NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 718 M 4.4659 8.3049 120.3563 53.9673 33.5529 174.8416 719 P 4.0849 0.0000 0.0000 62.4508 31.9545 173.9778 720 E 3.9810 10.0490 124.8644 59.8843 30.2669 178.4453 721 E 4.0126 8.3920 117.8799 59.7123 29.3297 178.7318 722 E 4.1185 8.7405 116.8022 58.0396 29.8287 177.6079 723 Y 4.7020 8.1311 117.8191 56.9459 38.3047 177.0930 724 S 4.3392 7.9667 117.1986 61.9381 62.4268 176.3957 725 E 3.9568 8.3295 121.3994 58.6762 28.9648 178.7444 726 F 4.4863 8.1300 120.8301 60.9378 39.8968 177.0391 727 K 3.6416 8.8678 120.2348 59.2062 31.7416 177.3751 728 E 4.2566 8.2832 116.8263 56.7539 29.6526 176.8207 729 L 4.3477 7.8743 119.5934 57.4319 42.3193 178.2598 730 I 3.5948 7.0015 118.1384 63.7261 37.1223 176.9392 731 L 4.2267 7.5450 117.7981 55.0833 42.3169 176.6742 732 Q 3.9501 7.3907 120.3434 56.3929 29.3487 177.6314 733 K 3.9515 8.9291 124.4968 59.8170 32.0290 178.1618 734 E 3.9698 8.2098 117.2420 57.4217 29.8078 177.7998 735 L 4.2239 8.4453 117.9470 56.0655 40.1970 176.0908 736 H 4.5185 7.9033 118.4496 59.2680 28.5814 177.6034 737 V 3.6236 7.8700 119.2546 66.1464 31.3732 177.9716 738 V 3.5277 7.6858 117.3616 66.1497 31.0473 177.4167 739 Y 3.9235 7.2177 114.7472 60.8168 38.0258 177.9018 740 A 4.3461 8.1177 121.6618 55.4203 18.4525 179.4470 741 L 3.9182 8.3983 117.6137 58.3868 41.5051 180.0826 742 S 4.0726 7.9181 113.7735 61.8656 62.7347 176.1953 743 H 4.5222 7.8786 118.2751 58.6425 28.6241 177.7717 744 V 3.9110 7.5632 112.9477 64.5095 31.9843 176.4609 745 C 4.3813 8.3204 115.5685 60.3976 29.4431 172.0505 746 G 4.2451 8.0843 116.1103 46.8020 0.0000 174.0736 747 Q 4.4133 8.2334 118.2632 56.0946 30.1984 175.8094 748 D 4.7442 7.9172 116.0528 54.5899 41.2264 177.5285 749 R 4.0769 7.9446 119.7181 60.3178 30.0405 177.6033 750 T 3.8562 7.9013 114.2218 66.7283 68.1836 175.9313 751 L 3.9283 7.9287 121.2704 58.2670 42.1239 178.5687 752 L 3.9452 8.8395 121.0126 58.0383 41.9153 178.5122 753 A 3.9343 8.2057 120.8161 55.6777 17.9079 179.5592 754 S 4.1036 7.9551 113.0328 62.0291 62.7604 177.3331 755 I 3.8667 7.3979 121.4513 64.1583 37.0170 178.3768 756 L 4.1580 8.4232 120.2934 57.5371 41.3355 179.3497 757 L 3.9643 8.3531 120.7365 58.3490 41.8932 179.2068 758 R 3.8837 7.4886 116.0008 59.2389 30.3028 178.8757 759 I 3.7568 7.5984 119.2453 64.6169 37.0879 178.6180 760 F 3.9634 8.5736 118.5912 60.2612 38.5171 177.8918 761 L 3.5236 8.6632 118.4983 57.6569 41.3676 178.8251 762 H 4.3299 7.9255 118.0442 58.3231 30.1007 176.2955 763 E 4.5017 8.0467 116.6291 56.8210 30.5526 175.5461 764 K 3.9527 7.8811 113.9701 59.4777 29.8338 175.4026 765 L 4.7984 8.7070 115.1028 54.2293 43.3944 178.9060 766 E 3.7858 8.4975 121.1912 59.9439 29.1737 179.6637 767 S 4.0447 7.9085 114.2381 61.3258 63.0920 176.0924 768 L 3.9345 7.8501 122.5633 58.3782 41.7611 178.4162 769 L 3.4853 7.8697 120.1106 58.0581 41.9479 178.8848 770 L 3.8097 8.0327 118.9873 57.8136 41.7117 179.1156 771 C 4.2606 8.2925 116.6188 60.3414 38.3739 176.3642 772 T 3.9111 7.8085 117.1681 66.3735 68.0862 176.6631 773 L 4.2496 8.0998 122.3932 58.4796 42.1558 178.8145 774 N 4.7866 8.2993 116.4031 56.5590 38.4862 176.9433 775 D 4.4352 8.1197 119.0525 57.1474 41.2797 178.5854 776 R 3.8722 8.3389 120.4772 58.8423 29.9119 178.6735 777 E 3.9461 8.0847 116.8147 59.6164 29.7038 179.4067 778 I 3.8759 7.8481 119.9472 64.3307 36.8266 178.6443 779 S 4.0667 8.1607 114.7387 60.8465 62.6347 175.4418 780 M 4.3612 7.5475 120.3083 54.4814 32.3239 175.4461 781 E 4.3406 7.5354 121.6718 55.3013 30.3971 175.4637 782 D 4.7495 8.7878 125.2322 53.5182 41.1460 175.9096 783 E 4.6264 8.3923 121.3195 53.9756 31.5818 176.3824 784 A 3.5162 8.3863 129.5163 55.1310 18.6129 178.7816 785 T 4.1236 7.7149 102.3083 62.6603 68.8448 174.7239 786 T 4.4327 7.3282 110.4958 60.9780 69.8427 173.5378 787 L 3.9942 7.8614 125.3570 56.7288 42.2057 176.2840 788 F 4.0006 8.4333 123.1030 58.6457 36.5286 176.1836 789 R 4.0017 7.9710 122.7957 58.3492 30.1398 176.5533 790 A 4.4693 7.6998 119.4963 51.6322 20.1766 177.5516 791 T 4.4382 8.0764 116.0507 62.6073 67.1404 175.1051 792 T 4.5116 8.0362 116.0881 60.0123 71.9305 175.9407 793 L 3.7922 8.5407 121.3236 58.3289 42.6956 179.1028 794 A 4.0674 8.4260 121.5534 55.4057 18.3607 179.3438 795 S 4.5748 8.3617 109.1471 60.5977 63.8460 176.2606 796 T 4.1473 7.5064 118.2893 65.8584 68.5467 176.6737 797 L 3.9945 8.5434 122.8048 58.3831 42.0307 178.6182 798 M 4.0031 8.4469 118.8398 58.3514 31.8857 178.1353 799 E 3.9626 8.0900 119.3352 59.9047 29.7533 179.3956 800 Q 4.1638 8.0347 115.9138 58.2311 29.0850 177.7358 801 Y 4.3044 7.9739 120.8898 61.0934 38.8588 177.5647 802 M 3.8492 8.4696 120.0158 58.2550 31.8402 178.7832 803 K 4.1753 7.8976 116.7027 58.4755 32.2035 178.3428 804 A 4.3762 7.8444 120.7208 53.3548 19.4800 178.3369 805 T 4.3462 7.6003 104.9372 61.2178 70.3478 174.5838 806 A 4.7859 7.9827 125.5978 52.1022 20.0257 178.9539 807 T 4.0636 8.1935 117.9124 68.5249 68.6563 176.3064 808 Q 3.9537 8.0716 119.4198 58.8577 28.7388 178.1573 809 F 4.0702 8.3771 121.2299 61.7492 39.1637 177.3216 810 V 3.1494 7.4873 116.9781 66.1303 31.1954 177.6806 811 H 3.9991 8.2489 115.9304 59.1892 28.2977 177.2033 812 H 3.9392 8.2946 117.0189 58.9273 28.6496 177.3050 813 A 3.9521 7.7242 121.8661 54.4879 18.4887 178.6060 814 L 4.3128 7.8482 116.4947 56.0993 43.1210 178.5961 815 K 3.7063 7.7350 119.5563 59.9071 32.1043 178.4061 816 D 4.2827 7.8796 118.1289 57.5884 40.7458 178.8350 817 S 4.1246 7.8941 115.1460 61.4261 62.8406 176.7762 818 I 3.7013 7.8570 122.5827 64.3999 36.9204 178.4091 819 L 4.0079 7.8578 119.8152 57.7732 41.1611 179.8201 820 K 4.0113 7.7336 117.2582 59.4801 32.0350 179.1713 821 I 3.8588 7.5095 120.1363 64.3524 36.7170 178.3720 822 M 4.1055 7.7885 118.8022 58.5621 32.0500 178.3681 823 E 4.1591 7.7383 115.2027 56.9744 29.9306 177.3189 824 S 4.5111 6.9913 114.1192 57.5985 63.1925 173.5710 825 K 4.4464 8.1940 120.5481 55.9624 33.7752 175.9754 826 Q 3.9217 7.5900 120.1080 55.7746 28.6220 175.5848 827 S 4.2605 8.4736 120.6571 58.8038 63.0348 173.2627 828 C 4.6477 8.3828 122.8233 59.3555 28.2899 173.3925 829 E 4.0391 7.8600 121.6247 56.3145 29.3946 176.5716 830 L 4.6103 8.3273 124.0299 54.4823 43.8937 176.4258 831 S 3.7845 7.5640 116.1627 56.6929 62.9842 173.3778 832 P 4.4366 0.0000 0.0000 64.0282 31.5153 176.9775 833 S 4.5356 7.6671 112.5466 59.2810 64.6612 175.6976 834 K 4.2847 7.7550 117.3443 56.6268 31.6666 176.4933 835 L 4.3489 7.2674 119.9110 53.3512 42.4602 176.6933 836 E 4.2272 8.2870 123.0617 55.7323 30.2844 176.6650 837 K 4.1206 8.3779 119.2444 57.7771 32.6084 177.2443 838 N 4.0702 8.7563 118.8204 53.9530 36.3804 173.7152 839 E 4.0318 7.5701 116.8010 55.7605 30.4998 175.9765 840 D 4.6653 8.4906 125.5426 53.0977 42.2017 177.3098 841 V 3.7707 8.2343 128.0872 64.1488 31.8837 177.8585 842 N 4.4010 8.1717 117.6994 56.3372 38.4871 177.3579 843 T 3.8643 7.9664 116.6559 66.6955 68.5910 175.8246 844 N 4.3424 8.1771 118.2622 56.4670 38.6044 176.7560 845 L 3.9142 7.9057 121.2103 58.8226 42.1311 178.9175 846 T 3.8490 7.7255 114.8065 67.3018 68.5607 175.8073 847 H 4.1633 8.2915 119.6415 59.1391 29.7939 177.0952 848 L 3.8058 8.0638 122.0535 58.1443 42.0014 178.7407 849 L 3.8087 7.9305 118.9247 58.0487 41.5226 179.3932 850 N 4.3189 8.1508 116.1022 56.2799 38.4096 177.5284 851 I 3.5835 7.4928 120.8803 64.2690 37.1041 178.4298 852 L 3.6979 7.9492 120.0522 57.7457 41.3741 179.6764 853 S 4.1519 8.2932 115.2309 61.7337 62.7088 176.4279 854 E 3.9069 8.2292 121.9122 59.0798 29.2271 178.7025 855 L 3.8414 8.1584 120.7016 58.2979 42.1912 179.2031 856 V 3.2305 7.9088 118.3761 65.5385 31.3510 177.6588 857 E 3.9634 8.1459 118.6395 59.5530 29.0960 179.5567 858 K 4.0410 7.4607 117.4273 59.2650 32.1255 179.3335 859 I 3.7390 7.5540 119.8458 64.3437 37.1933 178.1836 860 F 4.7033 8.6978 119.7284 60.4092 38.4647 176.3646 861 M 4.9330 8.0086 116.3707 55.5071 33.0417 176.4638 862 A 4.8175 7.8618 119.3989 51.8296 20.3525 178.7501 863 S 4.2190 8.7573 114.8053 62.4815 62.3142 175.7639 864 E 4.4078 8.2390 115.9821 57.3330 29.3781 177.0162 865 I 4.2039 7.9752 119.8304 61.5080 38.1008 175.9199 866 L 3.8745 7.3864 122.1539 53.8551 42.4658 175.3446 867 P 4.3129 0.0000 0.0000 62.4735 33.2822 175.5213 868 P 4.2431 0.0000 0.0000 66.1806 31.1846 179.3587 869 T 3.9074 7.8069 114.0847 66.4008 68.4999 176.4143 870 L 3.8472 7.7801 121.9217 58.0743 42.1613 178.9671 871 R 3.9467 7.6785 117.5921 59.3190 29.8781 178.3055 872 Y 4.3292 7.9349 120.5853 60.3298 38.7299 178.3894 873 I 3.4932 7.4683 120.5704 64.5012 37.2111 177.9777 874 Y 4.4132 7.6817 117.5404 60.9421 37.5372 179.1000 875 G 3.4779 8.0626 106.6804 47.7416 0.0000 174.7928 876 C 3.8805 8.4132 120.1558 60.0000 34.4618 176.6350 877 L 3.9776 8.0252 120.1536 57.8345 40.6271 179.5702 878 Q 4.1374 8.0085 117.8931 58.4553 28.7439 178.4582 879 K 3.9189 8.3543 120.0471 59.6765 32.0929 179.1933 880 S 4.0035 8.1189 115.1427 61.9151 62.8701 177.2617 881 V 3.9772 7.9145 114.3230 64.5610 31.0578 178.8715 882 Q 4.1488 7.8875 117.0520 59.2732 28.7356 177.9367 883 H 4.3004 8.1838 116.1576 58.0201 28.6879 177.4205 884 K 3.9757 7.8094 120.7656 57.2421 33.5458 177.3175 885 W 4.7812 8.1507 121.8375 53.9582 28.9488 174.3297 886 P 4.4416 0.0000 0.0000 65.1735 31.3125 177.7594 887 T 4.1396 7.9369 105.7292 61.9806 69.2069 173.7379 888 N 4.7993 7.9848 122.2670 52.3764 39.3452 174.7872 889 T 4.1245 8.3739 122.5306 65.2579 69.2157 176.6197 890 T 4.1330 7.8044 115.9176 64.4931 67.3260 176.3060 891 M 4.0805 7.5617 121.5299 58.0615 31.7027 178.6019 892 R 4.0396 8.0928 115.2602 58.5609 29.7956 178.0419 893 T 4.3054 7.5782 110.3519 63.8172 69.6868 176.7401 894 R 3.9346 8.0174 121.2114 59.0816 29.9195 179.1850 895 V 3.7182 7.8442 116.6713 64.2620 31.5059 177.7675 896 V 3.8412 7.5608 118.4362 65.0747 31.7594 177.5497 897 S 4.4768 8.2377 113.2149 61.3232 62.0677 176.1854 898 G 3.6164 8.3466 107.1931 46.4977 0.0000 174.3715 899 F 4.7132 7.7582 118.6737 59.4919 40.5792 178.3026 900 V 3.7119 8.0544 118.6307 64.5374 31.1453 176.7875 901 F 4.3797 8.4435 117.4002 58.7494 39.5509 177.4152 902 L 4.1839 8.0332 120.4578 57.9112 42.0780 178.2864 903 R 4.6632 7.5557 113.6882 55.8554 30.4022 175.5682 904 L 4.8335 7.8140 119.1263 56.1735 45.0511 178.3960 905 I 3.8280 7.9308 118.6060 64.5157 37.2355 178.2974 906 C 4.2603 8.2149 117.5376 62.3225 27.9086 174.2679 907 P 4.3139 0.0000 0.0000 65.7447 30.5340 178.5064 908 A 4.3421 7.9860 118.2544 54.8703 17.9744 179.9481 909 I 3.7197 7.4144 117.8318 64.7226 37.3843 178.2819 910 L 4.4331 7.9283 118.3866 56.1545 42.3318 176.6077 911 N 4.8353 8.6015 117.8582 50.4302 39.5453 172.5162 912 P 4.8310 0.0000 0.0000 62.9759 31.7022 177.1111 913 R 4.4071 7.8748 116.9572 56.7694 30.1711 177.9997 914 M 4.0198 7.7979 119.0474 57.8227 32.0979 177.6189 915 F 4.5854 7.9924 113.2492 55.9313 40.5979 174.6266 916 N 4.2354 7.6959 114.4620 54.8476 37.3784 175.1648 917 I 3.7363 8.2852 120.4079 63.3877 37.7495 176.1254 918 I 4.5967 7.4476 117.9070 59.2743 40.5549 175.0257 919 S 4.7207 8.3509 111.8771 58.1180 64.0172 173.1300 920 D 4.8318 7.7433 118.6247 52.8318 44.5991 175.1422 921 S 4.3285 8.5318 118.3489 57.4220 63.4359 172.8122 922 P 4.3077 0.0000 0.0000 62.6823 31.8522 176.9676 923 S 4.4103 8.3833 116.6869 57.4887 64.6632 173.5384 924 P 4.3012 0.0000 0.0000 65.8727 30.9808 179.1487 925 I 3.7408 7.6742 117.8405 64.1423 37.1742 177.9831 926 A 3.9501 7.9273 121.3412 55.2741 17.7887 179.3860 927 A 3.9412 8.4154 119.5934 55.4242 18.3432 179.9255 928 R 3.8905 7.7026 116.0692 59.8620 30.1764 178.9283 929 T 3.8679 7.8679 115.6100 66.5791 68.3878 176.5597 930 L 4.0048 8.0740 120.9476 57.9264 41.5338 179.8440 931 I 3.7471 7.4926 118.3752 64.4586 37.0118 178.4349 932 L 3.8920 8.0791 119.8616 57.6236 41.2985 179.9274 933 V 3.5853 8.4882 118.2710 65.9123 31.6470 178.0875 934 A 4.1019 8.2069 120.6045 54.8626 18.1745 179.6874 935 K 3.9886 8.8793 117.6905 59.8267 32.3033 179.6717 936 S 4.4993 7.9394 115.3627 61.8780 62.7591 176.8593 937 V 3.6485 8.2260 121.2983 66.1843 31.2816 177.8499 938 Q 3.9269 8.2019 119.2935 58.9313 28.7904 177.7837 939 N 4.1223 8.1946 117.6569 56.0896 38.6039 177.0884 940 L 3.7308 7.6734 121.0973 58.1118 41.9881 178.8943 941 A 3.5722 7.7709 119.5462 54.5200 18.1948 178.5176 942 N 4.4787 7.6415 113.0776 52.9106 39.2929 175.3436 943 L 3.6579 7.5963 118.4371 55.7406 39.1907 174.2917 944 V 4.2810 7.5105 111.6195 59.1706 33.5563 176.2692 945 E 3.9682 8.4028 124.0258 56.1614 29.4338 176.8097 946 F 3.9895 8.4555 120.6585 59.9910 38.8296 182.5299 947 G 3.2659 7.1731 106.2851 46.2770 0.0000 175.2517 948 A 4.4224 7.3464 129.9995 48.4731 18.7686 176.7323 949 K 4.0814 7.8768 128.9837 56.5666 37.2877 177.1523 950 E 4.2793 9.3165 121.2126 55.7451 31.3588 175.1560 951 P 4.9715 0.0000 0.0000 65.2860 31.9748 178.2529 952 Y 4.1667 7.8970 116.0655 59.8774 38.1854 177.0046 953 M 3.8337 6.8903 118.3957 56.3523 32.0520 177.7038 954 E 4.0058 7.9576 119.3429 59.2109 29.7433 178.3873 955 G 4.0524 7.9623 105.6746 45.8126 0.0000 174.5844 956 V 4.3242 7.6907 117.5817 62.6393 31.8886 177.0187 957 N 4.5778 8.0471 115.7355 56.3423 38.3920 174.9536 958 P 4.2562 0.0000 0.0000 66.2156 30.4819 177.9542 959 F 4.1864 7.9631 118.7777 61.0391 39.3384 177.1494 960 I 3.2572 7.6329 118.7501 64.2498 36.7397 178.4674 961 K 3.9726 8.2576 118.7447 59.0403 31.9805 178.7178 962 S 4.5117 7.8830 111.5764 58.9347 63.7495 174.1333 963 N 4.8261 7.3721 117.9217 52.0260 40.4299 175.8124 964 K 3.6933 8.0999 120.8303 60.0868 32.1904 177.8993 965 H 4.2876 8.0998 114.2250 58.2990 28.6930 177.5251 966 R 3.4918 7.2051 120.3711 58.8041 29.7072 178.5541 967 M 4.0492 7.8920 118.1249 58.7490 32.3360 178.1395 968 I 3.6940 7.3341 119.9341 64.7200 37.1898 177.8902 969 M 3.9527 7.8285 119.0982 58.5941 31.7667 178.4238 970 F 4.1592 7.9176 120.2107 61.6791 39.4438 177.3055 971 L 4.0377 8.1639 117.0988 57.6373 41.6285 178.8394 972 D 4.4415 8.2064 118.1823 57.2528 41.2882 177.6517 973 E 4.1629 8.5279 117.9001 57.4744 29.5153 178.3358 974 L 3.9409 8.0009 120.9996 57.2155 42.3282 177.3377 975 G 4.1147 7.4523 106.2481 45.5120 0.0000 173.2620 976 N 4.5802 8.0519 116.9373 53.5920 38.9420 174.8094 977 V 4.3396 7.8292 117.4088 60.1927 32.7278 173.8594 978 P 4.8666 0.0000 0.0000 62.7158 32.3940 174.8691 979 E 4.5891 7.9529 119.1863 54.1180 30.9879 175.4550 980 L 3.4089 8.0088 125.8797 54.3776 42.6473 175.2411 981 P 4.3714 0.0000 0.0000 65.3045 31.7952 175.8346 982 D 4.1078 7.6993 122.2600 56.0343 40.9864 177.5006 983 T 4.2126 7.8461 113.7932 61.0286 70.2907 176.5925 984 T 3.4848 8.3509 110.3394 63.9531 65.5517 170.4089 985 E 4.2574 8.0308 119.9512 56.4960 30.9459 179.0300 *986 H 4.3401 8.6382 120.9190 54.6496 28.4055 176.8509 987 S 4.2518 8.5401 123.9636 57.4359 62.8029 171.3968 988 R 4.3403 8.3225 120.5041 56.3688 29.6059 176.4503 989 T 4.5456 8.2620 118.1338 59.7875 70.2134 172.0544 990 D 5.0530 8.7482 120.0167 52.7786 43.4188 176.7836 991 L 4.3735 8.1810 125.8400 55.8249 42.9718 178.4648 992 S 3.7096 7.4025 114.5902 61.7219 62.4824 176.5410 993 R 3.6848 8.0077 121.5681 59.2183 29.6465 177.6777 994 D 4.4210 8.4993 118.3451 56.4507 41.0450 178.8848 995 L 3.9273 7.5686 119.0541 57.3694 41.5757 178.7272 996 A 3.9975 8.2818 121.1403 55.5082 18.1226 179.7077 997 A 4.1221 7.7792 118.6912 54.7920 18.4034 179.6075 998 L 4.0928 7.9154 119.3693 58.3949 42.2286 178.2364 999 H 4.2399 8.7990 118.5479 59.6171 29.7910 177.0730 1000 E 4.0021 8.6802 120.4635 59.2345 29.0140 179.1658 1001 I 4.0043 7.2331 117.5701 63.7333 37.6165 177.9008 1002 C 4.3422 7.8662 117.7395 62.5808 27.9827 175.7696 1003 V 3.5174 8.0178 120.0644 66.2417 30.8805 178.0228 1004 A 4.0653 7.8283 118.0859 54.2282 18.3432 177.4834 1005 H 4.8472 7.8127 114.2449 55.3441 30.0363 176.1792 1006 S 4.0850 8.5244 115.5734 61.4193 62.1924 174.9429 1007 D 4.4312 8.1553 121.3220 57.0916 38.8354 178.7145 1008 E 4.0052 8.2058 119.9337 58.7438 29.5454 179.1646 1009 L 4.1952 8.1758 118.6153 57.2506 41.5427 179.6582 1010 R 4.0774 8.0738 120.1868 58.9040 29.7536 179.0234 1011 T 3.9146 7.7299 114.8079 66.5915 68.5263 176.4656 1012 L 4.2048 7.9335 120.6995 57.3530 41.1670 179.3511 1013 S 4.3495 8.2288 114.0072 60.8844 62.8645 176.1181 1014 N 4.5529 7.7826 119.6763 54.3840 38.3088 174.6048 1015 E 4.2355 7.2662 120.8578 54.8987 30.0578 176.3688 1016 R 4.6744 7.7838 122.4944 55.0986 30.5857 176.3465 1017 G 4.1444 8.5102 105.5985 43.5175 0.0000 173.5475 1018 A 3.9773 8.1799 122.5426 55.3697 18.4509 179.6933 1019 Q 3.9134 7.8532 113.7812 58.3548 28.7664 177.2977 1020 Q 3.9525 8.2409 121.6010 59.5238 28.9375 177.5396 1021 H 4.0344 8.3056 118.2783 59.5779 29.8529 177.5403 1022 V 3.5221 7.7331 119.1594 66.1341 31.4416 177.9869 1023 L 4.0786 8.6545 119.0843 57.5070 41.4224 179.4235 1024 K 3.9630 8.8367 119.3370 59.6386 32.0006 179.1254 1025 K 3.9319 8.0296 119.5163 59.2570 31.9373 178.5015 1026 L 4.0415 7.9696 120.7516 58.3510 42.0737 179.0212 1027 L 3.9062 7.7674 118.5338 57.4972 41.5414 179.2504 1028 A 3.9668 7.8537 120.2918 55.4369 18.2720 179.7451 1029 I 3.6277 8.0604 118.2997 64.7894 37.1482 178.8167 1030 T 3.6977 8.5449 116.9894 66.6866 68.2506 176.3487 1031 E 3.9451 8.5818 121.6025 59.1300 29.5229 178.5840 1032 L 3.9170 8.4985 120.8257 57.8780 41.8881 178.7473 1033 L 3.9538 7.8868 118.3270 56.9135 41.7649 178.7529 1034 Q 4.1823 8.3070 118.8237 59.3197 28.5025 179.0467 1035 Q 4.0063 7.9516 117.3751 59.0597 28.9506 178.9663 1036 K 4.1144 7.6397 116.9083 57.8310 32.1739 177.4943 1037 Q 4.2824 7.5963 125.1127 56.1215 29.1662 174.5734 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 718 M 8.30 4.47 0.00 2.01 1.72 0.00 0.00 0.00 0.00 0.00 -0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.43 2.52 0.00 719 P 0.00 4.08 0.00 2.25 2.03 0.00 3.75 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.14 0.00 720 E 10.05 3.98 0.00 2.07 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 2.42 2.48 0.00 721 E 8.39 4.01 0.00 2.10 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 2.42 2.50 0.00 722 E 8.74 4.12 0.00 1.65 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 2.27 2.35 0.00 723 Y 8.13 4.70 0.00 3.16 3.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 724 S 7.97 4.34 0.00 4.10 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 0.00 725 E 8.33 3.96 0.00 2.22 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 0.00 2.43 2.34 0.00 726 F 8.13 4.49 0.00 3.01 3.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 727 K 8.87 3.64 0.00 1.94 1.90 0.00 1.61 0.00 0.00 1.41 0.00 0.00 2.77 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.28 1.52 7.81 728 E 8.28 4.26 0.00 2.05 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 2.28 2.34 0.00 729 L 7.87 4.35 0.00 2.00 1.78 0.97 0.97 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 0.00 730 I 7.00 3.59 1.72 0.00 0.00 -0.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.13 0.78 0.00 0.00 731 L 7.55 4.23 0.00 1.52 1.58 0.80 0.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 732 Q 7.39 3.95 0.00 2.14 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.88 6.75 0.00 0.00 0.00 0.00 0.00 2.40 2.43 0.00 733 K 8.93 3.95 0.00 1.80 1.90 0.00 1.82 0.00 0.00 1.72 0.00 0.00 3.03 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.48 1.50 7.81 734 E 8.21 3.97 0.00 1.83 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 2.33 2.37 0.00 735 L 8.45 4.22 0.00 2.09 1.49 0.68 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 736 H 7.90 4.52 0.00 3.11 3.41 0.00 5.64 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 737 V 7.87 3.62 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 0.00 0.00 1.00 0.00 0.00 738 V 7.69 3.53 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 0.74 0.00 0.00 0.83 0.00 0.00 739 Y 7.22 3.92 0.00 3.28 3.07 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 0.00 0.00 0.00 740 A 8.12 4.35 1.49 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 0.00 741 L 8.40 3.92 0.00 1.78 1.72 0.93 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 742 S 7.92 4.07 0.00 3.87 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 0.00 743 H 7.88 4.52 0.00 3.27 3.37 0.00 5.65 0.00 0.00 0.00 0.00 7.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 744 V 7.56 3.91 2.13 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 0.92 0.00 0.00 0.91 0.00 0.00 745 C 8.32 4.38 0.00 2.92 2.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 746 G 8.08 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 747 Q 8.23 4.41 0.00 2.03 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.56 6.85 0.00 0.00 0.00 0.00 0.00 2.27 2.31 0.00 748 D 7.92 4.74 0.00 2.74 2.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 749 R 7.94 4.08 0.00 1.88 1.95 0.00 3.23 0.00 0.00 3.53 7.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.79 0.00 750 T 7.90 3.86 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 1.22 0.00 0.00 751 L 7.93 3.93 0.00 1.77 1.85 0.93 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 752 L 8.84 3.95 0.00 1.71 1.95 0.93 1.07 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 0.00 753 A 8.21 3.93 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 754 S 7.96 4.10 0.00 4.07 3.97 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 0.00 755 I 7.40 3.87 2.04 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 1.53 1.64 0.94 0.00 0.00 756 L 8.42 4.16 0.00 1.63 1.70 0.84 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 757 L 8.35 3.96 0.00 1.91 1.71 0.81 0.99 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 0.00 758 R 7.49 3.88 0.00 1.88 2.06 0.00 3.23 0.00 0.00 3.24 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.88 0.00 759 I 7.60 3.76 2.01 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.11 0.52 0.00 0.00 760 F 8.57 3.96 0.00 3.15 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 0.00 761 L 8.66 3.52 0.00 1.83 1.78 1.02 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 762 H 7.93 4.33 0.00 3.33 3.38 0.00 5.74 0.00 0.00 0.00 0.00 7.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 763 E 8.05 4.50 0.00 2.04 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.09 0.00 764 K 7.88 3.95 0.00 1.82 1.98 0.00 1.53 0.00 0.00 1.67 0.00 0.00 3.08 0.00 0.00 3.18 0.00 0.00 0.00 0.00 1.33 1.47 7.81 765 L 8.71 4.80 0.00 1.78 1.90 0.83 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 766 E 8.50 3.79 0.00 1.81 1.67 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 2.42 2.45 0.00 767 S 7.91 4.04 0.00 3.86 4.03 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 0.00 768 L 7.85 3.93 0.00 1.79 1.89 1.05 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 769 L 7.87 3.49 0.00 0.50 1.29 -0.06 0.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 770 L 8.03 3.81 0.00 1.47 1.46 0.09 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 771 C 8.29 4.26 0.00 3.10 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 0.00 772 T 7.81 3.91 4.33 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 1.34 0.00 0.00 773 L 8.10 4.25 0.00 1.88 1.67 0.47 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 774 N 8.30 4.79 0.00 2.93 3.11 0.00 0.00 6.72 7.85 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 0.00 775 D 8.12 4.44 0.00 2.89 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 0.00 776 R 8.34 3.87 0.00 2.22 1.96 0.00 3.12 0.00 0.00 3.01 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.50 0.00 777 E 8.08 3.95 0.00 1.99 1.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.65 2.69 0.00 778 I 7.85 3.88 2.04 0.00 0.00 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.02 0.97 0.00 0.00 779 S 8.16 4.07 0.00 3.96 4.03 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 0.00 780 M 7.55 4.36 0.00 2.01 2.19 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.48 0.00 781 E 7.54 4.34 0.00 2.06 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 2.42 2.59 0.00 782 D 8.79 4.75 0.00 2.87 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 0.00 783 E 8.39 4.63 0.00 2.08 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 2.19 2.24 0.00 784 A 8.39 3.52 0.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 785 T 7.71 4.12 4.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 786 T 7.33 4.43 4.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 787 L 7.86 3.99 0.00 1.69 1.66 0.62 0.90 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 0.00 788 F 8.43 4.00 0.00 3.19 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 0.00 789 R 7.97 4.00 0.00 1.98 1.95 0.00 3.28 0.00 0.00 3.21 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.61 0.00 790 A 7.70 4.47 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 791 T 8.08 4.44 4.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 792 T 8.04 4.51 4.33 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 1.32 0.00 0.00 793 L 8.54 3.79 0.00 1.75 1.70 0.92 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 794 A 8.43 4.07 1.64 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 0.00 0.00 795 S 8.36 4.57 0.00 4.25 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 0.00 796 T 7.51 4.15 4.40 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 1.25 0.00 0.00 797 L 8.54 3.99 0.00 1.99 1.60 0.89 0.82 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 0.00 798 M 8.45 4.00 0.00 2.02 2.25 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 2.77 0.00 799 E 8.09 3.96 0.00 2.18 2.18 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 2.36 2.45 0.00 800 Q 8.03 4.16 0.00 2.13 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.74 0.00 0.00 0.00 0.00 0.00 2.41 2.55 0.00 801 Y 7.97 4.30 0.00 3.12 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 0.00 802 M 8.47 3.85 0.00 2.14 2.19 0.00 0.00 0.00 0.00 0.00 2.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.86 2.57 0.00 803 K 7.90 4.18 0.00 1.75 1.81 0.00 1.72 0.00 0.00 2.12 0.00 0.00 3.20 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.36 1.16 7.81 804 A 7.84 4.38 1.32 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 0.00 0.00 0.00 846 T 7.73 3.85 4.46 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 1.25 0.00 0.00 847 H 8.29 4.16 0.00 3.19 3.45 0.00 5.78 0.00 0.00 0.00 0.00 6.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 848 L 8.06 3.81 0.00 1.77 1.76 0.86 0.48 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 0.00 849 L 7.93 3.81 0.00 1.89 1.69 0.95 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 850 N 8.15 4.32 0.00 2.88 2.83 0.00 0.00 7.07 6.74 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 0.00 851 I 7.49 3.58 1.88 0.00 0.00 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.58 0.80 0.00 0.00 852 L 7.95 3.70 0.00 1.37 0.66 0.61 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 853 S 8.29 4.15 0.00 3.93 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 0.00 854 E 8.23 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4.14 4.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 888 N 7.98 4.80 0.00 2.77 2.79 0.00 0.00 7.11 8.06 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 0.00 889 T 8.37 4.12 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 1.22 0.00 0.00 890 T 7.80 4.13 4.21 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 1.26 0.00 0.00 891 M 7.56 4.08 0.00 2.21 2.14 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.25 2.49 0.00 892 R 8.09 4.04 0.00 2.00 2.12 0.00 3.04 0.00 0.00 3.51 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.81 0.00 893 T 7.58 4.31 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 1.23 0.00 0.00 894 R 8.02 3.93 0.00 1.85 2.03 0.00 3.05 0.00 0.00 3.32 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.68 0.00 895 V 7.84 3.72 2.29 0.00 0.00 0.00 0.00 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0.00 0.00 3.16 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.93 0.00 929 T 7.87 3.87 4.33 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 1.18 0.00 0.00 930 L 8.07 4.00 0.00 1.84 1.84 0.98 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 931 I 7.49 3.75 2.03 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 1.55 0.88 0.95 0.00 0.00 932 L 8.08 3.89 0.00 2.05 1.71 0.97 0.81 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 0.00 933 V 8.49 3.59 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 0.00 934 A 8.21 4.10 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 935 K 8.88 3.99 0.00 2.05 2.04 0.00 1.74 0.00 0.00 1.70 0.00 0.00 2.98 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.54 1.69 7.81 936 S 7.94 4.50 0.00 4.04 4.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.51 2.83 0.00 970 F 7.92 4.16 0.00 3.14 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 0.00 971 L 8.16 4.04 0.00 1.74 1.79 0.98 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 972 D 8.21 4.44 0.00 3.05 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 0.00 973 E 8.53 4.16 0.00 2.15 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.30 0.00 974 L 8.00 3.94 0.00 1.54 1.57 0.38 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 975 G 7.45 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 0.00 976 N 8.05 4.58 0.00 2.77 2.81 0.00 0.00 6.80 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 977 V 7.83 4.34 2.18 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 1.06 0.00 0.00 0.95 0.00 0.00 978 P 0.00 4.87 0.00 2.25 2.17 0.00 3.58 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 2.10 0.00 979 E 7.95 4.59 0.00 1.96 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 2.23 2.32 0.00 980 L 8.01 3.41 0.00 0.76 1.26 0.65 nan 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 981 P 0.00 4.37 0.00 2.00 2.03 0.00 3.52 0.00 0.00 3.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.02 0.00 982 D 7.70 4.11 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 0.00 983 T 7.85 4.21 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 1.21 0.00 0.00 984 T 8.35 3.48 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 1.21 0.00 0.00 985 E 8.03 4.26 0.00 1.98 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 2.23 1.87 0.00 *986 H 8.64 4.34 0.00 2.92 2.90 0.00 7.18 0.00 0.00 0.00 0.00 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 987 S 8.54 4.25 0.00 3.62 3.68 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 0.00 988 R 8.32 4.34 0.00 1.83 1.78 0.00 3.18 0.00 0.00 3.28 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.18 0.00 989 T 8.26 4.55 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 1.22 0.00 0.00 990 D 8.75 5.05 0.00 2.61 2.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 991 L 8.18 4.37 0.00 1.73 1.54 0.75 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 992 S 7.40 3.71 0.00 3.92 4.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 993 R 8.01 3.68 0.00 1.90 1.95 0.00 3.20 0.00 0.00 3.33 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.79 0.00 994 D 8.50 4.42 0.00 2.68 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 0.00 995 L 7.57 3.93 0.00 1.29 1.27 0.81 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 996 A 8.28 4.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 997 A 7.78 4.12 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 998 L 7.92 4.09 0.00 1.95 1.93 0.96 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 999 H 8.80 4.24 0.00 3.24 3.72 0.00 5.84 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1000 E 8.68 4.00 0.00 2.20 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 0.00 2.37 2.61 0.00 1001 I 7.23 4.00 2.09 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 1.57 0.75 0.95 0.00 0.00 1002 C 7.87 4.34 0.00 3.20 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 1003 V 8.02 3.52 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 1.06 0.00 0.00 0.80 0.00 0.00 1004 A 7.83 4.07 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1005 H 7.81 4.85 0.00 3.39 3.29 0.00 5.82 0.00 0.00 0.00 0.00 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1006 S 8.52 4.08 0.00 3.97 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 1007 D 8.16 4.43 0.00 2.91 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 1008 E 8.21 4.01 0.00 2.26 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 0.00 2.43 2.43 0.00 1009 L 8.18 4.20 0.00 1.89 1.76 1.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 1010 R 8.07 4.08 0.00 2.06 1.98 0.00 3.14 0.00 0.00 3.27 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.66 0.00 1011 T 7.73 3.91 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 1.22 0.00 0.00 1012 L 7.93 4.20 0.00 1.88 1.74 0.99 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 1013 S 8.23 4.35 0.00 4.07 4.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1014 N 7.78 4.55 0.00 2.89 2.93 0.00 0.00 6.92 7.76 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 1015 E 7.27 4.24 0.00 1.97 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 2.30 2.38 0.00 1016 R 7.78 4.67 0.00 1.94 2.01 0.00 2.78 0.00 0.00 3.72 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.64 0.00 1017 G 8.51 4.14 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1018 A 8.18 3.98 1.31 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 0.00 0.00 0.00 0.00 0.00 1019 Q 7.85 3.91 0.00 2.06 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.79 0.00 0.00 0.00 0.00 0.00 1.96 2.27 0.00 1020 Q 8.24 3.95 0.00 2.46 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.09 6.68 0.00 0.00 0.00 0.00 0.00 2.49 2.58 0.00 1021 H 8.31 4.03 0.00 3.25 3.35 0.00 5.72 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 1022 V 7.73 3.52 2.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 1.08 0.00 0.00 1023 L 8.65 4.08 0.00 1.85 1.73 0.96 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 1024 K 8.84 3.96 0.00 1.93 1.86 0.00 1.69 0.00 0.00 1.59 0.00 0.00 2.91 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.47 1.57 7.81 1025 K 8.03 3.93 0.00 1.95 1.88 0.00 1.57 0.00 0.00 1.59 0.00 0.00 2.93 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.45 1.44 7.81 1026 L 7.97 4.04 0.00 2.01 1.94 1.18 0.57 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 1027 L 7.77 3.91 0.00 1.72 1.71 0.94 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 1028 A 7.85 3.97 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 1029 I 8.06 3.63 2.18 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.66 0.91 0.00 0.00 1030 T 8.54 3.70 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 1.15 0.00 0.00 1031 E 8.58 3.95 0.00 2.26 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 2.29 2.30 0.00 1032 L 8.50 3.92 0.00 1.84 1.74 0.89 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 1033 L 7.89 3.95 0.00 1.46 1.32 0.43 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 1034 Q 8.31 4.18 0.00 2.20 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.78 0.00 0.00 0.00 0.00 0.00 2.44 2.55 0.00 1035 Q 7.95 4.01 0.00 2.14 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.95 0.00 0.00 0.00 0.00 0.00 2.38 2.39 0.00 1036 K 7.64 4.11 0.00 1.56 1.76 0.00 1.62 0.00 0.00 1.52 0.00 0.00 3.02 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.42 1.57 7.81 1037 Q 7.60 4.28 0.00 1.97 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.76 6.55 0.00 0.00 0.00 0.00 0.00 2.30 2.35 0.00 * Residues marked with a * may have inaccurate shift predictions.