NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- *578 H 4.7466 8.4293 117.3757 53.9096 29.6925 173.8662 579 K 4.3462 8.6907 114.6838 55.6978 35.2410 176.6053 580 T 4.2639 8.8614 119.1018 62.2688 68.9267 174.9810 581 L 4.9531 9.5549 128.5188 52.9228 44.4081 177.4831 582 A 3.9649 8.9131 122.6709 55.4394 17.9350 179.6213 583 M 4.2096 7.5695 113.0709 57.5913 31.4987 177.7655 584 D 4.5179 8.0407 119.7597 56.1783 41.3384 177.7791 585 V 4.0472 7.5669 117.0116 63.2863 32.5203 175.8278 586 M 4.4552 7.2340 115.3104 55.5528 31.8680 176.0302 587 K 4.7773 8.7053 118.5045 53.9143 36.1746 174.2109 588 P 4.7354 0.0000 0.0000 62.3466 32.1909 177.0109 589 R 4.2359 8.3176 120.7462 55.4236 31.3119 176.0423 590 R 4.0374 8.4932 117.8412 58.3054 30.1745 176.2995 591 N 4.1750 8.7154 118.6957 53.8678 36.2126 173.7518 592 D 4.8397 7.3500 116.6238 52.6814 42.9611 174.6756 593 P 4.3611 0.0000 0.0000 62.6441 31.7082 176.8140 594 L 4.1848 8.2643 121.2674 54.1522 42.2606 176.7924 595 L 3.8782 8.3340 121.6838 56.0321 42.2692 176.6761 596 T 4.3886 8.3409 122.2546 63.0351 68.8455 174.3868 597 V 4.8240 8.1263 118.7066 59.6182 35.9042 174.9279 598 L 4.8523 8.7576 122.2886 53.4953 44.5280 175.8200 599 T 5.1360 8.3124 110.8047 60.2135 71.1397 174.4707 600 Q 4.6551 8.6719 119.6099 57.9159 29.4078 176.7199 601 D 4.8133 8.2716 115.6932 53.5323 43.4451 175.2361 602 S 4.6965 7.8500 109.2114 58.0084 64.8178 174.1461 603 M 4.3387 7.8806 121.7318 54.9051 32.9949 175.8866 604 T 4.7679 8.0892 113.1040 60.7782 71.8916 176.3341 605 V 3.5635 8.4005 121.1343 66.0916 31.4439 177.8271 606 E 4.0945 8.3113 119.1342 59.2006 29.3875 178.4602 607 D 4.2970 7.9494 118.9661 57.5792 40.9547 179.1103 608 V 3.5504 7.6991 118.4139 65.8830 31.2818 177.9169 609 E 3.9744 8.0809 118.2558 59.5482 29.0478 179.1413 610 T 3.9225 7.7221 112.3413 64.8477 67.2602 176.3318 611 I 3.8450 7.5474 121.7426 64.2906 36.8671 178.3643 612 I 3.8733 7.4878 119.8406 64.2695 37.1131 178.0408 613 S 4.4483 7.6884 112.0375 59.4167 63.4444 174.9259 614 E 4.5630 7.7181 120.6508 55.5699 30.2384 174.9749 615 T 4.5730 7.2271 108.1017 59.9989 71.9659 173.4129 616 T 4.5285 7.5274 108.6780 61.2788 69.4125 173.7812 617 Y 4.4486 7.3405 119.0932 58.4098 38.7671 176.4024 618 S 4.2129 8.8548 119.4403 61.5866 63.1949 174.0771 619 G 3.8414 7.1923 103.9716 45.1381 0.0000 172.1595 620 F 4.9697 8.0679 117.6627 54.6952 42.9940 173.5837 621 P 5.0994 0.0000 0.0000 62.5612 32.8792 175.4053 622 V 4.7992 8.9896 122.5383 60.0663 33.9876 175.2069 623 V 4.8276 8.4314 117.0975 59.3752 34.7223 177.0647 624 V 3.7534 8.6086 122.7426 65.9951 31.9626 175.9125 625 S 4.6208 7.6029 112.3409 57.3959 65.8785 175.5069 626 R 4.0366 8.4459 119.3767 58.9026 30.1845 178.2289 627 E 4.1015 8.2379 118.2952 58.9476 29.8706 177.7706 628 S 4.2574 8.1348 113.1533 59.1329 63.7518 175.0422 629 Q 3.7197 8.0239 117.2542 56.5438 26.8854 172.7231 630 R 4.5052 7.2945 117.4930 55.6590 31.3465 175.7149 631 L 4.3432 8.5324 126.2555 55.1040 42.3118 176.1818 632 V 4.1667 9.0844 125.6525 62.4390 34.0052 175.3619 633 G 4.0039 6.8494 104.5699 46.3595 0.0000 170.6479 634 F 5.4564 8.0882 120.9761 56.2051 42.8295 174.5479 635 V 4.6649 8.0303 125.2256 59.6832 34.3730 175.3301 636 L 4.4599 8.3818 123.5233 54.2505 42.8955 178.0419 637 R 4.0930 9.1771 122.8682 59.7090 29.9544 179.2787 638 R 3.9859 8.0643 115.4479 59.5206 29.1562 178.4329 639 D 4.3621 8.0409 118.9950 56.9516 41.0172 178.2563 640 L 3.9951 7.7908 119.0800 58.0772 41.7355 179.2177 641 I 3.6973 7.8112 119.3885 64.8655 37.0821 178.3339 642 I 3.6751 7.5715 119.8253 64.6775 36.7096 178.7482 643 S 4.1132 8.4257 116.2901 61.8113 62.3685 176.9468 644 I 3.8751 7.9160 122.3615 63.9915 36.6270 178.0989 645 E 3.9573 7.9668 119.7088 59.2829 28.9230 178.3495 646 N 4.4598 8.4938 116.3456 55.7407 38.4667 176.9372 647 A 4.3856 7.6585 120.6886 54.2723 18.7685 179.4391 648 R 4.0403 7.5664 115.1814 58.4009 30.2437 178.4427 649 K 4.2238 7.3200 117.6231 57.8378 32.2957 178.3497 650 K 3.8954 7.6990 118.6020 58.8929 32.9118 177.4922 651 Q 3.1401 7.9400 118.5408 56.8688 27.1545 173.1806 652 D 4.7252 7.6029 118.7303 53.2513 41.1115 177.3481 653 G 4.1357 8.3255 111.6002 44.5372 0.0000 174.4551 654 V 3.7092 7.6240 118.8623 62.4486 32.4952 174.9848 655 V 4.5648 8.3494 119.7184 59.0131 35.3566 176.5132 656 S 4.1098 8.7543 115.9921 62.2819 62.4952 176.5587 657 T 4.3337 7.7137 106.4241 61.7496 69.1619 174.6511 658 S 4.3644 7.9100 120.1646 58.8253 64.2912 173.3879 659 I 4.4717 8.3398 125.0589 61.0216 38.2978 174.9898 660 I 4.7601 8.7798 128.9965 60.7370 38.2354 175.0170 661 Y 5.0878 8.2709 123.2064 55.5161 41.4386 175.3688 662 F 4.9175 9.1849 118.9316 57.5274 40.3374 175.8029 663 T 4.4656 8.1251 109.7478 60.5543 70.1178 174.6274 664 E 4.1318 8.8355 120.7020 58.9267 29.6030 177.3669 665 H 5.0211 7.7483 113.0900 53.3028 32.0279 173.5213 666 S 2.7900 8.1919 116.5611 56.9807 62.8340 172.3509 667 P 4.3397 0.0000 0.0000 61.2409 31.9394 174.3561 668 P 4.2102 0.0000 0.0000 63.3629 31.3768 175.5744 669 L 4.8384 8.0007 121.3072 51.7147 45.6018 174.5050 670 P 4.3994 0.0000 0.0000 61.9586 31.8487 174.9420 671 P 4.1351 0.0000 0.0000 63.8808 31.7779 175.9549 672 Y 3.8798 7.6736 116.0488 59.2767 35.4750 170.8172 673 T 4.5150 7.0475 108.5160 59.2326 70.6988 172.6402 674 P 4.4234 0.0000 0.0000 61.7860 31.8900 174.3689 675 P 4.4917 0.0000 0.0000 63.7992 31.6030 175.8697 676 T 4.5802 8.4273 111.9260 61.0287 71.0834 173.2488 677 L 4.6247 8.6271 123.7331 53.0666 44.8418 174.7267 678 K 3.5222 8.3578 127.6298 54.1386 32.8635 175.8827 679 L 4.5511 7.5219 128.6652 54.3516 42.5287 179.0054 680 R 4.1056 7.7713 122.2960 59.2875 30.2107 177.4842 681 N 4.6395 8.1103 112.7520 53.8785 37.4374 175.0486 682 I 4.4503 7.4757 110.9170 60.4381 38.0090 174.4828 683 L 4.4766 7.7788 122.8589 53.6062 43.4736 175.6105 684 D 4.5655 8.5910 126.0950 53.7207 40.3689 175.5808 685 L 4.6089 8.3394 126.2510 54.8963 42.1496 178.4656 686 S 4.5085 8.0738 113.4989 56.6432 63.7224 172.1934 687 P 4.3388 0.0000 0.0000 62.2080 32.9842 176.4215 688 F 4.4876 8.3368 118.3080 57.1912 40.3500 174.6619 689 T 5.2609 8.4857 116.9798 60.3960 70.7602 173.1128 690 V 4.7247 8.5897 125.7343 60.1639 35.3141 174.7901 691 T 4.8035 8.5180 113.1894 61.3089 69.7156 175.1057 692 D 4.5117 8.9476 121.8782 55.4061 39.5740 177.5624 693 L 4.4782 7.2266 118.4804 54.9172 42.2618 176.6684 694 T 4.0799 7.8465 118.2339 62.3629 69.1173 172.4729 695 P 4.6782 0.0000 0.0000 63.2708 33.2798 177.5069 696 M 4.1161 8.7915 120.9785 58.2326 32.0236 178.7861 697 E 3.9784 8.2440 119.3083 59.3031 29.7281 178.7680 698 I 3.9532 7.6597 119.3404 63.9145 37.4333 178.2168 699 V 3.6661 7.6729 118.7078 66.1103 31.4543 178.1679 700 V 3.5938 8.1939 118.3807 66.0048 31.2137 177.5464 701 D 4.3017 7.7020 116.5548 57.3970 41.0574 178.2549 702 I 3.6384 7.8477 120.2813 64.4433 37.1037 178.3921 703 F 3.7836 8.4661 118.5711 60.5039 38.4724 177.8627 704 R 3.9170 7.7966 116.4566 59.4303 30.0386 179.0462 705 K 4.1007 8.0304 117.0884 59.0215 32.2309 178.8217 706 L 4.2393 7.9786 116.9449 53.6759 42.2008 176.6925 707 G 3.8790 7.7393 106.4187 46.2385 0.0000 174.3425 708 L 3.9367 7.5007 117.8178 54.5510 42.5615 177.8764 709 R 4.3983 8.5228 120.9466 58.6831 31.3901 176.0302 710 Q 5.1209 7.5867 113.1162 55.2129 32.5099 173.4183 711 C 4.6129 8.9621 118.0927 58.2168 35.4295 172.6823 712 L 4.9530 8.5748 125.9226 53.5559 43.7246 175.5174 713 V 5.6661 8.7478 121.9556 60.5703 34.2568 174.5224 714 T 5.0941 8.5131 116.4888 60.1180 72.3913 172.3476 715 H 4.6498 8.7697 122.5050 54.2986 31.9615 173.4442 716 N 3.7894 9.4479 125.9965 54.4667 35.5582 175.7177 717 G 3.8948 8.5029 103.5310 45.3405 0.0000 173.3073 718 R 4.6272 7.4614 118.2519 53.5146 32.0306 175.1350 719 L 4.2694 8.6627 125.8293 55.9355 42.5518 175.9387 720 L 4.5723 8.9226 126.1255 56.6333 44.8941 175.6899 721 G 4.2009 7.5819 103.1120 45.9989 0.0000 171.3533 722 I 5.2150 8.3022 118.2485 59.8325 42.2710 174.8984 723 I 5.0395 8.9178 127.8440 60.0755 40.9853 175.3297 724 T 4.7792 8.9859 118.3840 60.2171 70.8895 175.7995 725 K 3.9147 8.6193 121.6846 59.6322 32.2398 178.4786 726 K 3.8663 8.0899 119.3689 59.6694 31.5375 177.9768 727 D 4.3385 7.9521 118.8261 57.5361 40.7242 179.1172 728 V 3.4719 7.5787 118.5210 65.7479 31.4774 178.1610 729 L 4.0423 7.7225 118.3251 57.4722 41.4988 179.3183 730 K 4.0529 7.9987 118.4202 59.2291 31.9695 178.8832 731 H 4.1358 7.8996 118.2476 59.3234 29.5586 177.4653 732 I 3.6983 7.4293 119.9735 64.1682 37.1039 178.0086 733 A 3.9391 7.7915 121.3136 55.0459 18.2094 179.4766 734 Q 3.8329 7.9940 118.1847 59.4883 28.9131 178.1326 735 M 4.0123 7.5967 117.9451 58.1473 32.2939 177.2868 736 A 3.5916 7.0895 118.4769 52.7979 18.5358 177.3009 737 N 5.0059 7.7746 114.1026 52.9724 40.4494 174.9563 738 Q 4.3617 8.1217 118.3794 56.2214 28.0790 176.5205 *744 L 4.4155 8.9185 128.1667 55.5855 43.5815 178.2765 745 F 4.4136 8.0650 119.0103 60.4063 39.4936 176.3747 746 N 4.5718 8.1791 114.6214 54.8393 38.7139 176.6695 747 E 4.0273 7.7595 119.8326 59.0323 29.5497 178.8063 748 F 4.3131 7.8424 120.4554 61.2115 39.2936 177.1218 749 L 3.5293 7.1017 117.7735 57.4835 41.6296 178.8434 750 E 3.9903 8.0506 119.0503 58.6025 29.1238 179.0955 751 V 3.6338 7.0484 117.6119 65.7223 31.6587 177.7715 752 L 3.9747 7.2975 116.3750 56.3806 41.3406 177.7774 753 F 4.4322 7.6007 118.8930 59.4769 40.7047 174.9975 754 Q 3.8358 8.6767 120.0529 56.6596 30.3780 173.1976 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 *578 H 8.43 4.75 0.00 2.95 2.79 0.00 7.16 0.00 0.00 0.00 0.00 6.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 579 K 8.69 4.35 0.00 1.97 1.84 0.00 1.55 0.00 0.00 1.68 0.00 0.00 2.83 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.38 1.51 7.81 580 T 8.86 4.26 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 1.33 0.00 0.00 581 L 9.55 4.95 0.00 1.59 1.56 0.93 0.88 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 0.00 582 A 8.91 3.96 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 0.00 583 M 7.57 4.21 0.00 2.30 2.20 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 2.59 2.68 0.00 584 D 8.04 4.52 0.00 2.76 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 0.00 585 V 7.57 4.05 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 0.82 0.00 0.00 0.79 0.00 0.00 586 M 7.23 4.46 0.00 2.23 2.06 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 2.60 2.71 0.00 587 K 8.71 4.78 0.00 1.72 1.69 0.00 1.67 0.00 0.00 1.64 0.00 0.00 2.92 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.35 1.43 7.81 588 P 0.00 4.74 0.00 1.95 2.00 0.00 3.68 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 2.10 0.00 589 R 8.32 4.24 0.00 1.85 1.90 0.00 3.31 0.00 0.00 3.34 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.60 0.00 590 R 8.49 4.04 0.00 1.80 1.89 0.00 3.36 0.00 0.00 3.28 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.63 0.00 591 N 8.72 4.17 0.00 2.96 2.95 0.00 0.00 6.13 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 0.00 592 D 7.35 4.84 0.00 2.86 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 0.00 593 P 0.00 4.36 0.00 2.10 2.04 0.00 3.73 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.15 0.00 594 L 8.26 4.18 0.00 1.66 1.63 0.94 0.97 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 0.00 595 L 8.33 3.88 0.00 1.61 1.61 0.96 0.90 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 0.00 596 T 8.34 4.39 4.48 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 0.00 0.00 1.36 0.00 0.00 597 V 8.13 4.82 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 0.76 0.00 0.00 0.94 0.00 0.00 598 L 8.76 4.85 0.00 1.48 1.58 0.91 0.69 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 0.00 599 T 8.31 5.14 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 1.23 0.00 0.00 600 Q 8.67 4.66 0.00 2.30 2.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.62 0.00 0.00 0.00 0.00 0.00 2.58 2.39 0.00 601 D 8.27 4.81 0.00 2.64 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 0.00 602 S 7.85 4.70 0.00 4.02 3.93 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 0.00 0.00 0.00 603 M 7.88 4.34 0.00 2.11 2.05 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.78 2.55 0.00 604 T 8.09 4.77 4.44 0.00 0.00 0.00 0.00 0.00 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 0.00 605 V 8.40 3.56 2.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.00 0.00 0.98 0.00 0.00 606 E 8.31 4.09 0.00 2.17 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 2.30 2.34 0.00 607 D 7.95 4.30 0.00 3.04 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 0.00 608 V 7.70 3.55 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 0.00 0.00 0.95 0.00 0.00 609 E 8.08 3.97 0.00 2.32 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 2.32 2.42 0.00 610 T 7.72 3.92 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 1.32 0.00 0.00 611 I 7.55 3.85 1.80 0.00 0.00 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.87 0.60 0.00 0.00 612 I 7.49 3.87 2.03 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 1.70 0.57 0.97 0.00 0.00 613 S 7.69 4.45 0.00 4.00 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 0.00 614 E 7.72 4.56 0.00 2.01 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 2.40 2.41 0.00 615 T 7.23 4.57 3.93 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 0.00 0.00 1.34 0.00 0.00 616 T 7.53 4.53 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 1.12 0.00 0.00 617 Y 7.34 4.45 0.00 2.70 2.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 618 S 8.85 4.21 0.00 3.95 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 619 G 7.19 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 620 F 8.07 4.97 0.00 2.77 2.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 621 P 0.00 5.10 0.00 2.15 2.10 0.00 3.84 0.00 0.00 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 2.37 0.00 622 V 8.99 4.80 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 0.23 0.00 0.00 0.67 0.00 0.00 623 V 8.43 4.83 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 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0.00 0.00 0.00 0.00 0.00 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 0.00 674 P 0.00 4.42 0.00 2.21 2.11 0.00 3.80 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.97 0.00 675 P 0.00 4.49 0.00 2.11 2.12 0.00 3.77 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 1.99 0.00 676 T 8.43 4.58 4.61 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 1.20 0.00 0.00 677 L 8.63 4.62 0.00 1.67 1.39 0.83 0.27 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 0.00 678 K 8.36 3.52 0.00 1.19 1.40 0.00 1.83 0.00 0.00 1.63 0.00 0.00 2.83 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.01 0.80 7.81 679 L 7.52 4.55 0.00 0.81 1.43 0.79 0.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 680 R 7.77 4.11 0.00 1.82 1.89 0.00 3.43 0.00 0.00 3.41 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.79 0.00 681 N 8.11 4.64 0.00 2.85 2.91 0.00 0.00 5.81 7.81 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2.43 0.00 698 I 7.66 3.95 2.04 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 1.54 0.76 0.93 0.00 0.00 699 V 7.67 3.67 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 1.19 0.00 0.00 1.00 0.00 0.00 700 V 8.19 3.59 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 0.95 0.00 0.00 0.94 0.00 0.00 701 D 7.70 4.30 0.00 3.11 2.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 702 I 7.85 3.64 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 1.48 0.65 0.69 0.00 0.00 703 F 8.47 3.78 0.00 3.30 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 0.00 704 R 7.80 3.92 0.00 2.03 1.99 0.00 3.27 0.00 0.00 3.22 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.82 0.00 705 K 8.03 4.10 0.00 1.67 1.82 0.00 1.67 0.00 0.00 1.68 0.00 0.00 3.00 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.44 1.54 7.81 706 L 7.98 4.24 0.00 1.23 1.22 0.47 1.03 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 0.00 707 G 7.74 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 0.00 708 L 7.50 3.94 0.00 0.69 1.24 0.06 -0.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 709 R 8.52 4.40 0.00 1.72 1.98 0.00 3.27 0.00 0.00 3.42 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.59 0.00 710 Q 7.59 5.12 0.00 1.85 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.68 6.64 0.00 0.00 0.00 0.00 0.00 1.79 1.41 0.00 711 C 8.96 4.61 0.00 2.70 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 0.00 712 L 8.57 4.95 0.00 1.64 1.54 0.90 0.68 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 0.00 713 V 8.75 5.67 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 0.99 0.00 0.00 0.95 0.00 0.00 714 T 8.51 5.09 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 0.00 715 H 8.77 4.65 0.00 3.41 3.22 0.00 5.93 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 0.00 716 N 9.45 3.79 0.00 2.65 2.78 0.00 0.00 7.29 7.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 717 G 8.50 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 718 R 7.46 4.63 0.00 2.05 1.84 0.00 3.17 0.00 0.00 3.17 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.52 0.00 719 L 8.66 4.27 0.00 1.57 1.72 1.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 720 L 8.92 4.57 0.00 1.72 1.61 0.93 1.27 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 0.00 721 G 7.58 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 0.00 0.00 0.00 722 I 8.30 5.22 1.85 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 1.34 0.88 0.00 0.00 723 I 8.92 5.04 1.99 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 1.27 0.58 0.77 0.00 0.00 724 T 8.99 4.78 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 1.23 0.00 0.00 725 K 8.62 3.91 0.00 2.07 1.88 0.00 1.72 0.00 0.00 1.61 0.00 0.00 2.91 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.44 1.52 7.81 726 K 8.09 3.87 0.00 1.86 1.80 0.00 1.80 0.00 0.00 1.82 0.00 0.00 2.94 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.50 1.53 7.81 727 D 7.95 4.34 0.00 2.91 2.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 728 V 7.58 3.47 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 0.79 0.00 0.00 0.02 0.00 0.00 729 L 7.72 4.04 0.00 1.83 1.68 0.91 0.72 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 0.00 730 K 8.00 4.05 0.00 1.82 1.83 0.00 1.66 0.00 0.00 1.56 0.00 0.00 2.88 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.44 1.61 7.81 731 H 7.90 4.14 0.00 3.20 3.46 0.00 5.78 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 732 I 7.43 3.70 1.88 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 1.51 0.83 1.06 0.00 0.00 733 A 7.79 3.94 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 0.00 734 Q 7.99 3.83 0.00 2.18 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.74 0.00 0.00 0.00 0.00 0.00 2.32 2.33 0.00 735 M 7.60 4.01 0.00 2.01 2.13 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 2.76 2.58 0.00 736 A 7.09 3.59 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 737 N 7.77 5.01 0.00 2.83 2.80 0.00 0.00 6.82 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 738 Q 8.12 4.36 0.00 2.19 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.17 6.65 0.00 0.00 0.00 0.00 0.00 2.32 2.43 0.00 *744 L 8.92 4.42 0.00 1.80 1.81 0.95 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 745 F 8.07 4.41 0.00 3.15 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 0.00 746 N 8.18 4.57 0.00 2.83 2.82 0.00 0.00 7.19 7.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 747 E 7.76 4.03 0.00 2.29 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 2.34 2.33 0.00 748 F 7.84 4.31 0.00 2.76 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 0.00 749 L 7.10 3.53 0.00 1.59 1.56 1.01 0.81 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 0.00 750 E 8.05 3.99 0.00 2.17 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 0.00 2.50 2.40 0.00 751 V 7.05 3.63 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.00 0.00 0.99 0.00 0.00 752 L 7.30 3.97 0.00 1.55 1.55 0.32 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.67 0.00 0.00 0.00 0.00 0.00 0.00 753 F 7.60 4.43 0.00 2.96 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 0.00 754 Q 8.68 3.84 0.00 2.25 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.08 6.32 0.00 0.00 0.00 0.00 0.00 2.11 2.11 0.00 * Residues marked with a * may have inaccurate shift predictions.