NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 804 M 4.3837 8.3001 118.1937 54.9799 33.4119 175.9788 805 A 3.9987 7.9644 122.2413 50.3062 18.8455 174.9359 806 S 4.7999 8.4632 117.1158 55.6175 66.7279 171.4801 807 N 4.5905 8.4004 118.0287 52.4861 37.5606 173.0784 808 P 4.8609 0.0000 0.0000 62.9770 33.1905 175.1052 809 S 4.7153 9.0561 115.2961 56.9801 67.9181 173.2399 810 L 4.6434 8.4900 124.9939 54.7605 42.7777 175.7818 811 I 4.7158 8.5596 127.6182 59.5193 39.9312 175.0555 812 R 4.4208 8.1454 121.7613 54.3063 32.5181 174.7968 813 S 3.0041 5.8100 114.9855 57.8963 63.0596 175.4767 814 E 3.7791 8.4307 126.1700 59.2575 29.4003 178.0991 815 S 4.3459 7.6347 110.4316 59.3230 63.7857 174.4721 816 W 4.5710 7.3261 120.5954 57.1634 29.4974 175.1341 817 Q 4.7949 8.6545 120.4502 53.9090 31.6028 175.1239 818 V 4.0346 8.5790 123.5426 63.3699 31.3471 174.4256 819 Y 4.4221 9.0891 130.4067 58.7792 40.1872 175.4779 820 E 4.4246 7.9066 118.4819 55.7801 33.5648 176.7224 821 G 3.6708 8.9109 113.8926 44.7422 0.0000 171.9941 822 N 5.0895 8.1389 113.9766 50.5542 42.5920 175.4513 823 E 4.0473 8.8661 120.5213 59.4585 29.5053 179.5425 824 A 4.1158 8.0949 120.3345 54.9235 18.2206 178.6862 825 N 4.7428 7.8870 115.0568 54.6972 38.9053 176.1442 826 L 4.8516 8.0250 120.0595 54.9084 41.8966 177.2231 827 L 4.8196 7.7235 117.4721 54.4033 43.0730 176.5567 828 D 4.5785 7.9314 115.6225 53.0385 39.6327 178.2621 829 G 3.8837 8.4984 107.6931 45.7286 0.0000 172.8372 830 D 4.7798 8.0248 120.1070 52.2254 41.8319 176.4902 831 D 4.4106 8.8428 127.5107 57.2227 40.9364 177.2662 832 N 4.7729 8.8198 114.8430 52.8871 38.7371 174.5725 833 T 4.6480 7.7341 109.5098 59.8733 71.0635 173.9260 834 G 4.3170 8.1135 111.6736 44.7901 0.0000 171.6777 835 V 4.6571 8.4679 117.4798 59.5921 35.3525 174.4409 836 W 5.0500 9.1540 133.2991 56.1593 32.8296 173.8769 837 Y 5.0769 9.2748 126.2076 56.4569 39.4361 175.0607 838 K 2.6207 8.7551 127.1110 55.7488 33.2459 175.6850 839 T 4.6594 7.3380 117.0248 60.0411 71.2573 174.1219 840 L 4.7260 8.3959 126.6258 53.7450 41.8645 177.2472 841 N 4.1466 9.7742 114.1539 55.5749 36.4431 173.9193 842 G 3.8365 8.4813 98.9254 47.3447 0.0000 173.1460 843 D 4.8377 8.0957 111.4232 55.9297 38.7632 174.1134 844 T 4.9453 8.2549 113.9095 61.8673 72.2712 174.6317 845 S 5.0399 8.8552 121.3474 56.4689 63.7951 173.4854 846 L 4.8928 8.9286 127.1382 53.9155 43.0666 176.6918 847 A 4.1598 9.3694 125.3232 53.8756 18.8056 178.0606 848 G 4.0038 8.6029 109.8081 45.2005 0.0000 174.3090 849 E 4.2676 7.7972 118.9064 56.6994 30.9387 176.0699 850 F 5.3128 7.9426 115.8959 56.1380 41.8784 172.8365 851 I 4.6334 8.8931 119.5421 59.4854 41.6686 174.9234 852 G 3.6978 7.3832 114.3405 45.9240 0.0000 171.0919 853 L 5.2331 8.2648 120.0318 52.9878 45.9777 175.5201 854 D 4.8609 9.2927 123.8794 53.2359 41.7800 176.7961 855 L 4.1405 8.9363 127.0893 55.7827 41.7862 178.5638 856 G 4.0025 10.8519 108.2195 46.0708 0.0000 172.7850 857 K 4.6679 6.9771 116.5916 55.7862 35.8872 174.3451 858 E 4.4952 8.6800 120.7932 56.4481 30.0141 176.7341 859 I 4.5893 8.6654 125.0846 59.1660 41.2787 175.2064 860 K 4.5898 8.8378 125.9929 56.1845 32.2186 176.5100 861 L 4.6517 9.1826 126.8110 54.2798 42.9279 177.5842 862 D 4.6793 9.1861 122.7676 54.6488 42.9059 176.1374 863 G 3.1931 6.9921 104.2873 45.8579 0.0000 171.7020 864 I 5.0400 7.2780 112.0444 59.2548 41.7292 175.0187 865 R 4.7979 9.1349 123.4519 55.2843 32.7092 173.2032 866 F 5.2293 9.1485 126.1079 55.5664 41.9698 174.9027 867 V 4.6475 8.9681 125.7222 61.3743 32.7356 174.9899 868 I 4.4338 8.5354 122.4725 60.4290 40.1827 176.6759 869 G 4.3710 8.5015 113.4553 44.8712 0.0000 172.1574 870 K 4.3852 7.4814 116.1142 55.9346 35.2876 174.5110 871 N 4.9354 8.3351 116.3309 52.9089 41.2018 177.5514 872 G 3.8852 8.1885 107.6945 45.3940 0.0000 175.2832 873 G 3.5465 8.6178 113.6952 46.8662 0.0000 172.6906 874 G 3.0025 8.3397 111.0804 45.8931 0.0000 175.6226 875 S 4.5019 7.3287 115.4756 59.7351 63.0133 175.5936 876 S 4.5099 7.6396 115.1321 58.6708 63.4717 174.7332 877 D 4.6098 7.5057 123.4521 52.6676 39.0026 175.2649 878 K 4.3701 7.2395 118.8486 53.4666 36.6025 176.7377 879 W 4.6072 7.9801 121.4757 57.3142 29.9008 176.2969 880 N 4.7773 9.2894 120.0494 56.0009 39.3072 175.0589 881 K 5.3413 8.2307 117.6301 54.6138 35.8694 175.2880 882 F 5.4317 8.8782 118.7205 56.0203 42.0034 172.7788 883 K 5.2642 9.2609 117.1993 55.2558 36.4486 174.8607 884 L 5.4733 9.3937 125.0080 53.8377 43.8396 175.0491 885 E 5.5412 9.5668 123.7349 55.0830 33.7669 173.6012 886 Y 5.7970 8.9352 117.9679 56.0680 42.4108 173.6013 887 S 4.3242 9.0387 112.8830 57.1662 65.5560 174.0835 888 L 4.4269 8.3873 124.9021 55.4602 43.1738 176.6571 889 D 4.7839 7.5052 114.1352 51.8888 40.0380 174.8381 890 N 3.4232 7.6249 115.7379 54.4787 37.8568 173.4626 891 E 4.3959 8.5553 114.3205 56.7414 31.4019 175.5147 892 S 4.7024 7.9333 113.1184 56.7168 64.3977 173.5477 893 W 4.8435 8.5546 124.0324 55.0716 32.2926 175.0543 894 T 4.5033 8.4152 119.3166 61.7719 71.1187 173.5426 895 T 4.4158 8.5686 123.8579 63.9602 68.5195 174.6760 896 I 4.0976 9.0613 128.6221 63.8850 38.0891 176.4581 897 K 4.2730 7.6954 118.9653 55.6402 35.1360 173.9525 898 E 5.0861 8.5476 124.9266 55.0226 32.4847 174.8139 899 Y 4.5975 8.9264 118.3543 56.2880 42.5791 174.1241 900 D 5.2182 8.8461 122.3740 52.3856 43.4331 175.2354 901 K 4.7393 9.5261 127.6959 56.2507 32.9373 178.9043 902 T 3.9002 8.2617 119.0155 66.6163 68.4042 175.4030 903 G 3.9772 7.9495 106.1845 44.9240 0.0000 173.4392 904 A 4.1648 7.7632 122.9697 51.0802 18.9090 176.5871 905 P 4.3924 0.0000 0.0000 61.9451 32.1233 176.5673 906 A 3.9270 8.1497 123.1829 53.3513 18.8266 176.4633 907 G 3.6180 8.8551 106.0813 43.3931 0.0000 173.5925 908 K 4.0206 7.8987 117.9389 57.3139 32.8876 176.7985 909 D 4.5700 9.0485 122.9292 52.5781 44.3438 174.6134 910 V 4.2158 8.5146 127.3098 62.1735 32.1358 175.8586 911 I 4.2598 8.8344 131.6525 60.2698 37.6642 174.3125 912 E 4.9965 8.6770 128.0041 54.2043 31.8152 174.7825 913 E 4.7809 8.8900 125.7443 54.6139 33.6854 174.7530 914 S 4.7403 8.5865 119.2819 56.7962 65.0244 173.7583 915 F 4.8555 8.5324 124.8968 56.3355 38.5349 175.9313 916 E 4.0461 9.1046 124.2449 59.4797 29.5421 178.1040 917 T 4.2939 7.7273 115.2753 61.7938 69.0109 172.8937 918 P 4.6488 0.0000 0.0000 63.2541 32.4389 175.7090 919 I 4.1874 8.4792 123.7489 59.5986 39.2693 174.9524 920 S 4.9547 8.5438 123.6936 57.9267 63.5555 173.6174 921 A 4.8377 8.9539 125.8632 50.7754 22.4913 176.2650 922 K 4.4722 8.9145 121.4548 56.1946 34.3813 175.5889 923 Y 5.4014 7.7386 116.5559 56.3430 42.4007 174.1766 924 I 5.6529 8.9823 122.5083 59.9989 42.1766 173.7719 925 R 5.2632 9.5839 123.9572 55.6012 33.5480 173.2376 926 L 5.5900 9.3313 120.2290 53.7324 44.3168 175.9326 927 T 4.8743 8.9003 119.6774 61.2274 72.1017 173.0784 928 N 3.7727 8.1744 125.8361 54.0672 39.6718 174.8341 929 M 4.6681 8.9202 123.8626 55.1643 33.6408 175.5380 930 E 4.6680 8.6025 120.1395 54.3299 33.0462 174.5405 931 N 4.7313 8.9880 124.4767 54.1117 39.4936 174.2365 932 I 4.5660 8.6976 123.0214 58.7822 41.7280 174.7802 933 N 5.4834 8.3962 129.8883 52.3728 36.3246 174.2473 934 K 4.7538 7.5604 117.9183 54.4236 36.9744 178.4410 935 W 4.7479 8.5859 122.6697 56.0198 31.0353 175.0711 936 L 4.7329 8.9380 119.5665 53.6446 45.3634 176.0478 937 T 4.9124 8.1788 113.9512 60.0629 71.5552 173.4219 938 F 5.1026 8.7411 120.8431 56.5105 43.4753 175.2244 939 S 4.6398 8.9327 114.7729 58.0604 65.8530 174.4588 940 E 5.0194 7.4701 116.1366 55.3762 32.8023 174.5449 941 F 5.2081 9.3163 125.0180 55.7033 41.8194 174.3472 942 A 5.0787 9.7768 125.0381 50.2759 22.8694 174.6921 943 I 4.8054 8.5509 112.7402 59.1620 40.9791 174.7844 944 V 4.4089 8.4816 122.6828 61.1402 34.0132 174.5348 945 S 4.8193 8.4822 122.4940 57.3538 64.4464 173.2942 946 D 4.4646 10.2196 129.3607 57.3707 41.0587 178.3314 947 E 3.9057 8.4785 118.8432 59.4403 29.3607 178.1612 948 L 4.0553 7.4323 114.6988 55.3016 42.0317 177.0606 949 E 4.1144 7.8135 122.8547 56.7998 29.9513 174.0305 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 804 M 8.30 4.38 0.00 2.14 2.26 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 2.45 2.54 0.00 805 A 7.96 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 0.00 806 S 8.46 4.80 0.00 3.98 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 0.00 807 N 8.40 4.59 0.00 2.74 2.88 0.00 0.00 6.02 7.75 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 0.00 808 P 0.00 4.86 0.00 2.12 2.24 0.00 3.76 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.01 0.00 809 S 9.06 4.72 0.00 3.75 3.75 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 0.00 810 L 8.49 4.64 0.00 1.59 1.55 0.54 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 811 I 8.56 4.72 1.99 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 1.27 1.06 0.00 0.00 812 R 8.15 4.42 0.00 0.78 1.42 0.00 2.73 0.00 0.00 2.57 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 1.53 0.00 813 S 5.81 3.00 0.00 2.72 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 0.00 814 E 8.43 3.78 0.00 1.80 1.85 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 2.23 2.25 0.00 815 S 7.63 4.35 0.00 4.04 3.95 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 0.00 816 W 7.33 4.57 0.00 3.12 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 0.00 817 Q 8.65 4.79 0.00 1.87 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 7.00 0.00 0.00 0.00 0.00 0.00 2.26 2.41 0.00 818 V 8.58 4.03 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 0.69 0.00 0.00 1.06 0.00 0.00 819 Y 9.09 4.42 0.00 2.48 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 0.00 820 E 7.91 4.42 0.00 2.19 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 2.36 2.35 0.00 821 G 8.91 3.67 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 822 N 8.14 5.09 0.00 2.74 2.66 0.00 0.00 6.87 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 0.00 823 E 8.87 4.05 0.00 2.06 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 0.00 2.51 2.46 0.00 824 A 8.09 4.12 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 0.00 825 N 7.89 4.74 0.00 2.87 2.92 0.00 0.00 6.93 7.21 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 0.00 826 L 8.02 4.85 0.00 1.92 1.97 1.11 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 827 L 7.72 4.82 0.00 1.64 1.66 0.95 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 828 D 7.93 4.58 0.00 2.89 2.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 829 G 8.50 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 0.00 830 D 8.02 4.78 0.00 2.75 2.69 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 0.00 0.00 0.00 0.00 831 D 8.84 4.41 0.00 2.69 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 0.00 832 N 8.82 4.77 0.00 2.79 2.82 0.00 0.00 6.81 7.35 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 0.00 833 T 7.73 4.65 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 1.26 0.00 0.00 834 G 8.11 4.32 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 0.00 835 V 8.47 4.66 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 0.47 0.00 0.00 0.58 0.00 0.00 836 W 9.15 5.05 0.00 3.45 3.19 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 0.00 837 Y 9.27 5.08 0.00 2.76 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 0.00 838 K 8.76 2.62 0.00 0.79 1.01 0.00 1.04 0.00 0.00 1.57 0.00 0.00 2.74 0.00 0.00 2.89 0.00 0.00 0.00 0.00 0.90 0.21 7.81 839 T 7.34 4.66 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 0.84 0.00 0.00 840 L 8.40 4.73 0.00 1.76 1.53 0.98 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 841 N 9.77 4.15 0.00 3.04 2.89 0.00 0.00 6.70 7.65 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 0.00 842 G 8.48 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 0.00 0.00 0.00 843 D 8.10 4.84 0.00 2.97 2.85 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 0.00 844 T 8.25 4.95 4.43 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 1.31 0.00 0.00 845 S 8.86 5.04 0.00 4.12 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 0.00 846 L 8.93 4.89 0.00 1.71 1.60 0.96 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 847 A 9.37 4.16 1.23 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 0.00 848 G 8.60 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 0.00 0.00 0.00 849 E 7.80 4.27 0.00 2.34 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 0.00 2.35 2.46 0.00 850 F 7.94 5.31 0.00 2.95 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 0.00 851 I 8.89 4.63 1.70 0.00 0.00 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.12 0.98 0.44 0.00 0.00 852 G 7.38 3.70 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 0.00 0.00 0.00 853 L 8.26 5.23 0.00 1.68 1.60 1.17 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 854 D 9.29 4.86 0.00 2.95 2.63 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.94 4.14 0.00 1.62 1.67 1.00 1.04 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 0.00 856 G 10.85 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 0.00 0.00 0.00 857 K 6.98 4.67 0.00 1.76 1.84 0.00 1.49 0.00 0.00 1.80 0.00 0.00 2.85 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.33 1.40 7.81 858 E 8.68 4.50 0.00 1.85 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 2.28 2.30 0.00 859 I 8.67 4.59 1.87 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 1.22 0.91 0.98 0.00 0.00 860 K 8.84 4.59 0.00 1.67 1.80 0.00 1.69 0.00 0.00 1.70 0.00 0.00 2.84 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.46 1.51 7.81 861 L 9.18 4.65 0.00 1.84 1.84 1.06 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 862 D 9.19 4.68 0.00 2.59 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 0.00 863 G 6.99 3.19 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 0.00 0.00 0.00 0.00 864 I 7.28 5.04 0.98 0.00 0.00 0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.95 0.56 0.96 0.00 0.00 865 R 9.13 4.80 0.00 1.80 1.83 0.00 3.14 0.00 0.00 3.18 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.59 0.00 866 F 9.15 5.23 0.00 2.86 2.37 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 0.00 867 V 8.97 4.65 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 1.00 0.00 0.00 0.94 0.00 0.00 868 I 8.54 4.43 1.59 0.00 0.00 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.44 0.98 0.00 0.00 869 G 8.50 4.37 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 0.00 870 K 7.48 4.39 0.00 1.77 1.75 0.00 1.38 0.00 0.00 1.63 0.00 0.00 2.97 0.00 0.00 2.39 0.00 0.00 0.00 0.00 1.03 1.20 7.81 871 N 8.34 4.94 0.00 2.66 2.70 0.00 0.00 6.93 7.65 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 0.00 872 G 8.19 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 0.00 0.00 0.00 873 G 8.62 3.55 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 0.00 0.00 0.00 874 G 8.34 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 0.00 0.00 0.00 875 S 7.33 4.50 0.00 3.93 4.09 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 0.00 876 S 7.64 4.51 0.00 3.78 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 0.00 877 D 7.51 4.61 0.00 2.69 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 0.00 878 K 7.24 4.37 0.00 1.56 1.46 0.00 1.63 0.00 0.00 1.52 0.00 0.00 3.09 0.00 0.00 2.84 0.00 0.00 0.00 0.00 0.94 1.16 7.81 879 W 7.98 4.61 0.00 3.30 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 0.00 880 N 9.29 4.78 0.00 2.83 2.98 0.00 0.00 6.85 7.68 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 0.00 881 K 8.23 5.34 0.00 1.75 1.73 0.00 1.73 0.00 0.00 1.90 0.00 0.00 3.11 0.00 0.00 3.27 0.00 0.00 0.00 0.00 1.48 1.48 7.81 882 F 8.88 5.43 0.00 3.23 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 0.00 883 K 9.26 5.26 0.00 2.01 1.95 0.00 1.31 0.00 0.00 1.58 0.00 0.00 2.73 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.49 1.43 7.81 884 L 9.39 5.47 0.00 2.26 1.93 1.29 1.01 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 0.00 885 E 9.57 5.54 0.00 2.32 2.07 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 2.20 2.28 0.00 886 Y 8.94 5.80 0.00 3.30 3.18 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 0.00 887 S 9.04 4.32 0.00 2.72 2.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 888 L 8.39 4.43 0.00 1.56 1.61 0.99 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 889 D 7.51 4.78 0.00 2.71 2.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 890 N 7.62 3.42 0.00 1.98 2.55 0.00 0.00 6.78 7.01 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 0.00 891 E 8.56 4.40 0.00 1.84 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 0.00 2.16 2.25 0.00 892 S 7.93 4.70 0.00 3.76 3.67 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 0.00 0.00 0.00 0.00 893 W 8.55 4.84 0.00 3.02 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 0.00 894 T 8.42 4.50 3.16 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 1.13 0.00 0.00 895 T 8.57 4.42 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 1.31 0.00 0.00 896 I 9.06 4.10 2.12 0.00 0.00 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.79 0.87 0.00 0.00 897 K 7.70 4.27 0.00 1.74 1.48 0.00 1.59 0.00 0.00 1.82 0.00 0.00 2.16 0.00 0.00 2.59 0.00 0.00 0.00 0.00 0.53 1.13 7.81 898 E 8.55 5.09 0.00 1.75 1.75 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 2.20 2.26 0.00 899 Y 8.93 4.60 0.00 1.44 2.36 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 0.00 900 D 8.85 5.22 0.00 2.65 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 0.00 901 K 9.53 4.74 0.00 2.05 1.91 0.00 2.02 0.00 0.00 1.77 0.00 0.00 3.11 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.49 1.86 7.81 902 T 8.26 3.90 4.29 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 1.25 0.00 0.00 903 G 7.95 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 0.00 0.00 0.00 904 A 7.76 4.16 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 0.00 905 P 0.00 4.39 0.00 2.04 1.99 0.00 3.70 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.08 0.00 906 A 8.15 3.93 1.17 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 0.00 907 G 8.86 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 K 7.90 4.02 0.00 1.55 1.74 0.00 1.61 0.00 0.00 1.78 0.00 0.00 2.85 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.41 1.48 7.81 909 D 9.05 4.57 0.00 2.67 2.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 910 V 8.51 4.22 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 0.84 0.00 0.00 0.92 0.00 0.00 911 I 8.83 4.26 2.04 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.85 0.88 0.00 0.00 912 E 8.68 5.00 0.00 1.92 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 2.13 2.37 0.00 913 E 8.89 4.78 0.00 1.82 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 2.31 2.63 0.00 914 S 8.59 4.74 0.00 3.68 3.70 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 0.00 915 F 8.53 4.86 0.00 2.84 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 0.00 916 E 9.10 4.05 0.00 1.99 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 2.36 2.31 0.00 917 T 7.73 4.29 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 1.21 0.00 0.00 918 P 0.00 4.65 0.00 1.94 2.03 0.00 3.65 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.16 0.00 919 I 8.48 4.19 1.36 0.00 0.00 -0.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.80 0.61 -0.28 0.00 0.00 920 S 8.54 4.95 0.00 3.74 3.79 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 0.00 0.00 0.00 0.00 921 A 8.95 4.84 1.21 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 0.00 0.00 922 K 8.91 4.47 0.00 1.69 1.49 0.00 1.50 0.00 0.00 1.64 0.00 0.00 2.73 0.00 0.00 2.87 0.00 0.00 0.00 0.00 0.30 1.02 7.81 923 Y 7.74 5.40 0.00 2.64 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 0.00 924 I 8.98 5.65 2.17 0.00 0.00 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 2.11 1.29 0.00 0.00 925 R 9.58 5.26 0.00 2.08 2.09 0.00 2.21 0.00 0.00 2.37 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 1.44 0.00 926 L 9.33 5.59 0.00 2.19 2.22 1.31 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.37 0.00 0.00 0.00 0.00 0.00 0.00 927 T 8.90 4.87 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 1.08 0.00 0.00 928 N 8.17 3.77 0.00 1.44 2.22 0.00 0.00 6.63 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 0.00 929 M 8.92 4.67 0.00 1.88 2.17 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 2.69 2.42 0.00 930 E 8.60 4.67 0.00 1.98 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 0.00 2.27 2.32 0.00 931 N 8.99 4.73 0.00 2.69 2.81 0.00 0.00 6.78 7.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 932 I 8.70 4.57 2.02 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 1.49 1.20 0.00 0.00 933 N 8.40 5.48 0.00 2.79 2.76 0.00 0.00 7.11 6.68 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 0.00 934 K 7.56 4.75 0.00 1.66 1.64 0.00 1.95 0.00 0.00 1.76 0.00 0.00 2.89 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.32 1.46 7.81 935 W 8.59 4.75 0.00 3.46 3.34 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 0.00 936 L 8.94 4.73 0.00 1.05 0.72 0.28 -0.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 937 T 8.18 4.91 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 0.42 0.00 0.00 938 F 8.74 5.10 0.00 3.26 3.15 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 0.00 0.00 0.00 939 S 8.93 4.64 0.00 3.64 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 0.00 940 E 7.47 5.02 0.00 2.04 1.70 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 2.22 2.36 0.00 941 F 9.32 5.21 0.00 2.85 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 0.00 942 A 9.78 5.08 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 0.00 943 I 8.55 4.81 1.96 0.00 0.00 0.92 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 0.82 1.13 0.00 0.00 944 V 8.48 4.41 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 0.93 0.00 0.00 0.87 0.00 0.00 945 S 8.48 4.82 0.00 3.89 3.70 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 0.00 946 D 10.22 4.46 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 0.00 947 E 8.48 3.91 0.00 1.92 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 2.36 0.00 948 L 7.43 4.06 0.00 1.87 1.72 0.94 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 949 E 7.81 4.11 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 2.24 2.28 0.00