NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 807 N 4.7350 8.4249 118.1276 52.1231 39.9672 173.8990 808 P 4.5494 0.0000 0.0000 61.5929 32.1289 174.0119 809 S 4.9054 9.1221 117.6200 56.1324 66.9077 172.6331 810 L 4.6955 8.4640 123.3246 54.9453 42.8643 175.8729 811 I 4.8076 8.5728 119.2781 59.2507 40.5061 174.5191 812 R 4.2642 8.1047 120.0103 54.4571 32.3461 174.5215 813 S 3.1391 6.0371 115.6143 58.5851 62.8262 176.2036 814 E 3.8913 8.3899 123.8843 58.7555 29.6034 178.3743 815 S 4.2653 7.5543 112.2795 59.9663 63.6789 174.8360 816 W 4.5792 7.1315 119.7576 57.1742 29.4270 175.0494 817 Q 4.6943 8.7672 121.0789 54.2552 30.6763 175.1947 818 V 3.9497 8.4540 123.7088 63.2692 31.4584 174.8142 819 Y 4.3983 8.7894 130.3300 59.8108 39.1832 175.2842 820 E 4.4066 7.8574 116.8661 55.5980 34.4692 176.4336 821 G 4.1129 9.4667 108.7893 44.6239 0.0000 171.8384 822 N 4.9809 8.1182 114.8060 50.8357 42.1103 175.7536 823 E 4.0245 8.8916 123.9651 59.1507 29.5607 179.2192 824 A 4.0619 8.7420 121.4722 55.0767 18.1188 179.1428 825 N 4.5945 8.1410 114.2210 55.7972 38.8483 176.4364 826 L 4.7297 8.0375 119.3526 55.3213 41.7625 177.4726 827 L 5.0208 7.7644 117.2292 54.3010 43.3388 176.5640 828 D 4.5492 8.3215 117.1035 53.0170 39.7998 177.1046 829 G 3.8479 9.0164 108.1811 45.9846 0.0000 172.8003 830 D 4.8522 8.2585 119.7093 51.8981 42.6724 176.6618 831 D 4.3690 8.8059 127.0611 57.1649 40.9723 177.0654 832 N 4.6539 8.6793 115.0717 53.4693 38.9225 174.7895 833 T 4.6372 7.5301 109.6021 59.7233 71.0497 173.9604 834 G 4.0492 8.1179 112.4711 44.7779 0.0000 171.3134 835 V 4.6027 8.6475 118.0667 60.8250 35.6766 175.2463 836 W 5.2251 9.0263 135.0000 55.9797 33.2451 173.5021 837 Y 5.1289 9.5405 125.7396 56.1895 39.9510 174.8177 838 K 2.7929 8.5542 126.2455 55.3237 33.2521 175.5117 839 T 4.5524 7.4124 117.3466 60.5708 71.1168 174.8690 840 L 4.7738 8.3118 125.9120 55.2131 43.3017 176.3696 841 N 4.3637 9.6885 112.9869 55.4942 36.2261 173.6937 842 G 3.7500 8.4687 99.4927 47.3787 0.0000 173.5763 843 D 4.8999 8.1354 111.8723 54.7864 38.6407 174.0993 844 T 4.9788 8.1483 113.8159 61.8706 72.2717 174.7745 845 S 5.1078 9.0707 122.0396 56.7845 63.5760 173.5035 846 L 4.8997 9.0792 127.2979 53.9277 43.0570 176.7000 847 A 4.1486 8.8558 125.0704 54.1728 18.7431 178.1942 848 G 3.9792 8.9204 110.5207 45.1858 0.0000 174.0824 849 E 4.4166 7.8616 118.8027 56.7522 31.0497 175.7832 850 F 5.4718 8.2919 115.3060 56.6720 41.8093 172.6836 851 I 4.6491 8.6161 119.0989 59.6020 41.4069 174.1591 852 G 3.8980 7.9214 116.6150 45.9667 0.0000 171.6634 853 L 5.2082 8.5205 121.7063 53.0022 46.2208 175.3416 854 D 5.0644 9.2206 123.4742 53.0940 42.1304 176.6881 855 L 4.0438 8.9339 126.4993 55.5396 41.7112 176.7773 856 G 4.1867 10.2236 107.9008 45.0797 0.0000 173.4833 857 K 4.5469 7.0781 115.8766 55.0274 36.2566 174.9532 858 E 4.2851 8.6496 122.8812 56.3549 30.0576 175.7780 859 I 4.7660 8.8015 119.7456 59.0043 41.9178 174.3140 860 K 4.6699 8.5885 122.7192 55.7645 32.8375 176.2609 861 L 4.7403 9.0029 126.4259 53.9702 42.6758 177.3336 862 D 4.6137 9.4466 123.2920 54.6397 42.5648 176.2942 863 G 3.1314 7.1068 104.7377 45.9427 0.0000 171.3907 864 I 5.1034 7.4484 111.9192 59.1845 41.7164 174.9462 865 R 4.7888 9.2151 123.5755 55.1791 32.8737 173.4416 866 F 5.4024 9.5072 126.0289 55.5682 42.5455 174.9176 867 V 4.6661 8.6501 123.5439 61.2369 33.4619 174.9427 868 I 4.4624 8.5492 122.3726 60.4954 40.2724 176.4860 869 G 4.3667 9.0378 112.5984 45.0856 0.0000 172.1333 870 K 4.2222 7.2806 115.8399 55.7620 34.7957 174.1337 871 N 4.6038 8.3499 117.8030 54.3784 40.8664 176.1799 872 G 3.8580 8.2301 113.5696 45.8781 0.0000 176.9212 873 G 3.4898 8.6617 113.0768 46.4555 0.0000 172.9728 874 G 3.0965 8.3949 111.1313 46.1388 0.0000 175.6439 875 S 4.3256 7.8018 116.0476 59.6120 63.0273 175.6987 876 S 4.6496 7.7203 113.3641 58.0938 62.8894 174.8766 877 D 4.6319 7.6904 124.1874 53.1106 38.9957 175.2396 878 K 4.2277 7.3673 119.3068 53.5082 36.6139 176.6748 879 W 4.6912 8.1289 121.1033 57.6132 29.8991 175.8037 880 N 4.9606 9.1633 117.7822 54.5651 40.0887 175.1676 881 K 5.2255 8.2096 117.3792 54.4861 34.8298 175.7793 882 F 5.1890 8.5221 119.0781 55.7173 41.8712 173.0394 883 K 5.2216 9.3514 118.3288 55.1082 36.4301 174.5739 884 L 5.4290 9.2064 124.4547 54.0831 43.6625 175.1634 885 E 5.5282 9.5977 123.5697 55.1066 33.7378 173.4983 886 Y 5.8422 9.0304 118.3880 55.9311 42.2757 173.7649 887 S 4.4322 9.0414 112.6950 57.2221 65.5316 174.5428 888 L 4.4067 8.4131 123.6681 55.5339 42.3196 177.0951 889 D 4.6876 7.1967 114.0298 51.8393 40.6036 174.9411 890 N 3.4854 7.7337 116.3783 54.3992 37.9345 173.7385 891 E 4.4470 8.4087 114.5047 57.0752 31.8369 176.1691 892 S 4.8070 7.8047 112.5716 56.4820 64.6698 173.6115 893 W 4.8064 8.7116 123.0631 55.0950 32.4456 175.0306 894 T 4.4877 8.5170 118.7712 61.9581 71.2752 173.3960 895 T 4.6067 8.6253 121.1338 62.1138 67.9981 173.9061 896 I 4.4183 9.0170 127.9454 62.7368 39.0061 176.3219 897 K 4.5911 7.8637 118.7598 54.9068 36.6534 175.0167 898 E 4.9891 8.3958 121.8888 54.7549 32.3665 174.9767 899 Y 4.5975 9.0175 120.6659 56.0730 41.8786 174.4454 900 D 4.7837 8.7314 121.5857 52.3721 43.5483 175.0066 901 K 4.6938 9.3425 127.3641 56.0651 32.8147 176.7829 902 T 4.0646 8.1255 116.2794 65.3175 68.6350 174.7635 903 G 3.8667 9.0483 112.8180 45.8041 0.0000 173.5212 904 A 4.1849 7.7172 122.0030 51.0214 18.9349 176.5823 905 P 4.2946 0.0000 0.0000 62.2024 32.0103 176.6840 906 A 3.9200 8.3161 124.2317 53.8556 18.9940 177.6757 907 G 3.7373 8.7063 106.1671 43.5647 0.0000 173.4402 908 K 4.2198 8.2540 117.9149 56.9610 33.0816 176.3843 909 D 4.6593 8.9824 122.8569 52.5813 44.4952 174.2274 910 V 4.4006 8.5630 126.5553 62.2763 32.6628 175.0935 911 I 4.4021 9.2381 130.4917 59.8124 38.5521 174.4013 912 E 5.1007 8.6940 127.5905 54.3954 32.6489 174.5007 913 E 4.8188 8.9651 124.7575 54.7409 34.3188 174.4980 914 S 4.6635 8.4911 117.7841 56.5704 66.3016 173.3306 915 F 5.1110 8.3614 123.3300 55.6549 39.7733 175.6306 916 E 4.0784 9.3216 122.8363 58.8624 29.6338 177.3677 917 T 4.5650 7.6188 115.3703 60.3914 70.3322 172.4600 918 P 4.7496 0.0000 0.0000 63.1211 32.6148 175.5500 919 I 4.2246 8.4438 123.0109 59.5480 39.3820 175.0919 920 S 4.9465 8.5344 123.6377 58.1409 63.4752 173.5832 921 A 4.7670 9.0313 125.7976 50.6081 22.4754 176.1788 922 K 4.2959 9.0833 120.8874 56.1755 34.6727 175.6511 923 Y 5.3525 7.7939 116.3039 56.2995 42.5061 174.3148 924 I 5.6337 9.1432 122.5946 60.0986 42.1549 173.7166 925 R 5.2468 9.6889 124.5422 55.5360 33.5348 173.2883 926 L 5.5729 9.2577 119.8568 53.7752 44.2916 176.0844 927 T 4.8303 8.9711 119.0063 61.6330 72.7730 174.0036 928 N 3.8598 8.1541 125.4471 52.8680 40.7430 172.6881 *930 E 4.2929 8.4738 118.8755 55.6024 30.4547 175.1158 931 N 4.5300 8.8204 122.5055 54.2831 39.3387 173.8892 932 I 4.6271 8.6377 121.3905 58.9179 41.7841 174.5959 933 N 5.1974 8.3951 129.2132 51.5117 36.2489 173.8032 934 K 4.7734 7.5526 118.1954 54.6155 37.3119 177.9229 935 W 4.7210 8.5463 122.1231 56.0897 30.9738 175.2312 936 L 4.7713 9.0330 119.4190 53.7074 45.7765 175.8251 937 T 4.9898 8.1350 113.1158 59.9902 71.8183 173.0042 938 F 5.1518 8.9930 120.9599 56.5285 43.5582 175.2168 939 S 4.6667 8.8221 114.3710 59.7767 65.9473 174.5101 940 E 4.9527 7.4136 116.9704 55.2124 32.9128 174.3126 941 F 5.0565 9.1781 124.0338 55.7706 42.1509 174.1210 942 A 5.1010 9.5831 124.9666 50.2400 22.9108 174.5284 943 I 4.9878 8.5541 112.2103 59.0798 41.2173 174.7885 944 V 4.4089 8.6249 123.0023 61.1461 33.9153 175.6516 945 S 4.5792 8.4061 120.6715 58.7325 62.3042 173.2669 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 807 N 8.42 4.73 0.00 2.75 2.86 0.00 0.00 6.94 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 0.00 808 P 0.00 4.55 0.00 2.07 2.07 0.00 3.66 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 2.10 2.19 0.00 809 S 9.12 4.91 0.00 3.86 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 0.00 810 L 8.46 4.70 0.00 1.64 1.58 0.68 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 811 I 8.57 4.81 2.08 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.27 1.07 0.00 0.00 812 R 8.10 4.26 0.00 0.76 1.44 0.00 2.66 0.00 0.00 2.56 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 1.49 0.00 813 S 6.04 3.14 0.00 2.72 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 0.00 814 E 8.39 3.89 0.00 1.81 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.14 0.00 815 S 7.55 4.27 0.00 3.98 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 0.00 816 W 7.13 4.58 0.00 3.19 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 0.00 817 Q 8.77 4.69 0.00 1.84 1.95 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 2.28 2.24 0.00 818 V 8.45 3.95 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 0.65 0.00 0.00 1.04 0.00 0.00 819 Y 8.79 4.40 0.00 2.46 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 E 7.86 4.41 0.00 2.08 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 1.72 1.47 0.00 821 G 9.47 4.11 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 0.00 0.00 0.00 0.00 0.00 0.00 822 N 8.12 4.98 0.00 2.65 2.59 0.00 0.00 6.94 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 0.00 823 E 8.89 4.02 0.00 2.10 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 2.54 2.45 0.00 824 A 8.74 4.06 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 0.00 825 N 8.14 4.59 0.00 2.87 2.92 0.00 0.00 7.02 8.05 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 0.00 826 L 8.04 4.73 0.00 1.95 2.02 1.19 0.61 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 0.00 827 L 7.76 5.02 0.00 1.64 1.67 0.99 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.00 0.00 0.00 0.00 0.00 0.00 828 D 8.32 4.55 0.00 2.80 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 9.02 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 0.00 0.00 0.00 0.00 830 D 8.26 4.85 0.00 2.70 2.64 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 0.00 831 D 8.81 4.37 0.00 2.69 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 0.00 832 N 8.68 4.65 0.00 2.82 2.83 0.00 0.00 6.79 7.17 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 0.00 833 T 7.53 4.64 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 1.28 0.00 0.00 834 G 8.12 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 0.00 0.00 0.00 0.00 835 V 8.65 4.60 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 0.27 0.00 0.00 0.92 0.00 0.00 836 W 9.03 5.23 0.00 3.42 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 0.00 837 Y 9.54 5.13 0.00 2.72 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 0.00 838 K 8.55 2.79 0.00 0.79 0.98 0.00 0.92 0.00 0.00 1.48 0.00 0.00 2.73 0.00 0.00 2.81 0.00 0.00 0.00 0.00 0.84 0.21 7.81 839 T 7.41 4.55 4.45 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 0.93 0.00 0.00 840 L 8.31 4.77 0.00 1.77 1.63 0.96 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 841 N 9.69 4.36 0.00 3.08 2.93 0.00 0.00 6.75 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 8.47 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 0.00 0.00 0.00 843 D 8.14 4.90 0.00 3.16 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 0.00 844 T 8.15 4.98 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 1.36 0.00 0.00 845 S 9.07 5.11 0.00 4.14 4.12 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 0.00 846 L 9.08 4.90 0.00 1.81 1.61 0.96 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 847 A 8.86 4.15 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 0.00 848 G 8.92 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 0.00 849 E 7.86 4.42 0.00 2.33 2.19 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 2.35 2.48 0.00 850 F 8.29 5.47 0.00 3.01 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 0.00 851 I 8.62 4.65 1.65 0.00 0.00 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.09 1.09 0.30 0.00 0.00 852 G 7.92 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 0.00 0.00 0.00 853 L 8.52 5.21 0.00 1.67 1.59 1.16 1.01 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 0.00 854 D 9.22 5.06 0.00 2.96 2.62 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 0.00 855 L 8.93 4.04 0.00 1.61 1.67 1.02 1.05 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 0.00 856 G 10.22 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 0.00 0.00 0.00 0.00 857 K 7.08 4.55 0.00 1.76 1.84 0.00 1.49 0.00 0.00 1.73 0.00 0.00 2.81 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.36 1.40 7.81 858 E 8.65 4.29 0.00 1.98 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 2.27 2.29 0.00 859 I 8.80 4.77 1.87 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 1.34 0.56 0.90 0.00 0.00 860 K 8.59 4.67 0.00 1.67 1.81 0.00 1.73 0.00 0.00 1.70 0.00 0.00 2.76 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.39 1.46 7.81 861 L 9.00 4.74 0.00 1.79 1.80 1.05 0.97 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 0.00 862 D 9.45 4.61 0.00 2.72 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 0.00 0.00 0.00 0.00 863 G 7.11 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 0.00 0.00 0.00 864 I 7.45 5.10 1.09 0.00 0.00 0.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.51 0.99 0.00 0.00 865 R 9.22 4.79 0.00 1.80 1.82 0.00 3.03 0.00 0.00 3.18 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.59 0.00 866 F 9.51 5.40 0.00 2.87 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 0.00 0.00 0.00 0.00 867 V 8.65 4.67 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 0.94 0.00 0.00 0.90 0.00 0.00 868 I 8.55 4.46 1.62 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 1.28 0.39 0.99 0.00 0.00 869 G 9.04 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 7.28 4.22 0.00 1.76 1.72 0.00 1.36 0.00 0.00 1.56 0.00 0.00 2.78 0.00 0.00 2.23 0.00 0.00 0.00 0.00 0.99 1.10 7.81 871 N 8.35 4.60 0.00 2.63 2.67 0.00 0.00 6.98 7.98 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 0.00 872 G 8.23 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 0.00 0.00 0.00 873 G 8.66 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 0.00 0.00 0.00 874 G 8.39 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 0.00 0.00 0.00 875 S 7.80 4.33 0.00 3.97 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 7.72 4.65 0.00 3.93 3.91 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 0.00 0.00 0.00 877 D 7.69 4.63 0.00 2.76 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 0.00 878 K 7.37 4.23 0.00 1.59 1.52 0.00 1.65 0.00 0.00 1.53 0.00 0.00 3.07 0.00 0.00 2.86 0.00 0.00 0.00 0.00 0.95 1.18 7.81 879 W 8.13 4.69 0.00 3.48 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 0.00 880 N 9.16 4.96 0.00 2.82 2.97 0.00 0.00 6.73 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 8.21 5.23 0.00 1.65 1.72 0.00 1.81 0.00 0.00 1.94 0.00 0.00 3.03 0.00 0.00 3.21 0.00 0.00 0.00 0.00 1.44 1.46 7.81 882 F 8.52 5.19 0.00 3.20 3.03 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 0.00 0.00 0.00 883 K 9.35 5.22 0.00 1.99 1.94 0.00 1.31 0.00 0.00 1.57 0.00 0.00 2.73 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.49 1.40 7.81 884 L 9.21 5.43 0.00 2.29 1.89 1.20 1.16 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 0.00 885 E 9.60 5.53 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 2.21 2.30 0.00 886 Y 9.03 5.84 0.00 3.31 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 0.00 887 S 9.04 4.43 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 8.41 4.41 0.00 1.61 1.69 0.93 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 889 D 7.20 4.69 0.00 2.64 2.62 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 0.00 890 N 7.73 3.49 0.00 1.73 2.54 0.00 0.00 6.88 6.93 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 0.00 891 E 8.41 4.45 0.00 2.09 1.83 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 2.14 2.28 0.00 892 S 7.80 4.81 0.00 3.55 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 0.00 893 W 8.71 4.81 0.00 3.05 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 0.00 894 T 8.52 4.49 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 1.11 0.00 0.00 895 T 8.63 4.61 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 1.22 0.00 0.00 896 I 9.02 4.42 2.03 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 1.03 0.93 0.00 0.00 897 K 7.86 4.59 0.00 1.53 0.97 0.00 1.53 0.00 0.00 1.70 0.00 0.00 2.93 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.49 1.51 7.81 898 E 8.40 4.99 0.00 1.68 1.72 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 2.16 2.24 0.00 899 Y 9.02 4.60 0.00 1.52 2.33 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 0.00 900 D 8.73 4.78 0.00 2.63 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 0.00 901 K 9.34 4.69 0.00 2.04 1.92 0.00 1.88 0.00 0.00 1.77 0.00 0.00 3.09 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.51 1.90 7.81 902 T 8.13 4.06 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 9.05 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 904 A 7.72 4.18 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 4.29 0.00 2.04 1.99 0.00 3.72 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 2.09 0.00 906 A 8.32 3.92 1.18 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 0.00 0.00 907 G 8.71 3.74 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 0.00 0.00 0.00 908 K 8.25 4.22 0.00 1.60 1.71 0.00 1.65 0.00 0.00 1.75 0.00 0.00 2.72 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.37 1.37 7.81 909 D 8.98 4.66 0.00 2.67 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 0.00 0.00 0.00 0.00 910 V 8.56 4.40 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 0.84 0.00 0.00 0.92 0.00 0.00 911 I 9.24 4.40 2.03 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 1.17 0.81 0.75 0.00 0.00 912 E 8.69 5.10 0.00 1.90 1.76 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 2.11 2.40 0.00 913 E 8.97 4.82 0.00 1.79 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 2.34 2.65 0.00 914 S 8.49 4.66 0.00 3.61 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 0.00 915 F 8.36 5.11 0.00 2.85 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 0.00 916 E 9.32 4.08 0.00 2.10 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.31 0.00 917 T 7.62 4.57 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 4.75 0.00 1.94 2.10 0.00 3.65 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 2.04 2.33 0.00 919 I 8.44 4.22 1.31 0.00 0.00 -0.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.83 0.21 -0.21 0.00 0.00 920 S 8.53 4.95 0.00 3.73 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 0.00 921 A 9.03 4.77 1.24 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 0.00 0.00 0.00 922 K 9.08 4.30 0.00 1.72 1.66 0.00 1.54 0.00 0.00 1.92 0.00 0.00 2.82 0.00 0.00 2.95 0.00 0.00 0.00 0.00 0.30 0.84 7.81 923 Y 7.79 5.35 0.00 2.78 3.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 924 I 9.14 5.63 2.17 0.00 0.00 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.98 1.26 0.00 0.00 925 R 9.69 5.25 0.00 2.04 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 1.36 1.47 0.00 926 L 9.26 5.57 0.00 2.15 2.18 1.30 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.38 0.00 0.00 0.00 0.00 0.00 0.00 927 T 8.97 4.83 4.15 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 1.11 0.00 0.00 928 N 8.15 3.86 0.00 1.44 2.33 0.00 0.00 6.44 7.62 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 *930 E 8.47 4.29 0.00 2.02 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 2.37 0.00 931 N 8.82 4.53 0.00 2.79 2.84 0.00 0.00 6.77 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 8.64 4.63 2.04 0.00 0.00 1.00 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 1.77 1.19 0.00 0.00 933 N 8.40 5.20 0.00 2.80 2.77 0.00 0.00 7.12 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 7.55 4.77 0.00 1.68 1.67 0.00 1.82 0.00 0.00 1.79 0.00 0.00 2.93 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.34 1.51 7.81 935 W 8.55 4.72 0.00 3.47 3.39 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 0.00 936 L 9.03 4.77 0.00 1.03 0.63 0.09 -0.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 0.00 0.00 0.00 0.00 937 T 8.14 4.99 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 0.59 0.00 0.00 938 F 8.99 5.15 0.00 3.21 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 0.00 939 S 8.82 4.67 0.00 3.64 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 0.00 940 E 7.41 4.95 0.00 2.01 1.65 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 2.27 2.40 0.00 941 F 9.18 5.06 0.00 2.81 2.60 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 0.00 942 A 9.58 5.10 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 0.00 943 I 8.55 4.99 1.97 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 0.85 1.13 0.00 0.00 944 V 8.62 4.41 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 0.90 0.00 0.00 0.90 0.00 0.00 945 S 8.41 4.58 0.00 3.84 3.66 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 * Residues marked with a * may have inaccurate shift predictions.