NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 697 E 4.2629 8.4401 120.2287 56.1398 31.3231 176.1566 698 A 3.9268 8.4518 124.0301 49.9545 19.7685 175.8277 699 P 4.3013 0.0000 0.0000 62.4935 32.9855 174.6937 700 N 4.5331 8.5703 120.9026 53.2552 37.5901 173.5316 701 Q 4.4200 8.3261 122.7766 55.3001 29.0901 176.2313 702 A 4.0075 7.8208 120.6843 52.6504 18.7709 177.6998 703 L 4.4076 8.2244 120.7530 53.3804 42.9384 176.0032 704 L 4.4682 8.3671 125.2715 53.3375 43.5083 174.9670 705 R 4.5908 8.3424 126.1567 54.7793 32.3092 174.4147 706 I 4.7391 8.3723 127.1383 60.1556 38.2237 174.9949 707 L 4.8890 8.6317 127.6997 52.9115 44.0122 176.6808 708 K 4.3462 8.4612 121.2647 55.5137 33.0817 178.2151 709 E 2.9918 8.6424 123.4883 58.9325 29.7151 178.0415 710 T 4.1993 7.6127 106.3650 62.0670 69.1614 174.5241 711 E 4.7297 7.9497 121.6841 56.6696 31.0625 175.4429 712 F 6.0925 7.6023 115.3707 54.1127 41.0406 174.1857 713 K 4.4461 8.8250 123.0730 55.1820 34.0338 176.5047 714 K 4.4891 8.7815 124.5922 57.2387 32.4307 176.4548 715 I 4.7583 8.1811 118.6364 62.2469 42.2381 176.2446 716 K 4.3948 7.8607 117.5464 55.9017 34.6283 174.9793 717 V 3.5841 8.6555 122.2061 63.5474 31.8062 175.4195 718 L 4.7569 8.8634 122.1348 53.2337 44.3097 176.7938 719 S 5.1264 7.0611 117.3457 58.0518 64.8628 175.8022 720 S 5.0121 8.0097 122.1424 56.7532 66.1039 174.1965 721 G 3.6284 7.8427 107.5416 45.6780 0.0000 172.6028 722 A 3.7829 8.6327 120.5045 55.4183 18.6957 179.1211 723 F 4.2493 8.0787 108.8312 59.0952 38.9502 174.6082 724 G 3.9403 5.3800 109.9890 44.8867 0.0000 171.4251 725 T 5.0271 8.4009 118.0153 60.1602 71.2210 173.7944 726 V 5.0791 8.8134 126.1479 61.4024 34.8041 173.7212 727 Y 5.1240 9.0869 125.2933 55.9692 40.7964 175.1830 728 K 4.4317 9.0007 124.7632 56.8331 33.9213 175.8556 729 G 4.3561 8.6743 111.8792 45.8313 0.0000 171.5284 730 L 5.3849 8.9248 119.2715 52.5206 45.4992 175.8153 731 W 5.3323 9.0334 133.4733 55.8996 32.3618 175.2940 732 I 5.1500 8.8770 128.9245 56.8773 35.7340 173.6039 733 P 4.1134 0.0000 0.0000 64.0051 33.0427 180.2180 734 E 3.6639 7.9380 114.6200 56.5264 33.2794 177.4734 735 G 3.9614 8.5188 111.5534 44.7793 0.0000 174.2787 736 E 3.7886 7.2653 119.8549 57.6471 29.6566 177.0686 737 K 3.8161 7.6672 117.7078 57.5463 30.9580 175.5280 738 V 4.7186 7.3073 108.0040 59.1238 36.4159 174.9870 739 K 4.6534 8.7748 122.0505 54.6291 35.7347 175.2792 740 I 4.9529 8.2847 124.6888 57.6016 40.4377 173.2755 741 P 4.9016 0.0000 0.0000 62.9522 32.2772 176.1333 742 V 5.0274 8.9934 116.9261 59.4659 36.3967 174.1756 743 A 5.2734 8.9231 124.4039 50.3415 21.7293 175.5937 744 I 4.6310 8.7899 123.5860 59.5467 39.5347 174.5363 745 K 4.9777 9.2124 129.6933 54.7849 34.5537 174.8213 746 E 4.8084 9.0839 127.4386 54.2355 32.3065 174.5667 747 L 4.8443 8.7509 127.5347 55.3929 40.4369 178.0390 748 R 3.2456 8.1675 121.8841 57.1543 30.1202 175.4218 749 E 4.0104 8.7186 114.2230 59.3490 30.3008 175.5776 750 A 3.9333 8.0263 124.7629 52.6229 17.9729 177.0136 751 T 4.5252 8.3914 118.5800 64.3458 68.6064 175.4638 752 S 4.0929 7.7878 116.9396 58.5733 63.2674 173.4844 753 P 4.4135 0.0000 0.0000 64.2242 30.5684 178.1982 754 K 4.0218 7.6969 120.4458 59.5827 31.7334 178.3145 755 A 4.1198 8.3857 121.0876 54.4497 18.3447 178.9858 756 N 4.5034 8.0546 114.5861 55.5108 39.0073 177.3193 757 K 3.9759 7.6490 120.4423 59.3971 32.2420 178.8273 758 E 3.9572 7.9370 118.4992 59.4356 29.5889 179.1383 759 I 3.7826 7.4845 117.3684 63.8699 37.9142 177.8900 760 L 4.1150 7.8575 119.7108 57.4941 41.3919 178.9958 761 D 4.3893 8.0209 119.0822 57.2872 40.7157 178.5872 762 E 3.9845 8.2611 118.8952 59.4031 29.4364 179.2691 763 A 3.9346 7.9344 120.5706 55.1084 18.1936 178.6914 764 Y 3.9427 7.9513 117.2567 61.0199 39.0796 178.6219 765 V 3.5097 7.9054 118.6476 66.3683 31.5212 177.9890 766 M 3.6387 8.1847 116.8412 57.9579 31.7854 178.1852 767 A 4.0797 8.0189 119.8952 53.7419 18.6189 178.0564 768 S 4.4585 7.3312 112.1590 57.9824 63.1725 174.2557 769 V 4.5133 7.2837 113.4280 59.5357 34.2287 175.0414 770 D 4.4118 9.5028 123.5045 53.0451 42.6446 173.8183 771 N 4.4590 7.8619 123.0020 51.4533 41.6456 173.6328 772 P 4.2230 0.0000 0.0000 65.2146 31.6695 176.9051 773 H 4.9328 8.7898 114.7771 55.0956 29.0462 173.3357 774 V 4.8986 7.3826 119.1926 60.7293 34.0690 175.0018 775 C 4.1532 9.0175 128.4707 59.9619 32.3361 172.8438 776 R 4.2009 8.3720 126.6688 55.6056 30.8664 174.7319 777 L 4.4624 8.3858 129.2690 54.7122 42.2607 176.1744 778 L 4.1921 9.5146 127.5924 54.9265 42.8468 177.1155 779 G 3.9792 6.6648 104.2262 46.1185 0.0000 170.9878 780 I 5.0363 8.0186 113.0801 58.9985 41.3108 174.0827 781 C 5.0466 9.1279 123.4065 57.1780 34.2480 174.1750 782 L 4.7220 8.4127 127.2760 55.0427 41.9149 176.8660 783 T 4.2431 7.7412 108.2180 60.9275 70.0297 174.3577 784 S 4.1500 8.7762 117.8228 61.8021 62.7319 175.2971 785 T 4.2218 7.6815 114.7065 60.6951 67.3176 173.7724 786 V 4.1295 8.3483 129.8923 62.7183 32.4692 174.8691 787 Q 4.9496 8.8217 127.2169 54.0689 31.4719 174.4134 788 L 4.5195 9.1133 126.6491 54.3278 43.8045 175.1822 789 I 4.7436 8.5438 127.6197 59.8034 39.4982 174.8213 790 T 4.8972 8.4769 116.9240 59.0991 72.5606 172.9890 791 Q 4.3671 8.4278 123.7181 55.6508 29.6346 175.5454 792 L 3.9643 8.4518 129.1293 55.8464 42.8560 177.1463 793 M 4.5579 8.5601 126.3965 52.5512 31.6721 174.2843 794 P 4.1286 0.0000 0.0000 65.5352 31.7715 177.8424 795 F 4.2930 7.9996 113.6447 57.6878 39.3638 177.2650 796 G 3.8344 8.3125 110.5158 45.3648 0.0000 172.3069 797 C 4.5691 8.3279 118.4613 59.0131 33.6829 175.3178 798 L 3.8240 8.6679 128.9817 57.7832 41.7791 179.1720 799 L 4.0026 7.7089 120.3648 58.4472 42.0831 178.8714 800 D 4.4917 8.1141 117.9844 57.1989 40.5493 177.9354 801 Y 4.0896 7.6702 119.3751 60.4633 39.0607 177.7860 802 V 4.0707 8.1462 113.5650 64.4049 31.5428 178.4942 803 R 4.0010 7.7262 116.3576 59.4738 30.1447 178.2802 804 E 4.1774 8.1780 115.7232 57.8064 29.5355 176.5041 805 H 4.8165 7.8133 112.5897 56.1375 31.5120 175.6016 806 K 4.1064 7.8813 120.1426 59.9083 31.9583 177.8994 807 D 4.4372 7.8646 114.3035 55.8195 40.4556 176.7174 808 N 4.8627 8.6322 113.9625 52.5423 41.2871 174.1304 809 I 4.0805 7.3250 120.4236 59.9403 37.9445 176.5270 810 G 4.0427 8.1320 112.6816 43.2776 0.0000 173.6509 811 S 4.1600 8.4364 114.5318 61.6620 62.6176 176.5988 812 Q 3.8820 8.1417 122.3280 59.1866 28.6558 178.0056 813 Y 3.0399 7.8923 116.9176 60.6995 37.9977 178.0045 814 L 3.7664 7.2310 119.2268 58.0189 41.7805 179.8526 815 L 4.0894 8.0050 118.7261 57.7402 41.4479 179.3120 816 N 4.3003 7.9360 116.6021 55.9309 38.2988 177.5336 817 W 4.3973 8.0814 120.7895 60.0119 29.0375 178.1449 818 C 3.8734 8.0067 116.6554 62.8099 27.3536 176.5271 819 V 3.6043 7.7776 119.4951 66.1643 31.1925 178.0423 820 Q 3.7233 8.3342 118.0725 59.1223 28.5739 179.0764 821 I 3.7744 8.2106 120.7851 64.2241 37.1134 178.4293 822 A 3.9414 7.8804 121.7548 54.8926 18.1964 179.7696 823 K 4.0118 8.4066 117.5023 59.5366 32.0524 179.6364 824 G 3.7164 8.1659 105.9035 48.2269 0.0000 175.6725 825 M 3.7178 7.8584 121.1849 57.7916 31.7897 178.1359 826 N 4.1846 8.2233 117.5397 57.0182 38.9926 176.2499 827 Y 3.9654 7.9441 120.7300 60.5758 38.9763 177.3880 828 L 3.8494 8.2540 120.2042 57.7150 41.6715 179.3291 829 E 3.5901 8.1533 119.2170 59.3467 29.4321 178.2169 830 D 4.3836 7.6995 117.5703 57.6233 40.9304 178.6174 831 R 4.1454 7.2239 115.1349 54.9660 30.9100 176.6619 832 R 3.9062 8.1845 117.4041 57.5327 28.3249 175.6010 833 L 4.9991 8.4204 117.8116 53.0814 44.6238 175.2488 834 V 4.4986 8.2694 125.4067 61.2520 32.7688 175.7237 835 H 3.9964 10.0707 128.7672 58.2592 29.8246 176.8589 836 R 4.1166 8.2859 113.1644 57.1713 28.8980 175.8624 837 D 4.7350 7.8785 117.3077 52.8370 41.4403 175.0841 838 L 3.9750 8.1739 120.2685 54.6453 43.1350 175.1670 839 A 4.5711 7.8881 125.8846 51.4064 21.6323 176.7183 840 A 4.1439 8.9759 123.1036 54.7225 18.6503 180.6627 841 R 3.9604 7.9057 111.6929 58.7040 29.9277 176.9513 842 N 4.7177 8.0056 115.5736 52.7604 38.8415 173.8123 843 V 4.7346 7.4888 118.2318 61.0926 34.6800 174.4462 844 L 5.1059 8.9946 126.9526 52.9183 45.7095 175.3857 845 V 4.2606 8.3935 120.0674 61.4262 32.9723 176.2164 846 K 4.0534 8.9955 130.4554 58.8666 32.5086 176.7983 847 T 4.5653 7.3557 106.8070 58.7096 71.8044 172.7493 848 P 3.6998 0.0000 0.0000 64.9991 31.3964 177.3144 849 Q 4.2695 7.7322 114.3850 56.1713 28.9795 175.3284 850 H 4.8706 9.1043 121.0583 55.8971 32.1664 172.4249 851 V 4.8541 9.1728 119.5294 59.6873 34.2600 175.8910 852 K 4.8929 8.8299 121.4256 54.6713 36.6214 176.0302 853 I 4.0741 8.8334 125.9326 62.0383 38.0291 175.2348 854 T 4.5092 8.3013 124.1175 63.6436 72.2180 173.9818 855 D 4.0405 8.8008 113.0790 56.8386 38.7831 173.5563 856 F 4.3895 8.1766 119.8438 56.5580 39.3502 178.0818 857 G 3.7846 7.5903 110.9837 47.9941 0.0000 174.5619 858 L 4.5629 7.5243 115.7111 53.7778 43.3831 176.3960 859 A 4.4772 7.9686 121.4633 52.0033 19.3515 177.4248 860 K 4.3873 8.6466 119.3031 54.3279 35.9508 175.6717 861 L 4.5439 8.5519 124.9939 53.8179 42.2049 176.7053 862 L 3.9941 8.3484 125.2237 54.8625 41.8391 178.3320 863 G 3.6914 8.8457 113.4742 45.0854 0.0000 170.9191 864 A 3.8337 8.9477 122.3007 53.2109 17.5829 179.7280 865 E 3.6475 7.2216 121.8808 58.6715 25.8014 177.1314 866 E 4.5893 7.7264 124.7102 55.8284 29.2678 177.6106 867 K 4.7497 7.2022 121.4369 55.7208 33.2929 176.2201 868 E 4.9282 7.9696 114.5779 54.7360 33.2165 174.4345 869 Y 4.6021 8.9692 123.5519 56.6878 40.5358 173.9488 870 H 4.8579 8.2981 124.2792 54.9251 29.5034 174.9534 871 A 4.3223 8.1261 125.3209 50.4539 20.9511 177.1793 872 E 4.2087 8.4328 118.4308 55.6749 31.3283 176.2295 873 G 3.8512 8.1854 108.7302 44.6387 0.0000 173.0572 874 G 4.1173 8.8396 105.8050 43.9896 0.0000 174.0430 875 K 3.9640 8.4614 119.9442 56.6793 32.5034 176.9701 876 V 4.3857 8.0366 122.4231 60.4169 34.8932 172.3330 877 P 4.5304 0.0000 0.0000 62.6535 31.4195 177.0454 878 I 3.9288 8.5587 125.7470 64.0898 37.3230 178.2852 879 K 4.0661 8.3548 117.0152 57.4949 32.0535 177.2580 880 W 4.6876 8.1444 116.4891 56.4636 29.8896 175.0679 881 M 4.4492 7.7317 118.2940 53.1557 33.2222 176.4875 882 A 2.0000 7.8827 124.3102 51.6972 20.3657 178.6372 883 L 3.5040 6.9614 121.7922 58.0179 42.1849 179.1274 884 E 3.8550 7.7904 117.4341 58.6617 29.2345 179.4420 885 S 4.2085 7.3205 116.5841 60.8707 62.9565 176.3924 886 I 3.6186 7.0030 120.3787 63.7683 36.7596 177.9483 887 L 4.3447 7.6576 118.7912 56.6337 42.1839 177.7776 888 H 4.7645 7.8344 112.7651 54.1669 30.0986 174.2394 889 R 4.0872 8.0721 119.3911 56.9457 28.6465 175.7079 890 I 4.5089 6.8789 117.2142 61.1997 38.9062 175.1789 891 Y 4.9462 8.8545 122.7439 56.6321 41.8206 174.5147 892 T 5.0061 9.2593 118.1567 59.8537 71.5961 174.4598 893 H 4.4222 8.8915 120.2811 59.2388 28.1857 177.8713 894 Q 4.0973 8.4171 119.5080 59.0544 28.4710 178.9759 895 S 4.4987 8.0931 114.1452 60.5633 63.2761 176.2820 896 D 4.6233 8.1776 122.8809 57.2527 40.6484 178.1843 897 V 3.3883 7.9951 118.9334 65.8285 31.5403 177.4546 898 W 4.8150 7.9312 128.3737 60.4570 30.4501 178.1811 899 S 4.8201 8.2861 113.7143 61.3131 62.2134 176.0045 900 Y 4.3447 8.7771 123.4194 60.6752 38.5553 178.0349 901 G 3.6746 8.6205 107.1061 48.2704 0.0000 175.7593 902 V 4.0330 8.2381 120.7242 65.5958 31.4114 178.2727 903 T 4.2986 8.4810 116.1995 66.6473 68.3598 176.5425 904 V 3.4306 7.9058 120.4598 65.8115 31.4812 177.5400 905 W 4.2851 8.3060 127.9595 60.8126 30.4536 177.6061 906 E 4.0650 8.9967 118.6606 59.4313 28.8860 179.2507 907 L 3.9562 8.1592 118.9766 58.3580 41.5832 179.7362 908 M 3.7612 8.2989 117.2594 57.6553 31.8208 177.8651 909 T 4.1789 7.1732 108.0318 60.7034 69.0978 174.6996 910 F 3.7338 8.2543 118.1849 59.2510 37.0373 175.5250 911 G 4.2549 8.1020 108.0802 46.3128 0.0000 174.8658 912 S 4.6393 7.5687 114.7609 57.0337 64.6405 173.9803 913 K 4.6814 8.3580 120.5244 54.1640 33.1824 174.5547 914 P 3.5879 0.0000 0.0000 63.5288 31.1024 175.6926 915 Y 3.3686 7.7667 121.7829 58.4097 34.7716 169.0498 916 D 4.5146 7.6860 118.9771 56.1395 42.5199 173.7912 917 G 4.0601 9.9622 119.1359 44.3325 0.0000 174.0460 918 I 3.4627 5.4200 123.0314 59.5585 36.6951 174.0325 919 P 4.4519 0.0000 0.0000 61.7796 32.1693 177.5961 920 A 4.0294 8.6424 123.6861 55.1433 18.5196 180.3646 921 S 4.1648 7.9809 109.8323 61.3563 63.6044 176.1716 922 E 4.0503 8.4547 120.9698 58.9884 29.1087 179.0836 923 I 3.3530 7.1493 119.7151 64.5950 37.1115 178.2729 924 S 4.0412 7.9080 114.2505 61.1103 62.7745 176.3489 925 S 4.1403 8.7067 117.2523 61.2562 62.1048 175.8759 926 I 3.6272 7.6803 121.9797 64.5631 37.0120 177.2900 927 L 4.4838 7.8154 117.6965 55.7900 41.5504 178.2743 928 E 4.2040 7.4455 117.6970 58.4290 30.0117 177.6310 929 K 3.9708 8.3517 118.2344 58.0883 32.2029 177.7765 930 G 4.0018 7.5158 104.6968 44.6909 0.0000 173.3400 931 E 4.0783 7.4848 120.6919 56.2979 30.1482 175.9370 932 R 4.5697 8.0249 122.7564 54.4294 34.2133 174.5486 933 L 3.9061 7.3920 117.8691 53.6077 42.2304 175.4419 934 P 4.5174 0.0000 0.0000 62.1898 32.0655 175.9864 935 Q 2.9502 8.0176 121.1033 55.2862 29.1593 174.6301 936 P 4.3180 0.0000 0.0000 61.7393 32.1713 175.3895 937 P 4.1679 0.0000 0.0000 65.9474 31.4725 177.5150 938 I 4.2584 7.6576 108.0892 61.1251 38.0512 174.5418 939 C 4.8822 7.9008 120.6975 58.1709 29.2237 173.9196 940 T 4.0980 8.1894 115.2938 61.1876 69.3015 175.0270 941 I 3.7742 8.5569 122.5322 64.6393 37.4629 177.7626 942 D 4.3657 8.1394 118.4106 57.4069 41.1191 178.5813 943 V 3.6013 7.5022 117.4726 66.2625 31.6529 177.5394 944 Y 4.1652 8.2370 119.1596 60.6188 38.5752 177.3481 945 M 3.8729 8.1697 119.4751 58.3325 32.0339 178.3101 946 I 3.5295 7.1102 118.9762 64.4601 37.5143 177.6518 947 M 3.3214 7.7258 118.8991 58.1988 31.5788 178.4350 948 V 3.1988 6.7650 117.6184 66.2337 31.5968 178.2677 949 K 3.7451 7.6144 117.6522 59.7468 31.7508 179.0004 950 C 4.1420 7.6809 116.4261 61.4306 27.5733 175.1036 951 W 3.4484 6.9528 118.9638 55.2321 29.2541 176.0061 952 M 4.4088 7.1168 119.0175 55.3499 32.1709 176.9315 953 I 4.0430 8.3675 121.4074 64.4431 37.1822 176.6887 954 D 4.4831 8.1045 122.0737 53.5358 39.7491 175.8975 955 A 4.2992 8.6522 129.7245 55.3924 18.5374 179.0648 956 D 4.6635 7.9822 111.8776 55.7162 41.2155 177.5434 957 S 4.3163 9.2119 116.2480 60.7670 63.2261 175.1644 958 R 4.2544 7.3651 118.3486 55.2919 30.3821 174.6086 959 P 4.5586 0.0000 0.0000 62.0516 32.3389 176.6413 960 K 4.1453 8.7125 120.5937 55.7975 33.0540 178.3423 961 F 3.9912 8.6320 122.1823 61.0714 38.6316 178.4592 962 R 4.0457 8.1350 114.7203 59.1795 29.0411 178.5618 963 E 4.0202 8.6973 119.8171 58.9605 29.5476 178.9016 964 L 4.0715 7.8184 118.6574 57.7058 41.6773 179.1662 965 I 3.7854 7.8197 119.8107 64.6347 37.0932 178.3507 966 I 3.6807 7.3767 120.0567 64.5521 37.0403 178.2153 967 E 3.7941 8.3243 119.4470 59.6976 29.2219 179.6568 968 F 4.0561 8.3820 117.4235 60.0143 38.7276 177.9089 969 S 4.1012 8.0427 112.5939 61.2255 62.5150 176.0345 970 K 4.0935 8.1118 121.1834 59.8323 31.8195 179.2309 971 M 3.5793 7.6958 118.5727 58.1208 31.5635 178.3715 972 A 4.2263 8.0116 119.3793 54.1406 18.6011 179.1951 973 R 4.2131 7.8396 116.0766 57.4126 31.9116 176.3918 974 D 4.8376 7.9996 117.2066 51.3881 41.3319 173.6108 975 P 4.5416 0.0000 0.0000 65.3833 32.0290 178.7729 976 Q 4.2994 7.9025 115.1344 57.6344 29.0416 177.0843 977 R 3.7921 7.5627 117.1212 58.2628 30.2212 176.3041 978 Y 4.8202 7.9746 113.5371 57.5468 41.2184 175.5127 979 L 5.0942 8.0178 117.8338 52.7921 45.4104 176.3336 980 V 4.2677 9.1656 124.3316 61.3128 33.4105 174.3728 981 I 4.5517 8.0013 128.6797 58.8589 39.9206 175.0483 982 Q 4.0212 8.8200 125.9473 58.1136 29.0346 175.9860 983 G 3.8769 8.6029 113.6799 45.6986 0.0000 173.7751 984 D 3.9974 7.5532 115.9106 53.8407 39.6010 174.3412 *1007 M 4.3909 8.0579 126.8218 55.5072 33.1357 174.6311 1008 D 4.4370 8.8493 118.0669 58.2828 41.7928 177.8971 1009 D 4.9222 7.7961 117.2979 54.1786 42.1100 176.4544 1010 V 4.2332 7.8391 118.9362 63.1845 32.0197 175.3621 1011 V 4.5354 8.6928 126.7502 60.8745 35.1616 174.4584 1012 D 4.4400 8.8048 126.1874 53.7643 42.1320 176.5034 1013 A 4.2214 8.8728 127.4802 55.7556 18.3853 179.6275 1014 D 4.4364 8.7564 114.3128 56.4691 40.9228 176.9216 1015 E 4.4191 8.0821 117.0331 56.0765 29.9911 175.4736 1016 Y 4.5246 7.9614 121.4264 55.8228 38.3840 174.4999 1017 L 4.5995 7.5669 125.5402 52.9321 44.4951 176.8263 1018 I 3.9056 7.7107 119.1859 61.5575 37.8477 174.4245 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 697 E 8.44 4.26 0.00 1.98 1.86 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 2.22 2.27 0.00 698 A 8.45 3.93 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 0.00 699 P 0.00 4.30 0.00 2.20 2.07 0.00 3.76 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.95 0.00 700 N 8.57 4.53 0.00 2.72 2.85 0.00 0.00 7.08 7.08 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 0.00 701 Q 8.33 4.42 0.00 2.06 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.67 0.00 0.00 0.00 0.00 0.00 2.31 2.48 0.00 702 A 7.82 4.01 1.16 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 0.00 0.00 703 L 8.22 4.41 0.00 1.62 1.60 0.92 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 704 L 8.37 4.47 0.00 1.55 1.55 0.88 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 705 R 8.34 4.59 0.00 1.89 1.70 0.00 3.32 0.00 0.00 3.42 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.67 0.00 706 I 8.37 4.74 1.90 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 1.35 0.99 0.93 0.00 0.00 707 L 8.63 4.89 0.00 1.53 1.63 0.02 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 708 K 8.46 4.35 0.00 2.01 1.71 0.00 1.73 0.00 0.00 1.65 0.00 0.00 2.87 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.46 1.43 7.81 709 E 8.64 2.99 0.00 1.84 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 2.03 1.74 0.00 710 T 7.61 4.20 4.18 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 1.13 0.00 0.00 711 E 7.95 4.73 0.00 2.50 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 2.34 2.34 0.00 712 F 7.60 6.09 0.00 3.10 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 0.00 713 K 8.82 4.45 0.00 1.86 2.02 0.00 1.53 0.00 0.00 1.84 0.00 0.00 2.86 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.48 1.50 7.81 714 K 8.78 4.49 0.00 1.61 1.83 0.00 1.37 0.00 0.00 0.61 0.00 0.00 2.13 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.15 1.40 7.81 715 I 8.18 4.76 2.07 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 1.33 0.60 0.95 0.00 0.00 716 K 7.86 4.39 0.00 1.79 1.89 0.00 1.52 0.00 0.00 1.76 0.00 0.00 2.80 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.28 1.29 7.81 717 V 8.66 3.58 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 0.61 0.00 0.00 0.65 0.00 0.00 718 L 8.86 4.76 0.00 1.59 1.61 0.93 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 719 S 7.06 5.13 0.00 3.94 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 0.00 720 S 8.01 5.01 0.00 3.80 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 0.00 721 G 7.84 3.63 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 0.00 0.00 0.00 722 A 8.63 3.78 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 0.00 723 F 8.08 4.25 0.00 3.27 3.37 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 0.00 724 G 5.38 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 0.00 0.00 0.00 725 T 8.40 5.03 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 1.44 0.00 0.00 726 V 8.81 5.08 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 1.04 0.00 0.00 1.05 0.00 0.00 727 Y 9.09 5.12 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 0.00 728 K 9.00 4.43 0.00 1.87 1.72 0.00 1.67 0.00 0.00 1.67 0.00 0.00 2.86 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.47 1.42 7.81 729 G 8.67 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 0.00 0.00 0.00 0.00 730 L 8.92 5.38 0.00 1.63 1.58 0.94 0.82 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 0.00 731 W 9.03 5.33 0.00 3.32 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 0.00 732 I 8.88 5.15 1.82 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 0.85 1.16 0.86 0.00 0.00 733 P 0.00 4.11 0.00 2.13 1.30 0.00 2.92 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.44 0.00 734 E 7.94 3.66 0.00 2.18 1.48 0.00 0.00 0.00 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 2.40 0.00 735 G 8.52 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 0.00 0.00 0.00 736 E 7.27 3.79 0.00 1.95 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 2.39 2.28 0.00 737 K 7.67 3.82 0.00 1.96 1.88 0.00 1.72 0.00 0.00 1.68 0.00 0.00 3.02 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.30 1.36 7.81 738 V 7.31 4.72 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 0.84 0.00 0.00 0.42 0.00 0.00 739 K 8.77 4.65 0.00 1.63 1.63 0.00 1.58 0.00 0.00 1.62 0.00 0.00 2.82 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.26 1.32 7.81 740 I 8.28 4.95 1.98 0.00 0.00 -0.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 1.47 1.04 0.00 0.00 741 P 0.00 4.90 0.00 2.09 2.00 0.00 3.60 0.00 0.00 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.13 0.00 742 V 8.99 5.03 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.84 0.00 0.00 0.90 0.00 0.00 743 A 8.92 5.27 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 0.00 744 I 8.79 4.63 1.95 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 0.67 0.65 0.89 0.00 0.00 745 K 9.21 4.98 0.00 1.82 1.68 0.00 1.56 0.00 0.00 1.59 0.00 0.00 2.89 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.45 1.50 7.81 746 E 9.08 4.81 0.00 2.22 1.92 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 2.42 2.31 0.00 747 L 8.75 4.84 0.00 1.62 1.69 1.02 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 748 R 8.17 3.25 0.00 1.85 1.89 0.00 3.12 0.00 0.00 3.23 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.69 0.00 749 E 8.72 4.01 0.00 2.07 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 0.00 2.25 2.36 0.00 750 A 8.03 3.93 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 0.00 751 T 8.39 4.53 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 1.22 0.00 0.00 752 S 7.79 4.09 0.00 3.96 4.04 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 0.00 753 P 0.00 4.41 0.00 2.28 2.34 0.00 3.69 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.02 0.00 754 K 7.70 4.02 0.00 1.95 1.84 0.00 1.52 0.00 0.00 1.66 0.00 0.00 3.04 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.44 1.50 7.81 755 A 8.39 4.12 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 0.00 756 N 8.05 4.50 0.00 2.75 2.87 0.00 0.00 6.80 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 0.00 757 K 7.65 3.98 0.00 1.93 1.99 0.00 1.61 0.00 0.00 1.64 0.00 0.00 2.91 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.43 1.47 7.81 758 E 7.94 3.96 0.00 2.08 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 2.33 2.31 0.00 759 I 7.48 3.78 1.90 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 1.53 1.37 1.02 0.00 0.00 760 L 7.86 4.11 0.00 1.95 1.71 0.93 1.39 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 0.00 761 D 8.02 4.39 0.00 2.92 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 0.00 762 E 8.26 3.98 0.00 2.22 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.37 2.51 0.00 763 A 7.93 3.93 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 0.00 764 Y 7.95 3.94 0.00 3.03 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 0.00 765 V 7.91 3.51 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 0.77 0.00 0.00 1.09 0.00 0.00 766 M 8.18 3.64 0.00 1.83 2.07 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.28 0.00 767 A 8.02 4.08 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 0.00 768 S 7.33 4.46 0.00 3.67 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 0.00 769 V 7.28 4.51 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 0.59 0.00 0.00 0.71 0.00 0.00 770 D 9.50 4.41 0.00 2.48 2.49 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 0.00 771 N 7.86 4.46 0.00 1.44 2.01 0.00 0.00 7.11 7.71 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 0.00 772 P 0.00 4.22 0.00 1.72 1.95 0.00 3.50 0.00 0.00 3.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 2.00 0.00 773 H 8.79 4.93 0.00 3.24 3.35 0.00 5.55 0.00 0.00 0.00 0.00 6.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 774 V 7.38 4.90 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 0.87 0.00 0.00 1.10 0.00 0.00 775 C 9.02 4.15 0.00 3.20 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 0.00 776 R 8.37 4.20 0.00 1.98 1.86 0.00 3.18 0.00 0.00 3.13 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.55 0.00 777 L 8.39 4.46 0.00 1.58 1.46 0.93 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 778 L 9.51 4.19 0.00 1.33 1.35 0.94 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 779 G 6.66 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 0.00 780 I 8.02 5.04 1.84 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 1.08 1.07 0.86 0.00 0.00 781 C 9.13 5.05 0.00 3.08 2.90 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 0.00 782 L 8.41 4.72 0.00 1.69 1.67 0.93 0.94 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 0.00 783 T 7.74 4.24 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 1.28 0.00 0.00 784 S 8.78 4.15 0.00 3.88 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 0.00 785 T 7.68 4.22 4.26 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 1.28 0.00 0.00 786 V 8.35 4.13 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 0.84 0.00 0.00 0.98 0.00 0.00 787 Q 8.82 4.95 0.00 2.06 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.71 0.00 0.00 0.00 0.00 0.00 2.32 2.49 0.00 788 L 9.11 4.52 0.00 1.71 1.51 0.90 0.83 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 0.00 789 I 8.54 4.74 1.50 0.00 0.00 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.26 0.26 0.45 0.00 0.00 790 T 8.48 4.90 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 1.17 0.00 0.00 791 Q 8.43 4.37 0.00 2.13 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.91 6.84 0.00 0.00 0.00 0.00 0.00 2.37 2.32 0.00 792 L 8.45 3.96 0.00 1.78 1.58 0.92 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.00 0.00 0.00 0.00 0.00 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0.00 826 N 8.22 4.18 0.00 2.90 2.98 0.00 0.00 6.90 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 827 Y 7.94 3.97 0.00 3.18 3.17 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 0.00 828 L 8.25 3.85 0.00 1.83 1.90 1.17 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 0.00 0.00 0.00 0.00 0.00 0.00 829 E 8.15 3.59 0.00 2.07 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 2.06 1.69 0.00 830 D 7.70 4.38 0.00 2.61 2.59 0.00 0.00 0.00 0.00 0.00 0.00 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 R 7.22 4.15 0.00 1.40 1.74 0.00 3.34 0.00 0.00 3.15 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 1.19 0.00 832 R 8.18 3.91 0.00 1.95 1.99 0.00 3.09 0.00 0.00 3.10 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.52 0.00 833 L 8.42 5.00 0.00 1.49 1.68 0.93 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 834 V 8.27 4.50 2.06 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 1.02 0.00 0.00 0.90 0.00 0.00 835 H 10.07 4.00 0.00 3.19 3.54 0.00 5.79 0.00 0.00 0.00 0.00 6.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 836 R 8.29 4.12 0.00 1.88 1.85 0.00 2.77 0.00 0.00 2.93 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.64 0.00 837 D 7.88 4.73 0.00 2.47 2.49 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 0.00 838 L 8.17 3.98 0.00 1.63 1.74 0.89 1.33 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 0.00 839 A 7.89 4.57 0.55 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 0.00 840 A 8.98 4.14 1.47 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 0.00 0.00 841 R 7.91 3.96 0.00 1.85 2.01 0.00 2.81 0.00 0.00 3.07 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 1.47 0.00 842 N 8.01 4.72 0.00 2.77 2.68 0.00 0.00 6.25 7.03 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 0.00 843 V 7.49 4.73 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 0.98 0.00 0.00 0.93 0.00 0.00 844 L 8.99 5.11 0.00 1.52 1.49 0.88 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 0.00 0.00 0.00 0.00 845 V 8.39 4.26 2.06 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 0.55 0.00 0.00 0.42 0.00 0.00 846 K 9.00 4.05 0.00 1.69 1.88 0.00 1.63 0.00 0.00 1.64 0.00 0.00 3.05 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.48 1.38 7.81 847 T 7.36 4.57 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 1.29 0.00 0.00 848 P 0.00 3.70 0.00 2.34 2.33 0.00 3.40 0.00 0.00 2.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 1.70 0.00 849 Q 7.73 4.27 0.00 2.02 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.77 0.00 0.00 0.00 0.00 0.00 2.32 2.41 0.00 850 H 9.10 4.87 0.00 3.16 3.16 0.00 5.57 0.00 0.00 0.00 0.00 6.52 0.00 0.00 0.00 0.00 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0.00 958 R 7.37 4.25 0.00 1.84 1.84 0.00 3.39 0.00 0.00 3.60 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 1.76 0.00 959 P 0.00 4.56 0.00 1.91 1.88 0.00 3.54 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 1.99 0.00 960 K 8.71 4.15 0.00 1.78 1.71 0.00 1.72 0.00 0.00 1.61 0.00 0.00 2.87 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.43 1.54 7.81 961 F 8.63 3.99 0.00 3.04 3.02 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 0.00 962 R 8.13 4.05 0.00 2.05 2.38 0.00 2.97 0.00 0.00 3.34 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.73 0.00 963 E 8.70 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 2.29 2.32 0.00 964 L 7.82 4.07 0.00 1.78 1.83 0.33 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 965 I 7.82 3.79 2.05 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 1.56 0.83 0.94 0.00 0.00 966 I 7.38 3.68 2.00 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 1.52 0.61 0.88 0.00 0.00 967 E 8.32 3.79 0.00 1.74 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 2.38 2.35 0.00 968 F 8.38 4.06 0.00 3.23 3.06 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 0.00 969 S 8.04 4.10 0.00 4.20 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 0.00 970 K 8.11 4.09 0.00 1.86 1.76 0.00 1.64 0.00 0.00 1.60 0.00 0.00 2.91 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.43 1.43 7.81 971 M 7.70 3.58 0.00 1.70 1.91 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.81 0.00 972 A 8.01 4.23 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 0.00 973 R 7.84 4.21 0.00 2.05 2.03 0.00 3.12 0.00 0.00 3.16 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.81 0.00 974 D 8.00 4.84 0.00 2.69 2.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 975 P 0.00 4.54 0.00 2.25 2.13 0.00 3.67 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 2.27 0.00 976 Q 7.90 4.30 0.00 2.01 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 7.10 0.00 0.00 0.00 0.00 0.00 2.36 2.34 0.00 977 R 7.56 3.79 0.00 1.64 1.02 0.00 3.02 0.00 0.00 2.88 7.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 1.29 0.00 978 Y 7.97 4.82 0.00 3.07 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 0.00 979 L 8.02 5.09 0.00 1.53 1.57 0.95 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 980 V 9.17 4.27 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 0.97 0.00 0.00 0.92 0.00 0.00 981 I 8.00 4.55 1.93 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 1.49 0.70 0.97 0.00 0.00 982 Q 8.82 4.02 0.00 1.96 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.69 0.00 0.00 0.00 0.00 0.00 2.31 2.43 0.00 983 G 8.60 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 0.00 984 D 7.55 4.00 0.00 2.96 2.79 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 *1007 M 8.06 4.39 0.00 2.07 2.06 0.00 0.00 0.00 0.00 0.00 -0.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.48 0.00 1008 D 8.85 4.44 0.00 2.63 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 1009 D 7.80 4.92 0.00 2.67 2.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1010 V 7.84 4.23 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 0.78 0.00 0.00 0.99 0.00 0.00 1011 V 8.69 4.54 2.06 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 0.97 0.00 0.00 0.99 0.00 0.00 1012 D 8.80 4.44 0.00 2.83 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 1013 A 8.87 4.22 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 1014 D 8.76 4.44 0.00 2.76 2.75 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 1015 E 8.08 4.42 0.00 2.13 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 2.29 2.28 0.00 1016 Y 7.96 4.52 0.00 2.94 3.02 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 1017 L 7.57 4.60 0.00 1.53 1.44 0.88 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 1018 I 7.71 3.91 1.64 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 1.26 0.57 0.91 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.