 0.00 3.22 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.73 0.00 860 A 7.66 5.01 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 0.00 861 K 8.89 5.00 0.00 1.58 1.20 0.00 1.67 0.00 0.00 1.61 0.00 0.00 2.68 0.00 0.00 2.64 0.00 0.00 0.00 0.00 1.31 1.25 7.81 862 I 7.97 4.99 1.74 0.00 0.00 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 1.24 0.75 0.00 0.00 863 F 8.91 5.04 0.00 2.85 2.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 864 C 7.84 2.77 0.00 2.32 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 0.00 865 A 8.52 4.19 1.20 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 0.00 866 R 7.84 4.07 0.00 1.83 1.87 0.00 3.37 0.00 0.00 3.28 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.63 0.00 867 Q 8.81 3.53 0.00 1.99 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 7.35 0.00 0.00 0.00 0.00 0.00 2.34 2.41 0.00 868 N 8.97 4.71 0.00 2.73 2.78 0.00 0.00 6.78 7.66 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 0.00 869 C 6.89 4.10 0.00 2.88 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 0.00 870 S 7.87 4.08 0.00 3.91 3.65 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 0.00 871 H 7.90 4.46 0.00 3.26 3.27 0.00 5.70 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 872 D 8.83 4.50 0.00 2.80 2.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 873 W 10.33 4.64 0.00 3.33 3.25 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 0.00 874 G 6.43 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 0.00 0.00 0.00 0.00 875 I 8.39 5.19 2.02 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.86 0.97 0.00 0.00 876 H 9.16 5.12 0.00 3.21 3.19 0.00 5.53 0.00 0.00 0.00 0.00 6.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 877 V 8.52 5.14 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 0.65 0.00 0.00 0.41 0.00 0.00 878 K 8.61 4.88 0.00 1.87 1.71 0.00 1.68 0.00 0.00 1.76 0.00 0.00 2.79 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.46 1.46 7.81 879 Y 8.88 5.05 0.00 3.37 2.94 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 0.00 880 K 8.74 3.62 0.00 1.73 1.08 0.00 1.62 0.00 0.00 1.66 0.00 0.00 2.84 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.03 0.36 7.81 881 T 8.19 4.04 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.00 0.00 882 F 8.13 5.06 0.00 3.34 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 0.00 883 E 8.90 5.27 0.00 1.96 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 2.30 2.36 0.00 884 I 8.51 4.89 1.84 0.00 0.00 0.49 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 0.60 1.01 0.00 0.00 885 P 0.00 4.67 0.00 1.99 1.89 0.00 3.73 0.00 0.00 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.39 0.00 886 V 8.90 4.75 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 0.97 0.00 0.00 0.40 0.00 0.00 887 I 8.61 5.16 2.26 0.00 0.00 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.23 1.11 0.00 0.00 888 K 8.60 4.91 0.00 1.91 2.10 0.00 1.34 0.00 0.00 1.60 0.00 0.00 2.74 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.62 1.35 7.81 889 I 7.81 3.05 0.56 0.00 0.00 -0.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.56 0.73 0.32 0.00 0.00 890 E 7.84 4.07 0.00 2.05 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 2.24 2.25 0.00 891 S 8.03 4.38 0.00 3.40 3.49 0.00 0.00 0.00 0.00 0.00 0.00 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 F 7.54 5.12 0.00 2.65 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 0.00 893 V 8.81 4.27 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 0.86 0.00 0.00 0.86 0.00 0.00 894 V 8.31 4.44 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 0.71 0.00 0.00 0.29 0.00 0.00 895 E 9.09 5.03 0.00 1.96 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 0.00 2.19 2.20 0.00 896 D 8.85 4.56 0.00 2.83 2.57 0.00 0.00 0.00 0.00 0.00 0.00 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 I 8.12 3.71 1.92 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 1.34 0.81 0.96 0.00 0.00 898 A 8.52 4.62 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 0.00 899 T 7.64 4.48 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 1.23 0.00 0.00 900 G 8.38 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 0.00 0.00 0.00 901 V 7.40 3.68 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 0.91 0.00 0.00 0.93 0.00 0.00 902 Q 8.60 5.20 0.00 1.90 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.91 6.54 0.00 0.00 0.00 0.00 0.00 2.24 2.54 0.00 903 T 8.89 4.55 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 0.53 0.00 0.00 904 L 8.00 4.71 0.00 1.27 1.36 0.82 0.63 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 0.00 905 Y 8.06 4.66 0.00 2.66 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 0.00 906 S 8.71 4.34 0.00 3.80 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 0.00 907 K 7.51 4.71 0.00 1.98 1.70 0.00 1.78 0.00 0.00 1.70 0.00 0.00 2.91 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.37 1.40 7.81 908 W 8.98 4.14 0.00 3.43 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 0.00 909 K 8.26 4.15 0.00 1.82 1.95 0.00 1.81 0.00 0.00 1.81 0.00 0.00 3.07 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.57 1.49 7.81 910 D 8.05 4.51 0.00 2.90 2.88 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 0.00 911 F 7.63 3.79 0.00 1.51 2.77 0.00 0.00 0.00 0.00 0.00 0.00 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 H 8.63 4.59 0.00 3.18 3.23 0.00 5.92 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 913 F 7.47 4.68 0.00 2.95 2.51 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.75 3.77 0.00 2.02 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 2.22 2.27 0.00 915 K 7.70 3.93 0.00 1.47 1.46 0.00 1.58 0.00 0.00 1.66 0.00 0.00 2.57 0.00 0.00 2.36 0.00 0.00 0.00 0.00 0.30 0.74 7.81 916 I 7.63 3.91 1.84 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 1.30 0.68 0.86 0.00 0.00 917 P 0.00 4.77 0.00 1.90 1.94 0.00 3.62 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 2.00 0.00 918 F 8.74 4.23 0.00 2.94 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 0.00 919 D 7.43 4.58 0.00 2.59 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 0.00 0.00 0.00 920 P 0.00 4.19 0.00 2.33 2.53 0.00 3.67 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.57 0.00 921 A 8.02 4.19 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 0.00 922 E 7.98 3.91 0.00 1.84 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 2.18 2.26 0.00 923 M 7.59 4.36 0.00 2.29 2.05 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 2.16 2.26 0.00 924 S 8.03 4.40 0.00 4.15 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 0.00 925 K 7.50 4.15 0.00 2.05 1.87 0.00 1.78 0.00 0.00 1.69 0.00 0.00 3.02 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.43 1.48 7.81 926 L 7.79 4.38 0.00 1.67 1.72 0.92 0.87 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 0.00 927 E 8.20 4.51 0.00 2.11 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 2.32 2.42 0.00 928 H 7.91 4.56 0.00 3.42 3.15 0.00 5.69 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00