NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 697 E 4.2248 8.4401 121.4716 55.5091 30.8378 175.1343 698 A 4.0201 8.2122 124.8401 50.7317 18.9632 175.2323 699 P 4.2534 0.0000 0.0000 62.4143 32.7553 174.8212 700 N 4.5527 8.6369 122.4007 53.0573 37.7780 173.6205 701 Q 4.4172 8.3391 122.9952 55.2791 29.1152 176.2030 702 A 4.0148 7.7848 120.7808 52.6366 18.7863 177.7384 703 L 4.3780 8.1852 120.6149 53.4813 42.9869 176.0952 704 L 4.4473 8.2877 124.6672 53.3725 43.2535 175.2571 705 R 4.4795 8.3744 126.7069 55.3836 31.8771 174.5828 706 I 4.8077 8.3734 126.8027 59.8120 38.7987 174.7520 707 L 4.9865 8.8919 127.8540 52.6552 43.5558 176.9922 708 K 4.0696 8.5781 122.6428 56.2132 32.7044 177.6544 709 E 3.2135 8.9455 124.6802 59.3136 29.5343 178.8311 710 T 3.8717 7.5513 106.8229 63.7396 69.1045 174.6848 711 E 4.3051 8.4272 122.0798 57.3139 29.8237 176.0069 712 F 5.5954 7.2163 114.8044 55.1739 40.9496 174.2526 713 K 4.2019 8.9890 125.9123 56.2930 33.1124 176.2809 714 K 4.8059 8.6615 126.5335 56.3159 33.0588 176.4756 715 I 4.7255 8.2902 118.7687 61.5807 41.5071 175.3277 716 K 4.3833 7.9362 119.9683 55.6519 35.3282 173.8229 717 V 4.0695 8.4812 124.8853 62.3113 32.2164 174.6939 718 L 4.4763 9.1721 127.3405 55.9344 43.4893 176.3546 719 G 4.1876 7.9372 103.6326 43.8520 0.0000 171.4504 720 S 5.4163 8.6227 119.1322 58.1253 64.3234 173.2779 721 G 3.6671 7.4169 119.9378 44.2790 0.0000 174.6649 722 A 4.0177 7.9573 129.3212 54.6469 19.0544 177.4110 723 F 4.7974 7.9470 120.4491 58.4711 47.4171 173.4887 724 G 4.5528 7.7420 106.7390 44.7023 0.0000 169.9641 725 T 4.7104 8.2880 115.2425 61.6164 71.4309 173.8095 726 V 4.8055 7.8435 124.2446 61.3025 34.4288 173.8101 727 Y 5.1294 9.0264 124.7368 55.6776 41.5222 175.1945 728 K 4.3683 8.7460 124.6006 57.0141 33.8059 175.8153 729 G 4.4952 8.2587 111.5952 46.0463 0.0000 171.6693 730 L 5.4074 8.9283 119.4399 52.4682 45.8044 176.1341 731 W 5.1989 9.0132 132.2565 56.0625 33.2042 174.4782 732 I 4.1047 8.3979 129.8761 57.9466 36.7813 174.3418 733 P 3.8459 0.0000 0.0000 62.6463 33.0264 178.5457 734 E 2.9807 7.9652 112.0741 57.0080 30.3551 179.4580 735 G 4.1895 8.8943 110.7845 45.1361 0.0000 172.7923 736 E 4.3734 7.6587 117.4728 55.1395 32.0357 177.1867 737 K 3.7870 8.0292 117.8636 57.5255 30.3864 174.7667 738 V 4.7114 6.9159 106.2438 58.9602 35.8021 175.0825 739 K 4.7683 8.6418 121.5087 54.6497 36.1118 175.3443 740 I 4.9798 8.0873 124.3396 57.6796 40.3641 173.3093 741 P 4.7974 0.0000 0.0000 63.2612 32.1702 176.0905 742 V 5.0859 9.0719 116.9415 59.4869 36.6864 174.1731 743 A 5.0912 9.0649 123.9723 50.4720 21.3293 175.5922 744 I 4.5356 8.5960 124.1337 59.6714 39.6292 174.9282 745 K 5.3677 9.2614 128.4521 53.6714 34.3115 174.8515 746 E 5.2522 8.6973 125.2644 54.1100 32.6310 174.2822 747 L 4.6501 8.1175 122.3485 54.2339 43.5744 177.1143 748 R 3.5560 8.8989 125.8972 56.6388 28.2581 177.8377 749 E 2.7558 8.2696 119.3424 55.1163 30.9538 177.9024 750 A 3.7844 8.1967 120.6176 52.8907 19.7191 177.8612 751 T 4.5672 8.3870 120.0141 61.5571 70.6828 174.1893 752 S 4.6954 7.9217 119.5181 56.0695 65.6525 173.5766 753 P 4.0919 0.0000 0.0000 65.2541 31.0918 177.9940 754 K 3.8533 8.1335 116.7487 59.4716 32.1244 178.1906 755 A 4.2408 8.7835 121.8522 55.1636 18.6286 179.0652 756 N 4.2153 8.1887 114.2325 56.5679 38.7278 177.0483 757 K 3.8232 7.7593 120.8282 59.6199 32.0694 178.0608 758 E 4.2091 8.4158 118.2921 58.6933 30.0339 178.4035 759 I 3.9133 7.7844 118.0908 64.0196 37.9529 177.6791 760 L 4.1466 8.0171 119.9135 57.3779 41.5469 179.0534 761 D 4.3354 7.6602 118.2701 57.2612 40.7185 178.0474 762 E 3.9555 8.7631 119.9723 59.6173 29.6334 178.9111 763 A 3.9540 8.0864 120.4569 55.0673 18.1431 178.8445 764 Y 3.8788 8.0641 117.8540 60.8745 39.0515 178.5059 765 V 3.6268 7.7441 118.9261 66.2883 31.8860 177.7615 766 M 3.5737 8.1226 117.8398 58.2476 31.7948 177.7079 767 A 4.1186 7.6506 119.5380 53.7887 18.6933 178.5633 768 S 4.3968 7.5880 112.0985 57.3520 63.6637 174.1631 769 V 4.5452 6.6886 114.3755 59.6209 33.8789 175.6184 770 D 4.4914 9.2221 123.3780 52.4012 41.8055 173.5038 771 N 4.6491 7.6142 121.7519 50.3966 42.1392 173.4315 772 P 4.3616 0.0000 0.0000 64.8526 31.6253 176.5948 773 H 5.0391 8.3774 115.3226 55.1247 30.5035 173.1420 774 V 4.9178 7.5406 117.4696 60.8712 34.3346 175.2134 775 C 4.2508 8.9584 125.2733 59.8862 29.0044 173.5954 776 R 3.9862 8.6064 123.9304 56.0809 30.6079 174.8473 777 L 4.3794 8.3299 129.8560 54.8566 42.0993 176.3115 778 L 4.1901 9.0795 127.6615 55.3385 42.6461 177.3112 779 G 4.0644 6.7564 106.0532 46.1979 0.0000 171.2268 780 I 5.0622 7.9791 113.2617 58.9489 41.2321 174.0444 781 C 5.0952 9.0379 123.6067 57.2278 33.9103 174.6093 782 L 4.5567 8.2631 129.9164 53.5841 40.0998 175.5833 783 T 4.4995 7.4291 109.5697 60.6169 71.4189 177.0376 784 S 3.9831 7.7231 118.4017 61.2305 63.0800 174.8302 785 T 4.3626 7.5212 115.5069 59.6547 68.0685 173.6637 786 V 3.8974 8.3578 129.8816 63.4702 32.7673 174.3317 787 Q 4.9040 9.0358 127.5882 54.2274 31.1173 174.4435 788 L 4.5004 8.8898 127.1390 54.4121 43.7175 175.1871 789 I 4.7134 8.5195 128.1037 59.7870 39.2920 174.9364 790 T 4.9520 8.4544 116.7452 58.9970 72.7802 172.9899 791 Q 4.1941 8.2403 123.1590 56.0493 29.5090 175.5910 792 L 3.8954 8.3356 128.8796 55.9968 42.7601 177.1181 793 M 4.3959 8.6342 127.4675 53.0704 31.0146 174.8168 794 P 4.1366 0.0000 0.0000 65.5868 31.7585 177.9106 795 F 4.4158 8.1137 113.3490 57.3546 38.7963 177.3590 796 G 3.9222 8.3128 112.6771 45.3024 0.0000 173.3699 797 C 4.7272 8.1872 113.4231 57.5127 32.1446 174.1090 798 L 3.7672 8.7092 123.8920 57.9524 41.5022 178.8708 799 L 3.9834 7.6302 120.5507 58.4932 42.0061 178.8568 800 D 4.3903 8.0812 118.0707 57.5666 40.6473 177.7897 801 Y 4.1616 7.9596 118.8622 60.8927 39.0068 178.5859 802 V 4.0078 8.4295 113.5991 64.4863 31.5366 178.4033 803 R 4.0183 7.5728 116.3538 59.5499 30.1614 178.1387 804 E 4.2299 8.0259 114.7236 57.3590 29.9680 176.3482 805 H 4.8497 8.1549 112.6189 55.7544 31.7139 175.4718 806 K 4.1320 8.0938 119.6365 60.2106 32.4880 176.7992 807 D 4.6225 7.8345 116.2731 54.3793 40.4943 176.4979 808 N 4.8952 8.7019 113.3415 53.1728 41.5548 174.0002 809 I 4.1717 7.8893 120.3534 59.9217 38.3513 175.4597 810 G 4.1075 7.8560 114.0093 43.2254 0.0000 173.9305 811 S 4.0417 8.4665 114.8188 61.6444 62.5258 176.7417 812 Q 3.9389 8.0337 122.2904 59.2393 28.8080 177.9129 813 Y 3.4069 8.0271 117.6026 60.7816 37.8653 177.8644 814 L 3.6975 7.4470 119.2123 58.1166 41.7548 179.7112 815 L 4.0300 8.1290 118.6249 57.8117 41.5983 179.0714 816 N 4.2239 8.0087 116.4365 56.2907 38.3791 177.3221 817 W 4.4022 8.2465 120.1495 60.1054 29.1772 177.9909 818 C 3.8897 8.1485 116.6659 62.9697 27.4120 176.6028 819 V 3.6225 8.2700 119.5324 66.2627 31.1942 178.0891 820 Q 3.7402 8.5386 118.1102 58.7854 28.5227 178.7887 821 I 3.6896 8.7613 121.7933 64.3567 37.2273 177.9187 822 A 3.8145 8.3079 121.6324 55.4370 18.1681 179.8010 823 K 3.9862 8.3574 116.9535 59.4664 32.0645 179.4903 824 G 3.8479 8.0712 105.9681 48.3916 0.0000 175.5966 825 M 3.7111 7.5474 121.0884 57.7740 31.8148 178.0759 826 N 4.2875 8.2819 117.4990 57.2415 39.0633 175.9601 827 Y 3.9639 8.1682 120.5847 60.6542 38.9390 177.7114 828 L 3.8601 8.4822 119.8997 58.0690 41.8325 179.4912 829 E 3.6388 8.5689 119.4483 59.2707 29.3610 178.5510 830 D 4.3547 7.8410 117.9272 56.9713 40.8025 177.9211 831 R 4.1725 7.1479 116.0953 54.6978 31.1380 176.8141 832 R 3.9024 7.6744 116.4688 57.3892 28.1084 176.4953 833 L 4.7796 8.3270 117.1483 53.1885 45.2817 175.2993 834 V 4.4589 9.0085 126.8612 61.3665 32.0669 175.6967 835 H 3.9943 9.7981 128.8985 58.5561 29.8087 176.8703 836 R 4.2400 8.7498 113.9053 56.9676 28.3036 176.5584 837 D 4.6636 7.8890 117.2585 52.5469 41.5129 175.1306 838 L 3.8529 8.2531 119.7965 54.7267 43.0209 175.4275 839 A 4.7224 8.4799 124.6467 51.9160 21.7565 176.4824 840 A 4.1245 9.3717 124.5575 55.4609 18.5424 180.8031 841 R 3.9520 7.9446 110.7508 58.6878 29.8547 176.6178 842 N 4.9154 8.4514 116.4425 53.0204 39.9602 174.5844 843 V 4.6536 7.6513 118.2663 61.1427 34.7866 174.0663 844 L 4.8445 8.8235 127.5860 53.0750 44.8342 175.8282 845 V 4.2284 8.3970 122.5633 61.3427 32.0570 176.6623 846 K 4.1124 8.6702 129.2165 59.3375 33.2537 177.1835 847 T 4.5118 7.2862 107.2961 58.7946 71.7452 172.5598 848 P 4.0057 0.0000 0.0000 65.2075 31.3233 177.5820 849 Q 3.8749 7.4886 113.9331 56.6606 29.2293 175.0535 850 H 4.8921 8.7292 119.4636 54.9726 32.3080 172.3392 851 V 4.8046 8.9326 119.0367 59.7482 34.1178 175.8734 852 K 4.8576 8.6578 120.8892 54.7241 36.7654 176.1163 853 I 4.0966 9.2765 126.0553 61.9508 38.3965 175.2970 854 T 4.7799 8.0176 119.7765 61.5947 70.9416 170.2327 855 D 4.1597 8.8330 124.5594 54.5141 38.4582 172.8898 856 F 4.6794 8.1865 122.2439 56.8498 39.5227 177.7193 857 G 3.8476 8.0842 107.9005 47.2784 0.0000 174.2741 858 L 4.7105 7.5144 116.1912 53.4813 44.6955 176.7644 859 A 4.3622 8.0755 120.5357 52.9670 19.0073 176.7470 860 K 4.4115 9.1494 119.6915 54.8081 36.9281 174.9870 861 L 4.9489 8.0344 120.7591 54.5999 42.4373 175.9391 *866 E 4.1032 8.6483 125.8447 57.7853 30.4853 177.2124 867 K 4.4766 8.4378 125.3218 54.9869 34.2402 174.6908 868 E 4.9281 7.6860 112.7468 55.8145 32.1767 174.8796 869 Y 4.4746 9.0349 126.9149 57.5062 40.1222 174.3868 870 H 4.6890 7.9067 123.7812 53.4388 28.4032 173.5477 871 A 3.6076 7.8596 124.4255 53.4634 19.5246 177.2905 872 E 4.2130 9.1522 119.6537 56.4557 30.3495 178.4624 873 G 4.0234 8.8238 113.7557 47.3890 0.0000 175.7972 874 G 4.0800 8.8758 109.9009 45.0666 0.0000 172.3919 875 K 4.2008 8.2852 119.1271 55.7309 32.6278 177.0753 876 V 4.4124 8.1039 123.1512 60.1627 34.5489 173.8071 877 P 4.6417 0.0000 0.0000 61.8901 30.4090 176.8388 878 I 3.7194 8.4817 126.8175 64.8861 37.2305 178.6444 879 K 4.1763 8.3911 115.6100 57.5544 32.0075 177.2235 880 W 4.6835 8.5912 117.9915 56.4978 30.6627 175.0778 881 M 4.4863 8.0474 118.6432 53.3719 33.0503 176.3757 882 A 2.0000 7.7911 123.8262 51.4867 20.3507 178.7529 883 L 3.5333 6.9007 121.2912 58.1191 42.2596 178.4948 884 E 3.7533 7.8763 117.9963 59.6941 29.1683 179.5712 885 S 3.9364 7.3784 115.7133 60.9963 62.6767 176.6516 886 I 3.6718 7.1003 120.9202 63.3847 36.8531 177.4779 887 L 4.6063 7.7425 117.7282 55.0491 41.7853 176.6946 888 H 4.7909 8.0157 112.7941 54.1617 30.6478 173.5645 889 R 4.1376 7.6925 118.0932 57.0617 28.3561 175.4355 890 I 4.5329 6.8964 117.5814 60.8521 38.9979 175.0440 891 Y 4.8241 8.9158 123.6432 56.6320 41.4615 174.7545 892 T 5.1318 8.2389 114.8420 59.6801 72.2820 174.7915 893 H 4.5009 8.8004 117.1523 59.1470 28.4154 177.7592 894 Q 4.1615 8.3657 119.8209 58.1328 28.4505 178.2075 895 S 4.3739 8.0061 114.8392 60.6814 63.2546 176.2632 896 D 4.6055 8.1430 122.8187 57.2499 40.7761 178.1179 897 V 3.3042 7.8927 118.9262 65.9352 31.5170 177.6387 898 W 4.6640 8.0072 129.0460 60.3557 30.4472 178.1193 899 S 4.9135 8.4569 115.7585 60.8427 62.2780 175.7477 900 Y 4.4051 8.9066 123.4180 60.9155 38.4631 178.2331 901 G 3.7067 8.4110 106.4131 48.1386 0.0000 175.5716 902 V 3.8967 8.2676 120.3639 66.0193 31.4238 178.0827 903 T 4.2987 8.4894 115.9110 66.8226 68.2566 176.6899 904 V 3.4356 8.2110 120.3431 65.7249 31.6326 177.7925 905 W 4.1705 8.7318 128.4511 60.5169 30.4203 177.6567 906 E 4.2080 9.1082 118.9415 59.5587 28.9862 179.4029 907 L 3.9582 8.0024 118.8277 58.1917 41.5262 179.6129 908 M 3.8604 8.1659 117.7963 57.3593 31.7659 177.7715 909 T 4.2770 6.8690 107.8794 60.6166 69.5677 174.3349 910 F 3.6925 8.4055 117.2302 59.2332 37.1820 175.8347 911 G 4.1147 8.2101 106.7201 46.0543 0.0000 174.9011 912 S 4.4815 7.5695 115.2654 57.8502 64.0416 173.8444 913 K 4.6807 8.4872 120.4854 53.8849 33.0643 174.5302 914 P 3.5506 0.0000 0.0000 63.8341 31.6308 175.7448 915 Y 3.4819 7.6244 119.0443 58.4341 35.5250 169.8855 916 D 4.4370 7.6449 118.1256 55.9644 42.0152 174.5337 917 G 4.4246 9.1976 119.8456 46.1368 0.0000 174.1648 918 I 3.7801 7.0656 120.5082 60.2971 37.7585 174.3890 919 P 4.4885 0.0000 0.0000 61.7220 32.2563 177.1277 920 A 3.9097 8.6958 125.3775 55.6959 18.6811 179.8051 921 S 4.1484 8.2706 110.3827 62.1239 63.1612 176.5485 922 E 4.0688 8.4233 119.4995 58.9552 28.9698 179.2118 923 I 3.3557 7.2244 120.4215 64.5478 36.9350 177.8387 924 S 3.9613 7.9852 112.8476 61.7698 62.5973 176.2302 925 S 4.1721 8.3199 116.6502 61.0456 62.3098 175.7178 926 I 3.6512 7.7093 122.0361 64.7581 36.7098 178.0199 927 L 4.5185 7.8194 118.5213 56.1309 40.6785 178.4306 928 E 4.2154 7.6055 118.5573 58.5354 29.6460 177.8948 929 K 4.0435 8.0978 118.2400 58.9142 32.2059 177.4433 930 G 4.0607 7.2521 100.8792 45.0835 0.0000 173.6457 931 E 4.1583 8.1960 121.8558 56.0433 30.4825 175.8345 932 R 4.9585 8.1316 123.9593 54.6418 33.5878 174.7803 933 L 4.0331 7.3777 117.8330 53.4149 42.5660 174.6937 934 P 4.5778 0.0000 0.0000 62.4093 32.0833 175.5261 935 Q 3.4689 8.1178 120.0456 54.1757 29.1597 173.6703 936 P 4.1156 0.0000 0.0000 62.5307 32.0224 175.1959 937 P 4.1486 0.0000 0.0000 65.8578 31.3754 177.5223 938 I 4.1171 7.6935 108.4228 61.4949 37.8442 174.6593 939 C 4.7388 7.9063 120.9974 58.2293 28.7975 173.8513 940 T 4.0289 8.0610 115.3716 61.4624 69.2143 174.8272 941 I 3.7841 8.7614 123.1498 64.8910 37.5933 177.5507 942 D 4.5245 8.1625 117.5141 57.6210 40.9062 179.2176 943 V 3.5499 7.7807 117.6087 66.2845 31.7482 177.1310 944 Y 4.1595 8.0566 119.2809 61.0529 38.5689 177.7497 945 M 3.8049 8.9164 119.7650 58.6386 32.2901 178.3873 946 I 3.5530 7.7565 120.2179 64.3644 37.0381 177.9878 947 M 3.4186 7.7108 118.0340 58.3667 31.9143 178.5879 948 V 3.1739 6.9889 117.9635 65.4847 31.3917 178.0058 949 K 3.7244 7.2965 117.3332 59.8682 31.7822 178.7035 950 C 4.0957 7.3798 115.9518 61.3603 27.9242 174.6500 951 W 3.2430 7.3920 120.7428 55.1809 30.1179 175.8731 952 M 4.5811 7.3502 117.2043 54.2434 33.2812 177.1522 953 I 3.8911 8.5156 123.0927 64.6322 37.6107 176.5128 954 D 4.4139 8.0526 123.3670 53.8094 40.2078 175.8748 955 A 4.1708 8.6764 131.0126 55.3290 18.5100 178.9193 956 D 4.5903 8.1586 113.3913 56.3565 41.0666 177.3710 957 S 4.3530 8.1450 115.1741 60.0478 63.2903 174.9570 958 R 4.3246 7.3849 118.6194 54.9367 30.5074 174.5577 959 P 4.5596 0.0000 0.0000 62.0751 32.3656 176.6467 960 K 4.1458 8.9781 120.6639 55.7582 33.0289 178.4274 961 F 4.1903 8.6458 121.4861 60.9624 38.5539 178.2370 962 R 4.1941 8.0436 114.6393 58.7447 29.3942 178.5477 963 E 4.0279 8.5840 120.2432 59.0096 29.5688 178.7003 964 L 4.0977 7.8525 118.5473 57.9725 41.6400 179.1015 965 I 3.7627 8.2262 119.9631 64.7237 37.0195 177.9971 966 I 3.6847 7.5040 119.9544 64.7998 37.0706 178.1320 967 E 3.8040 8.6571 119.0039 59.7175 29.3548 179.7346 968 F 4.0270 8.3977 117.6888 60.4738 38.6788 177.7764 969 S 4.2188 8.2852 112.4537 61.0232 62.3656 176.0616 970 K 4.0488 8.2512 121.5467 59.8785 31.8771 178.8931 971 M 3.4712 7.6734 118.4357 58.4114 31.6559 178.2759 972 A 4.2859 8.1801 118.5438 53.5988 18.6687 178.6480 973 R 4.3548 7.9591 115.7185 56.3453 32.1873 176.2503 974 D 4.8213 8.2128 118.4213 51.7950 41.7466 173.6895 975 P 4.4724 0.0000 0.0000 65.6174 32.0153 178.5045 976 Q 4.5093 7.8209 114.0894 56.3521 29.3880 176.6635 977 R 3.7819 7.8231 118.4577 58.4880 30.0246 176.3887 978 Y 4.7791 7.5195 113.2851 57.1865 40.2509 175.5142 979 L 5.0062 8.0216 118.7999 52.9573 44.8112 176.3738 980 V 4.1755 8.8736 125.5286 61.4558 32.9493 174.8090 981 I 4.7628 8.0029 128.7589 58.8858 40.0909 174.8052 982 Q 3.9746 8.7590 126.6727 58.5484 29.1167 176.3813 983 G 3.9385 9.4659 114.1324 45.1581 0.0000 173.9165 984 D 4.1632 7.5604 118.1746 57.6347 41.7061 178.3521 985 E 3.9191 8.2417 120.9307 59.5389 29.5264 178.4735 986 R 4.6866 7.7270 117.0942 56.0730 30.1915 179.2482 987 M 4.7895 7.7266 120.2128 55.1656 35.1711 175.6891 *988 H 4.8703 8.4146 117.9472 52.9753 32.5086 169.5020 989 L 4.9054 7.8453 116.4184 54.4202 46.3656 175.7316 *1002 M 4.3893 8.9166 120.3244 55.5633 33.0883 176.9225 1003 D 4.9365 8.8121 112.2731 51.2954 40.0863 175.8298 1004 E 4.6725 7.6897 122.1803 55.9069 34.0894 177.6416 1005 E 3.9283 8.8831 118.9049 58.4463 29.9740 175.3438 1006 D 4.8502 7.3821 115.2927 55.3523 40.8853 176.1440 1007 M 4.4744 7.6647 118.3094 55.9216 32.4625 177.5366 1008 D 4.4090 8.3275 120.3076 57.2545 41.8694 176.2411 1009 D 4.8736 7.8455 116.3156 53.9101 42.1834 176.4779 1010 V 4.2399 7.7188 119.2229 63.3871 32.4070 175.6275 1011 V 4.4686 8.6810 126.6053 61.0662 35.1509 173.9617 1012 D 4.5084 9.0328 127.2130 53.9792 42.0641 176.5137 1013 A 4.1877 8.9117 128.6254 55.8517 18.4431 179.3831 1014 D 4.4419 8.4577 113.6752 56.3949 40.9014 176.9402 1015 E 4.5708 8.6157 117.6060 56.1635 30.0072 176.1393 1016 Y 4.5889 7.8587 122.4126 55.8417 37.7653 174.7142 1017 L 4.3443 7.5453 123.2620 53.1462 43.3615 176.3331 1018 I 4.5337 7.5355 113.1738 58.1600 40.7061 173.5430 1019 P 4.3665 0.0000 0.0000 63.0673 31.0928 176.3916 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 4.22 0.00 1.95 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 2.20 2.32 0.00 698 A 8.21 4.02 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 0.00 699 P 0.00 4.25 0.00 2.05 2.01 0.00 3.67 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 2.03 2.07 0.00 700 N 8.64 4.55 0.00 2.69 2.79 0.00 0.00 7.12 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 8.34 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 2.30 2.45 0.00 702 A 7.78 4.01 1.15 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 0.00 0.00 703 L 8.19 4.38 0.00 1.63 1.59 0.92 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 704 L 8.29 4.45 0.00 1.54 1.55 0.88 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 705 R 8.37 4.48 0.00 1.94 1.77 0.00 3.42 0.00 0.00 3.55 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.73 0.00 706 I 8.37 4.81 1.90 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 1.36 1.02 0.94 0.00 0.00 707 L 8.89 4.99 0.00 1.64 1.98 -0.10 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 708 K 8.58 4.07 0.00 1.91 1.73 0.00 1.71 0.00 0.00 1.59 0.00 0.00 2.88 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.48 1.43 7.81 709 E 8.95 3.21 0.00 1.85 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 2.15 1.92 0.00 710 T 7.55 3.87 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 8.43 4.31 0.00 2.59 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 2.42 2.35 0.00 712 F 7.22 5.60 0.00 3.15 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 0.00 713 K 8.99 4.20 0.00 1.91 1.80 0.00 1.72 0.00 0.00 1.84 0.00 0.00 2.84 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.54 1.50 7.81 714 K 8.66 4.81 0.00 1.62 1.66 0.00 1.23 0.00 0.00 0.61 0.00 0.00 2.77 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.39 1.42 7.81 715 I 8.29 4.73 1.92 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 1.15 0.57 0.94 0.00 0.00 716 K 7.94 4.38 0.00 1.81 1.61 0.00 1.71 0.00 0.00 1.74 0.00 0.00 2.79 0.00 0.00 2.75 0.00 0.00 0.00 0.00 1.32 1.35 7.81 717 V 8.48 4.07 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.67 0.00 0.00 0.76 0.00 0.00 718 L 9.17 4.48 0.00 1.54 1.62 0.91 0.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 719 G 7.94 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 0.00 720 S 8.62 5.42 0.00 3.79 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 0.00 721 G 7.42 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 0.00 722 A 7.96 4.02 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 0.00 723 F 7.95 4.80 0.00 2.95 2.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 724 G 7.74 4.55 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 0.00 725 T 8.29 4.71 4.34 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 0.91 0.00 0.00 726 V 7.84 4.81 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 0.96 0.00 0.00 0.92 0.00 0.00 727 Y 9.03 5.13 0.00 2.91 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 8.75 4.37 0.00 1.89 1.72 0.00 1.66 0.00 0.00 1.66 0.00 0.00 2.87 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.47 1.41 7.81 729 G 8.26 4.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 730 L 8.93 5.41 0.00 1.61 1.58 0.94 0.83 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 0.00 731 W 9.01 5.20 0.00 3.27 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 8.40 4.10 1.78 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 1.17 0.92 0.84 0.00 0.00 733 P 0.00 3.85 0.00 1.66 1.36 0.00 3.16 0.00 0.00 2.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.83 0.44 0.00 734 E 7.97 2.98 0.00 1.99 1.66 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 2.32 2.51 0.00 735 G 8.89 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 0.00 736 E 7.66 4.37 0.00 1.85 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 2.31 2.24 0.00 737 K 8.03 3.79 0.00 1.83 1.82 0.00 1.69 0.00 0.00 1.68 0.00 0.00 3.20 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.42 1.41 7.81 738 V 6.92 4.71 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 0.85 0.00 0.00 0.46 0.00 0.00 739 K 8.64 4.77 0.00 1.63 1.61 0.00 1.58 0.00 0.00 1.63 0.00 0.00 2.82 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.27 1.32 7.81 740 I 8.09 4.98 2.04 0.00 0.00 0.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 1.08 1.06 0.00 0.00 741 P 0.00 4.80 0.00 2.09 2.01 0.00 3.63 0.00 0.00 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.14 0.00 742 V 9.07 5.09 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 1.04 0.00 0.00 0.91 0.00 0.00 743 A 9.06 5.09 1.19 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 0.00 744 I 8.60 4.54 1.92 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 0.57 0.40 0.84 0.00 0.00 745 K 9.26 5.37 0.00 1.82 1.67 0.00 1.70 0.00 0.00 1.82 0.00 0.00 2.98 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.36 1.24 7.81 746 E 8.70 5.25 0.00 2.11 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.45 2.19 0.00 747 L 8.12 4.65 0.00 1.66 1.52 0.49 0.65 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 0.00 748 R 8.90 3.56 0.00 1.97 1.74 0.00 3.44 0.00 0.00 3.19 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.76 0.00 749 E 8.27 2.76 0.00 2.04 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 2.31 2.31 0.00 750 A 8.20 3.78 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 751 T 8.39 4.57 4.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 752 S 7.92 4.70 0.00 3.93 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 0.00 753 P 0.00 4.09 0.00 2.19 2.12 0.00 3.60 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.19 0.00 754 K 8.13 3.85 0.00 1.74 1.88 0.00 1.71 0.00 0.00 1.75 0.00 0.00 3.23 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.47 1.67 7.81 755 A 8.78 4.24 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 756 N 8.19 4.22 0.00 2.75 2.91 0.00 0.00 6.57 6.98 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 0.00 757 K 7.76 3.82 0.00 1.83 2.06 0.00 1.50 0.00 0.00 1.65 0.00 0.00 3.05 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.47 1.59 7.81 758 E 8.42 4.21 0.00 2.34 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 2.29 2.34 0.00 759 I 7.78 3.91 1.96 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 1.67 1.41 1.03 0.00 0.00 760 L 8.02 4.15 0.00 1.88 1.72 0.94 1.07 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 0.00 761 D 7.66 4.34 0.00 2.98 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 0.00 762 E 8.76 3.96 0.00 2.22 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 0.00 2.43 2.40 0.00 763 A 8.09 3.95 1.43 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 0.00 0.00 0.00 764 Y 8.06 3.88 0.00 3.02 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 0.00 765 V 7.74 3.63 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.58 0.00 0.00 1.07 0.00 0.00 766 M 8.12 3.57 0.00 2.03 2.14 0.00 0.00 0.00 0.00 0.00 2.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.51 0.00 767 A 7.65 4.12 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 0.00 768 S 7.59 4.40 0.00 3.67 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 0.00 769 V 6.69 4.55 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.57 0.00 0.00 0.73 0.00 0.00 770 D 9.22 4.49 0.00 2.45 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 0.00 771 N 7.61 4.65 0.00 1.44 1.91 0.00 0.00 7.09 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 4.36 0.00 1.80 1.99 0.00 3.52 0.00 0.00 3.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 2.02 0.00 773 H 8.38 5.04 0.00 3.04 3.22 0.00 5.56 0.00 0.00 0.00 0.00 6.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 774 V 7.54 4.92 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 1.01 0.00 0.00 0.93 0.00 0.00 775 C 8.96 4.25 0.00 3.04 2.91 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 0.00 776 R 8.61 3.99 0.00 1.91 1.82 0.00 3.21 0.00 0.00 3.24 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.69 0.00 777 L 8.33 4.38 0.00 1.62 1.60 0.90 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 778 L 9.08 4.19 0.00 1.35 1.24 0.89 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 779 G 6.76 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 0.00 0.00 0.00 780 I 7.98 5.06 1.86 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 1.09 0.93 0.88 0.00 0.00 781 C 9.04 5.10 0.00 3.18 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 0.00 782 L 8.26 4.56 0.00 1.68 1.63 0.93 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 783 T 7.43 4.50 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 1.29 0.00 0.00 784 S 7.72 3.98 0.00 3.89 3.92 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 0.00 785 T 7.52 4.36 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 1.31 0.00 0.00 786 V 8.36 3.90 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 0.93 0.00 0.00 0.94 0.00 0.00 787 Q 9.04 4.90 0.00 2.03 2.00 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 2.53 2.40 0.00 788 L 8.89 4.50 0.00 1.82 1.57 0.93 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 789 I 8.52 4.71 1.50 0.00 0.00 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.21 -0.20 0.33 0.00 0.00 790 T 8.45 4.95 4.30 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 1.17 0.00 0.00 791 Q 8.24 4.19 0.00 2.10 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.90 6.91 0.00 0.00 0.00 0.00 0.00 2.37 2.33 0.00 792 L 8.34 3.90 0.00 1.79 1.59 0.91 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.00 0.00 0.00 0.00 0.00 0.00 793 M 8.63 4.40 0.00 2.21 1.99 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.65 0.00 794 P 0.00 4.14 0.00 1.65 1.95 0.00 3.89 0.00 0.00 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.10 0.00 795 F 8.11 4.42 0.00 3.02 3.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 796 G 8.31 3.92 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 0.00 0.00 0.00 797 C 8.19 4.73 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 0.00 798 L 8.71 3.77 0.00 1.54 1.75 -0.14 0.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 799 L 7.63 3.98 0.00 1.75 1.69 1.04 1.33 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 0.00 800 D 8.08 4.39 0.00 2.96 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 0.00 801 Y 7.96 4.16 0.00 3.08 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 0.00 802 V 8.43 4.01 2.30 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 1.02 0.00 0.00 1.13 0.00 0.00 803 R 7.57 4.02 0.00 1.93 2.06 0.00 3.22 0.00 0.00 3.21 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 1.92 0.00 804 E 8.03 4.23 0.00 1.94 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 2.09 2.26 0.00 805 H 8.15 4.85 0.00 3.12 3.04 0.00 5.90 0.00 0.00 0.00 0.00 6.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 806 K 8.09 4.13 0.00 1.17 1.75 0.00 1.46 0.00 0.00 1.49 0.00 0.00 2.72 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.55 1.39 7.81 807 D 7.83 4.62 0.00 2.62 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 0.00 808 N 8.70 4.90 0.00 2.59 2.73 0.00 0.00 6.84 7.33 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 0.00 809 I 7.89 4.17 2.24 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.86 1.12 0.00 0.00 810 G 7.86 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 0.00 811 S 8.47 4.04 0.00 4.18 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 0.00 812 Q 8.03 3.94 0.00 2.20 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.96 0.00 0.00 0.00 0.00 0.00 2.50 2.56 0.00 813 Y 8.03 3.41 0.00 2.63 1.50 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 0.00 814 L 7.45 3.70 0.00 1.71 1.68 0.80 0.73 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 0.00 815 L 8.13 4.03 0.00 1.70 1.84 1.03 0.93 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 0.00 816 N 8.01 4.22 0.00 2.60 2.76 0.00 0.00 7.06 6.97 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 0.00 817 W 8.25 4.40 0.00 3.56 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 0.00 818 C 8.15 3.89 0.00 2.79 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 0.00 0.00 0.00 819 V 8.27 3.62 2.25 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 1.13 0.00 0.00 1.10 0.00 0.00 820 Q 8.54 3.74 0.00 2.21 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.57 0.00 0.00 0.00 0.00 0.00 2.26 2.59 0.00 821 I 8.76 3.69 2.03 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.98 1.12 0.00 0.00 822 A 8.31 3.81 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 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7.15 4.17 0.00 1.69 1.79 0.00 3.27 0.00 0.00 2.94 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.63 1.39 0.00 832 R 7.67 3.90 0.00 1.92 1.98 0.00 3.12 0.00 0.00 3.16 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.53 0.00 833 L 8.33 4.78 0.00 1.71 1.71 0.99 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 0.00 0.00 0.00 0.00 834 V 9.01 4.46 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 1.08 0.00 0.00 0.89 0.00 0.00 835 H 9.80 3.99 0.00 3.24 3.41 0.00 5.78 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 8.75 4.24 0.00 1.93 1.97 0.00 2.88 0.00 0.00 3.05 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.75 0.00 837 D 7.89 4.66 0.00 2.53 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 0.00 838 L 8.25 3.85 0.00 1.63 1.74 0.86 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 839 A 8.48 4.72 0.70 0.00 0.00 0.00 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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 4.01 0.00 2.22 2.37 0.00 3.39 0.00 0.00 2.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.65 0.00 849 Q 7.49 3.87 0.00 1.95 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.80 0.00 0.00 0.00 0.00 0.00 2.27 2.38 0.00 850 H 8.73 4.89 0.00 3.11 3.11 0.00 5.57 0.00 0.00 0.00 0.00 6.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 851 V 8.93 4.80 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 0.07 0.00 0.00 0.95 0.00 0.00 852 K 8.66 4.86 0.00 1.62 1.62 0.00 1.60 0.00 0.00 1.76 0.00 0.00 2.98 0.00 0.00 2.66 0.00 0.00 0.00 0.00 1.52 1.36 7.81 853 I 9.28 4.10 1.98 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.66 0.79 0.00 0.00 854 T 8.02 4.78 4.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 855 D 8.83 4.16 0.00 2.78 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 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0.00 4.58 0.00 2.29 2.16 0.00 3.67 0.00 0.00 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.16 0.00 935 Q 8.12 3.47 0.00 0.93 1.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.89 0.00 0.00 0.00 0.00 0.00 2.01 1.62 0.00 936 P 0.00 4.12 0.00 2.07 1.66 0.00 3.74 0.00 0.00 4.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.48 0.00 937 P 0.00 4.15 0.00 2.04 2.12 0.00 3.58 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.10 0.00 938 I 7.69 4.12 2.01 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.37 1.08 0.00 0.00 939 C 7.91 4.74 0.00 3.17 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 0.00 940 T 8.06 4.03 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 1.26 0.00 0.00 941 I 8.76 3.78 1.92 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.44 0.95 0.00 0.00 942 D 8.16 4.52 0.00 2.82 2.77 0.00 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0.00 0.00 1.86 1.72 0.00 959 P 0.00 4.56 0.00 1.93 1.89 0.00 3.54 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 1.99 0.00 960 K 8.98 4.15 0.00 1.94 1.70 0.00 1.53 0.00 0.00 1.62 0.00 0.00 2.96 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.44 1.42 7.81 961 F 8.65 4.19 0.00 3.03 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 0.00 962 R 8.04 4.19 0.00 2.06 2.46 0.00 2.97 0.00 0.00 3.34 7.64 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 8.58 4.03 0.00 2.17 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 7.85 4.10 0.00 1.82 1.84 0.45 1.00 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 0.00 965 I 8.23 3.76 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 1.55 0.89 0.94 0.00 0.00 966 I 7.50 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 1.53 0.85 0.89 0.00 0.00 967 E 8.66 3.80 0.00 1.73 1.69 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 2.41 2.36 0.00 968 F 8.40 4.03 0.00 3.21 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 0.00 969 S 8.29 4.22 0.00 3.89 4.20 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 0.00 970 K 8.25 4.05 0.00 1.82 1.75 0.00 1.65 0.00 0.00 1.61 0.00 0.00 2.91 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.43 1.62 7.81 971 M 7.67 3.47 0.00 1.78 2.02 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 0.81 0.00 972 A 8.18 4.29 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 0.00 973 R 7.96 4.35 0.00 1.94 2.02 0.00 3.15 0.00 0.00 3.17 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.83 0.00 974 D 8.21 4.82 0.00 2.73 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 0.00 975 P 0.00 4.47 0.00 2.23 2.21 0.00 3.67 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 2.29 0.00 976 Q 7.82 4.51 0.00 2.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 7.11 0.00 0.00 0.00 0.00 0.00 2.30 2.32 0.00 977 R 7.82 3.78 0.00 1.59 0.81 0.00 3.14 0.00 0.00 2.67 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 1.26 0.00 978 Y 7.52 4.78 0.00 3.10 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 0.00 979 L 8.02 5.01 0.00 1.53 1.57 0.95 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 980 V 8.87 4.18 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 0.94 0.00 0.00 0.91 0.00 0.00 981 I 8.00 4.76 1.90 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.09 0.95 0.00 0.00 982 Q 8.76 3.97 0.00 1.98 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.53 0.00 0.00 0.00 0.00 0.00 2.31 2.34 0.00 983 G 9.47 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 0.00 984 D 7.56 4.16 0.00 2.95 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 0.00 985 E 8.24 3.92 0.00 2.09 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 2.26 2.26 0.00 986 R 7.73 4.69 0.00 1.85 1.82 0.00 3.21 0.00 0.00 3.22 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.44 0.00 987 M 7.73 4.79 0.00 1.84 2.05 0.00 0.00 0.00 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.46 2.38 0.00 *988 H 8.41 4.87 0.00 2.86 2.77 0.00 7.14 0.00 0.00 0.00 0.00 6.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 989 L 7.85 4.91 0.00 1.68 1.81 1.12 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 *1002 M 8.92 4.39 0.00 1.98 1.83 0.00 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.41 2.50 0.00 1003 D 8.81 4.94 0.00 2.76 2.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1004 E 7.69 4.67 0.00 1.96 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 2.30 2.25 0.00 1005 E 8.88 3.93 0.00 1.98 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 2.23 1.90 0.00 1006 D 7.38 4.85 0.00 2.56 2.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1007 M 7.66 4.47 0.00 2.01 2.08 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.58 0.00 1008 D 8.33 4.41 0.00 2.63 2.68 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 0.00 0.00 0.00 0.00 1009 D 7.85 4.87 0.00 2.63 2.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1010 V 7.72 4.24 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 0.93 0.00 0.00 1011 V 8.68 4.47 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 0.94 0.00 0.00 1.00 0.00 0.00 1012 D 9.03 4.51 0.00 2.82 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 8.91 4.19 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1014 D 8.46 4.44 0.00 2.80 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 8.62 4.57 0.00 2.02 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 2.27 2.27 0.00 1016 Y 7.86 4.59 0.00 2.94 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 1017 L 7.55 4.34 0.00 1.54 1.46 0.89 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 1018 I 7.54 4.53 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 1.35 0.57 0.72 0.00 0.00 1019 P 0.00 4.37 0.00 2.04 1.99 0.00 3.67 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.05 0.00 * Residues marked with a * may have inaccurate shift predictions.