NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 516 E 4.3508 8.3033 121.7239 56.4126 31.5616 173.6540 517 C 4.7838 8.3588 115.3217 57.8895 32.7770 172.2371 518 I 4.2905 8.7010 120.9105 59.5592 40.6217 174.2774 519 S 5.0092 8.4928 121.8992 56.8802 63.5196 173.4260 520 V 4.3722 8.5121 126.3102 61.7094 33.3574 175.4223 521 K 4.1465 10.7193 130.6530 57.8446 30.1885 175.6484 522 G 3.9526 8.1912 100.1267 46.3614 0.0000 174.5837 523 R 4.4519 7.5796 116.4926 54.4602 34.8824 175.9424 524 I 4.5004 8.2168 125.4742 60.9357 38.1595 174.9192 525 Y 4.9737 9.0522 124.9070 56.0784 41.3458 174.6804 526 S 5.0511 9.0825 118.3529 56.7384 65.8350 173.3955 527 I 4.4766 7.8046 124.1043 60.7046 36.6545 175.9413 528 L 4.3060 8.8855 128.6173 57.0309 41.8954 177.5802 529 K 4.4728 7.7590 115.0864 56.2632 35.6671 173.2617 530 Q 4.6466 8.7440 122.2836 55.2989 30.0117 174.6964 531 I 3.9875 8.4114 128.0347 61.0725 37.8102 177.3006 532 G 3.6451 9.0207 115.8756 46.4425 0.0000 175.2726 533 S 4.3558 8.1635 109.6777 58.0323 63.3198 175.8358 534 G 4.1005 7.7795 117.3870 44.1112 0.0000 170.8631 535 G 3.9456 8.2484 108.0133 44.5463 0.0000 173.9370 536 S 4.2423 9.0031 119.9468 57.9589 63.1192 169.3450 537 S 5.1904 7.6145 115.3534 56.3905 65.4179 172.7410 538 K 4.7034 9.3004 125.3723 54.8452 36.7817 175.0839 539 V 4.7122 8.1160 123.8027 61.2069 34.1248 174.1485 540 F 5.3011 8.9717 125.8475 55.5260 42.6463 174.0890 541 Q 4.6973 9.2184 125.7816 56.2544 29.9943 175.2289 542 V 5.2048 9.1646 118.9161 59.8099 36.9493 174.1462 543 L 5.4882 8.8422 121.7054 53.1663 45.3242 177.1306 544 N 4.5008 8.9231 120.8117 51.4184 39.2520 175.1520 545 E 3.8177 8.5492 118.0183 59.4534 29.4565 177.6207 546 K 4.3409 8.0547 115.1611 55.7867 32.0092 176.4303 547 K 3.8959 7.8845 116.5255 57.5107 30.1927 175.5093 548 Q 4.2167 8.7637 118.0192 55.0951 29.6666 174.9626 549 I 4.6588 7.7427 122.5431 60.6784 39.2195 174.0384 550 Y 5.1189 9.2872 125.3492 56.5498 43.3550 173.4351 551 A 5.2091 9.4421 122.1080 50.3987 21.9216 175.3705 552 I 5.3844 9.0193 123.9470 58.6615 39.7743 174.8422 553 K 4.6712 8.7371 129.5602 55.9555 33.5536 174.4645 554 Y 5.3297 9.6638 129.6833 55.9605 41.2663 174.2924 555 V 4.3743 7.9142 125.8263 60.8228 34.7342 173.5623 556 N 4.7169 8.6194 127.6258 52.9323 39.4915 174.7195 557 L 4.5698 8.8887 125.1380 54.6330 42.6164 178.2262 558 E 3.9826 9.0071 119.3278 58.6596 29.4486 177.5956 559 E 4.4497 8.1080 115.4985 55.7140 30.0462 175.0305 560 A 4.2488 7.7895 123.7927 50.9146 19.4780 178.5079 561 D 4.6322 8.2486 123.5727 52.7894 42.0540 177.1496 562 N 4.2363 8.4305 116.1548 56.3832 38.4499 177.4093 563 Q 3.9596 7.9716 120.5351 59.3286 29.1319 178.3476 564 T 3.5538 9.0526 117.7333 66.4657 68.4173 176.4568 565 L 3.6690 7.6800 120.9499 57.8385 41.6794 179.0192 566 D 4.3105 8.4482 118.3221 57.5764 41.1547 178.6410 567 S 4.2670 8.0614 114.5303 61.4280 63.2180 176.0706 568 Y 4.2043 8.2638 120.6171 61.1356 37.5221 178.6564 569 R 3.9286 8.3207 119.1815 59.0834 30.1454 178.6564 570 N 4.3041 8.3097 117.0113 56.7197 38.9740 176.6452 571 E 4.1279 8.3998 120.7676 59.2828 29.7189 178.8174 572 I 3.4964 7.7776 119.8456 63.9408 37.0415 178.1855 573 A 3.9192 8.1993 121.8969 55.5306 18.2957 179.3842 574 Y 4.0607 8.0811 115.1374 60.9708 37.4192 178.4168 575 L 4.1658 8.3322 121.4204 58.3515 41.9924 178.4313 576 N 4.3507 7.9991 115.5352 56.5969 38.8877 176.4657 577 K 4.1172 7.8069 119.8949 59.5569 32.7955 178.6247 578 L 4.1189 8.6169 118.3637 56.2096 41.6767 178.9393 579 Q 3.9995 7.7572 118.6203 59.2456 28.7107 179.0779 580 Q 4.2660 8.0799 111.3258 57.5247 28.9700 176.0496 581 H 4.5906 8.1892 116.1147 57.2346 29.9919 175.5570 582 S 4.6325 7.7155 112.0541 56.7285 65.3031 173.4646 583 D 4.8268 8.7392 125.3447 53.8320 39.6009 176.5974 584 K 4.4521 8.1528 118.8513 56.8833 33.1644 175.7699 585 I 4.7136 7.1693 120.3973 59.1557 38.8899 175.6345 586 I 3.8427 7.9878 126.6647 61.4442 38.6595 175.2328 587 R 4.0512 9.0225 130.0806 55.9416 31.1532 174.7367 588 L 4.6092 8.9819 129.8952 53.8879 41.9694 175.4428 589 Y 4.3281 8.7852 125.8445 60.9411 38.6281 175.7038 590 D 4.6111 7.9567 115.5726 54.0654 44.5649 174.2125 591 Y 5.4189 8.0235 119.3965 55.7060 41.5792 173.4740 592 E 4.8270 9.7318 121.4696 54.5192 32.9296 174.3323 593 I 4.9679 8.5392 126.3575 59.8534 40.7959 173.8859 594 T 4.6918 7.8874 120.9450 60.1771 71.1383 172.9409 595 D 4.4526 8.5111 119.1615 57.0293 41.4294 177.3043 596 Q 4.5166 7.7921 117.7866 57.8121 30.4907 175.1718 597 Y 5.2480 7.0270 114.8984 56.0569 41.8726 173.6598 598 I 5.0857 8.6688 119.8810 59.7232 41.3365 174.3158 599 Y 5.5066 9.5206 123.6505 56.5691 41.3604 174.5337 600 M 5.0904 9.1736 123.1498 53.5408 35.5661 174.7909 601 V 4.2578 9.0159 125.4501 62.3700 32.9746 174.8233 602 M 5.5179 9.1540 126.8275 53.0030 36.7144 174.4065 603 E 4.6038 9.0389 122.1693 57.1765 30.4810 175.8021 604 C 4.5618 8.8339 126.5809 57.8138 32.7230 173.2050 605 G 4.1224 8.3326 115.7866 44.0272 0.0000 173.4116 606 N 4.4631 8.9323 118.2537 55.2939 38.9902 175.6689 607 I 4.4356 7.0761 116.0207 58.5820 41.2244 173.3159 608 D 4.9462 8.4450 126.0094 52.9203 41.6015 177.1774 609 L 4.0529 8.7398 123.2341 58.4116 42.0566 179.1579 610 N 4.4898 8.3142 116.5112 56.9931 39.1866 176.9182 611 S 4.2391 8.3231 116.1158 61.3557 62.6473 176.5771 612 W 4.2823 8.1016 129.9702 60.2942 30.5496 177.9194 613 L 3.9083 8.2704 118.3344 57.7236 41.1809 179.0638 614 K 4.1266 8.1094 117.5193 58.0801 33.3626 177.9129 615 K 4.4233 6.8260 117.5638 53.5046 31.4655 176.0101 616 K 3.9480 6.9249 113.7625 56.3855 36.3628 175.6685 617 K 4.0157 8.9109 126.2838 58.4410 32.4392 176.0566 618 S 4.7455 7.5147 109.9510 56.2742 66.2239 172.3383 619 I 4.5244 7.7568 118.6542 57.9130 40.8284 174.3050 620 D 4.3960 8.8241 125.6663 54.1898 42.0046 175.1053 621 P 4.2229 0.0000 0.0000 65.7529 31.3673 178.3158 622 W 4.0770 8.3484 126.4637 60.3921 30.6441 177.5520 623 E 3.3991 8.2260 119.5202 58.8505 28.9986 178.5156 624 R 3.8632 8.0824 119.0442 59.4481 30.1260 178.2933 625 K 3.8899 7.6667 119.9946 58.9265 32.2458 178.6340 626 S 3.7479 7.4708 113.2473 61.4708 62.1916 175.7170 627 Y 4.2914 8.0496 119.8369 60.8648 37.5785 178.2952 628 W 4.3337 8.5498 129.3857 60.3761 30.7303 178.0717 629 K 3.7263 8.0873 118.3595 59.5169 31.5027 178.7627 630 N 4.2119 7.8321 116.1231 56.7401 38.4190 177.2979 631 M 3.8028 7.7956 119.6584 58.2699 31.9913 178.8279 632 L 3.6366 7.2376 118.9618 57.5956 41.7271 179.1359 633 E 3.8699 8.1795 119.0480 59.1767 29.4096 178.8103 634 A 3.9475 8.1022 120.7274 55.2997 18.5354 179.8777 635 V 3.4592 7.9976 117.0393 66.0981 31.5915 177.4008 636 H 4.0336 8.6182 118.4453 59.7927 29.1566 177.1562 637 T 3.7961 7.7892 117.3847 66.6799 68.2693 176.7070 638 I 3.3273 7.3877 114.9902 64.0606 37.5034 177.9304 639 H 4.2604 8.1260 118.0590 58.8695 28.3504 177.6188 640 Q 4.0570 7.9904 118.2201 57.9404 28.4086 176.8804 641 H 4.6946 7.3161 116.0839 55.4046 29.1540 175.2975 642 G 3.8355 8.2327 106.9697 45.4855 0.0000 173.9391 643 I 3.9617 7.4694 121.0977 59.6316 37.8733 175.2273 644 V 4.2518 7.9895 125.4536 61.2084 33.0640 174.8091 645 H 4.3252 9.7400 127.5161 58.7125 29.8179 177.1951 646 S 4.2603 9.5505 110.3503 58.7617 62.2967 170.3744 647 D 4.7754 7.7208 119.4741 53.0773 41.2542 175.1541 648 L 4.2368 8.0597 118.0950 54.2805 42.6651 176.8077 649 K 3.9886 8.6785 120.4857 54.7660 35.7222 174.8490 650 P 4.4045 0.0000 0.0000 65.8326 31.4000 178.7392 651 A 4.2535 7.9799 119.6405 55.0758 18.5670 177.8788 652 N 4.4126 8.5865 112.4894 54.4177 38.8488 174.3788 653 F 5.4296 8.1615 117.7427 55.3914 42.8555 173.9689 654 L 4.9590 8.6177 123.1314 53.2878 45.5800 175.2621 655 I 4.2740 8.7821 127.5754 60.7019 38.1983 175.3926 656 V 4.3297 8.6975 126.8571 61.6344 32.9660 174.7899 657 D 4.2510 9.2926 130.1003 55.6199 37.8056 174.0807 658 G 4.1007 8.1133 98.8066 46.9272 0.0000 172.8682 659 M 5.0406 7.5243 116.2808 53.0135 36.3661 174.9891 660 L 4.5748 8.8059 123.3589 54.2381 42.9016 176.5418 661 K 4.8766 8.9320 122.7295 54.2158 36.1497 175.2442 662 L 4.2935 9.0053 127.7927 55.1956 42.4943 177.0387 663 I 4.3443 8.2348 120.0585 61.3005 38.5526 175.1647 664 D 4.2910 7.5987 120.4694 52.5201 42.0996 174.8246 665 F 4.8619 9.7967 118.5705 56.9027 39.4931 177.1639 666 G 3.7834 7.9388 107.7316 46.3884 0.0000 175.0679 667 I 3.8991 7.8969 121.9062 63.1598 37.6374 176.8956 668 A 4.2291 8.3552 122.8164 52.8886 19.4920 176.3484 669 N 4.9221 8.3644 122.0969 53.1268 37.5281 178.5167 670 Q 4.1822 8.5696 113.3451 56.0590 25.9461 175.4558 671 M 4.5833 7.5285 121.0686 57.1293 33.0637 176.6215 *684 V 3.8769 7.4055 122.2205 61.0499 32.7938 176.2161 685 G 4.0368 8.3002 121.2197 46.3596 0.0000 171.3430 686 T 4.3553 7.8623 114.7240 63.3393 72.2197 173.0506 687 V 4.4787 8.0235 122.8360 62.6971 32.3187 176.9848 688 N 4.3495 8.3631 116.5923 55.5379 38.3951 175.2125 689 Y 4.6944 7.8823 113.3508 57.6649 38.8071 175.1843 690 M 4.3349 7.7822 121.7022 54.3442 32.9927 174.2167 691 P 2.9700 0.0000 0.0000 61.1692 32.6750 175.3522 692 P 3.8872 0.0000 0.0000 65.6720 31.0054 178.8311 693 E 3.8730 7.8110 115.4042 58.9848 29.3162 178.8631 694 A 3.9710 7.3719 121.4882 54.6433 18.4319 179.3167 695 I 3.8426 7.2372 117.2096 64.2900 37.6450 178.0564 696 K 4.0481 7.9719 118.3368 58.6060 33.1562 177.5411 697 D 4.6928 7.4080 119.6040 53.0947 39.3346 176.0662 698 M 4.6356 7.3237 123.1644 54.0319 33.7049 175.5084 *711 I 3.8816 7.8408 119.1348 61.2983 38.3667 175.2952 712 S 4.5849 8.5236 119.3463 55.4296 65.7422 172.5758 713 P 4.1070 0.0000 0.0000 66.0192 30.7930 178.7705 714 K 4.1103 7.9751 117.0410 59.3511 31.4569 179.2609 715 S 4.3256 8.2490 115.6943 62.0030 62.6973 176.5689 716 D 4.5256 8.0280 120.8675 57.1986 40.5302 178.9789 717 V 3.7173 7.8514 118.5296 65.6576 31.5381 177.4963 718 W 4.3568 8.2850 127.6478 60.8346 30.4975 178.1151 719 S 4.5555 8.2268 114.3411 61.7932 62.3266 176.4291 720 L 4.3291 8.4786 122.0526 58.1268 41.3544 179.7766 721 G 3.7272 8.9085 105.7167 48.3352 0.0000 175.5002 722 C 4.1429 8.3644 119.2238 62.4737 28.2258 176.2978 723 I 4.2294 8.3802 121.8787 64.1974 36.6151 178.3090 724 L 3.9174 8.4074 121.3707 58.2775 41.9357 177.9220 725 Y 4.0127 8.1634 119.8615 61.2041 38.5137 177.8243 726 Y 4.7241 8.2658 121.3324 60.8004 38.7780 177.9884 727 M 3.9168 7.7981 117.6669 58.0815 32.0265 178.6827 728 T 3.7967 7.7714 116.0281 65.9879 68.8614 175.7883 729 Y 4.5867 8.2208 116.4665 56.9906 38.0759 177.2364 730 G 4.0706 9.1675 108.3156 45.4135 0.0000 173.7404 731 K 4.7736 7.6666 117.2324 55.6871 35.7694 175.5260 732 T 4.1597 8.5507 111.6187 60.6539 69.6630 173.7178 733 P 3.2541 0.0000 0.0000 65.2922 31.1280 178.4269 734 F 4.7864 7.5665 115.0680 57.1539 39.4496 177.8536 735 Q 3.9525 7.7871 125.0507 58.9410 28.9648 177.5270 736 Q 4.0385 7.9488 114.8634 58.4101 28.8590 176.3514 737 I 4.1364 7.1955 120.0633 59.8732 35.7366 175.4151 738 I 3.7501 8.0592 119.6570 63.1502 38.0733 177.0842 739 N 4.4867 8.0472 120.1405 53.0920 39.5372 175.3428 740 Q 4.0620 8.6696 127.9297 59.0303 28.9363 178.6807 741 I 3.7444 7.7989 120.5092 64.3207 37.1612 178.4942 742 S 4.0270 7.9633 115.7383 61.3519 62.7021 176.2345 743 K 3.7346 8.3073 122.7806 59.9187 31.7126 178.6107 744 L 3.8378 7.8421 118.7384 57.9873 41.1168 179.3636 745 H 4.0060 8.0733 115.6040 58.6504 28.4158 177.4970 746 A 3.9188 8.2736 121.8440 55.3893 18.2152 179.4855 747 I 3.0295 7.1231 117.2841 63.4295 37.1744 177.7252 748 I 4.2623 7.0559 110.9415 59.8423 38.2261 174.9059 749 D 4.6829 7.3854 121.8191 52.2231 41.1963 174.6868 750 P 4.3328 0.0000 0.0000 65.9679 31.3917 177.7134 751 N 4.4583 8.2727 112.6425 54.9773 38.6283 174.9122 752 H 4.5629 8.0189 118.9335 54.7197 28.6211 173.2736 753 E 4.4088 8.2646 125.0057 55.2024 30.4202 176.8736 754 I 3.6943 8.2267 124.5869 60.7220 37.9613 175.2149 755 E 4.1899 8.0398 125.6329 55.6391 30.4497 176.5299 756 F 4.4785 8.1271 123.2976 53.9489 39.4046 171.7992 757 P 4.2045 0.0000 0.0000 62.5037 32.0165 176.3192 758 D 4.8616 8.9812 121.9588 54.2529 41.2864 175.9330 759 I 4.7368 7.8603 114.6849 58.3649 40.9708 173.2622 760 P 4.2851 0.0000 0.0000 66.1063 31.4018 178.1991 761 E 4.2795 7.8811 122.0757 55.5233 28.7782 177.3317 762 K 4.0737 8.3636 124.6370 58.8221 32.2590 178.7964 763 D 4.3434 8.0388 119.1964 57.2274 40.9107 177.9915 764 L 2.8818 7.8238 120.2694 57.9955 41.7867 178.5006 765 Q 3.8707 7.6830 118.7912 59.2859 28.8933 177.9873 766 D 4.1498 7.8356 118.8399 57.2004 41.3042 178.1725 767 V 3.3622 7.6703 118.8939 66.0229 31.5292 178.0094 768 L 3.9408 7.6629 118.4478 57.7239 41.2559 179.6640 769 K 3.3325 7.3605 117.2791 59.4028 31.6769 178.9584 770 C 4.3023 8.1036 117.0222 63.0527 27.8448 175.9856 771 C 4.3827 8.0375 117.2631 61.9988 27.7710 174.8491 772 L 4.1170 7.4914 118.7515 53.3436 42.7093 176.5857 773 K 4.5137 7.8566 119.2298 55.4770 32.6894 177.2604 774 R 4.0355 9.0928 124.0562 59.1724 30.4362 176.6714 775 D 4.5156 8.1037 118.2982 53.0437 41.3317 174.4630 776 P 4.3415 0.0000 0.0000 65.7803 31.6716 177.9471 777 K 4.1201 8.0437 116.1127 59.6957 31.9832 178.5348 778 Q 4.1560 7.9897 115.5663 58.0715 29.0591 176.5439 779 R 4.3864 7.5626 118.4905 55.9903 30.7780 176.2306 780 I 4.2751 7.9479 124.9494 61.1155 39.0274 175.7516 781 S 4.6292 8.8308 123.3317 57.5834 65.1013 175.4925 782 I 3.7269 8.4314 120.1634 64.1523 36.6291 176.8365 783 P 4.2079 0.0000 0.0000 65.5646 31.4899 178.1403 784 E 4.1560 7.9854 117.2792 59.5497 29.2956 179.4644 785 L 4.2101 8.0333 118.8312 57.7049 41.4293 179.4419 786 L 4.0244 7.9418 117.6242 56.6864 41.7072 177.5050 787 A 4.5051 7.4780 119.0731 52.0080 19.8726 176.7999 788 H 4.3255 7.8217 117.0922 55.1845 30.7771 174.2098 789 P 4.2550 0.0000 0.0000 65.9712 31.1681 177.7133 790 Y 4.2899 8.5745 118.5287 60.6077 38.5675 178.1285 791 V 3.9068 7.7087 110.0512 62.1006 32.6259 176.9718 792 Q 4.2977 7.9618 117.4635 57.6078 29.6230 176.1348 793 I 3.9777 7.8271 119.2004 60.6632 37.5531 176.1802 794 Q 4.1790 8.6510 122.6139 56.4303 28.6497 175.8210 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 516 E 8.30 4.35 0.00 2.00 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 2.30 0.00 517 C 8.36 4.78 0.00 2.83 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 0.00 518 I 8.70 4.29 1.60 0.00 0.00 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.71 0.47 -0.10 0.00 0.00 519 S 8.49 5.01 0.00 3.84 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 520 V 8.51 4.37 2.17 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 1.04 0.00 0.00 0.66 0.00 0.00 521 K 10.72 4.15 0.00 1.96 1.85 0.00 1.90 0.00 0.00 1.72 0.00 0.00 2.88 0.00 0.00 2.76 0.00 0.00 0.00 0.00 1.42 1.82 7.81 522 G 8.19 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 0.00 0.00 0.00 523 R 7.58 4.45 0.00 1.99 1.36 0.00 3.11 0.00 0.00 3.01 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.56 0.00 524 I 8.22 4.50 1.75 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.68 0.84 0.00 0.00 525 Y 9.05 4.97 0.00 2.72 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 0.00 526 S 9.08 5.05 0.00 3.84 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 0.00 527 I 7.80 4.48 1.77 0.00 0.00 0.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 0.33 1.00 0.00 0.00 528 L 8.89 4.31 0.00 1.71 1.77 0.95 0.69 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 0.00 529 K 7.76 4.47 0.00 1.83 1.91 0.00 1.52 0.00 0.00 1.78 0.00 0.00 2.94 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.48 1.43 7.81 530 Q 8.74 4.65 0.00 2.11 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.54 6.88 0.00 0.00 0.00 0.00 0.00 2.36 2.19 0.00 531 I 8.41 3.99 1.83 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 1.18 0.69 0.91 0.00 0.00 532 G 9.02 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 533 S 8.16 4.36 0.00 3.91 3.83 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 0.00 0.00 0.00 534 G 7.78 4.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 535 G 8.25 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 0.00 0.00 0.00 536 S 9.00 4.24 0.00 4.22 4.31 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 0.00 537 S 7.61 5.19 0.00 3.79 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 538 K 9.30 4.70 0.00 1.72 1.13 0.00 1.74 0.00 0.00 1.69 0.00 0.00 3.10 0.00 0.00 3.20 0.00 0.00 0.00 0.00 1.36 1.55 7.81 539 V 8.12 4.71 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 1.07 0.00 0.00 0.87 0.00 0.00 540 F 8.97 5.30 0.00 3.01 2.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 541 Q 9.22 4.70 0.00 2.19 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 6.67 0.00 0.00 0.00 0.00 0.00 2.40 2.39 0.00 542 V 9.16 5.20 2.28 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 0.72 0.00 0.00 1.08 0.00 0.00 543 L 8.84 5.49 0.00 1.60 1.55 0.93 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 544 N 8.92 4.50 0.00 2.60 3.06 0.00 0.00 6.39 7.39 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 0.00 545 E 8.55 3.82 0.00 1.83 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 2.25 2.29 0.00 546 K 8.05 4.34 0.00 1.78 1.79 0.00 1.94 0.00 0.00 1.70 0.00 0.00 2.97 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.38 1.42 7.81 547 K 7.88 3.90 0.00 1.91 1.89 0.00 1.70 0.00 0.00 1.70 0.00 0.00 3.00 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.36 1.53 7.81 548 Q 8.76 4.22 0.00 2.26 1.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.96 6.93 0.00 0.00 0.00 0.00 0.00 2.27 2.26 0.00 549 I 7.74 4.66 1.80 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 1.32 0.91 0.79 0.00 0.00 550 Y 9.29 5.12 0.00 2.88 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 0.00 551 A 9.44 5.21 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 552 I 9.02 5.38 1.95 0.00 0.00 0.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.87 0.18 1.05 0.00 0.00 553 K 8.74 4.67 0.00 1.84 1.69 0.00 1.58 0.00 0.00 1.61 0.00 0.00 2.59 0.00 0.00 2.73 0.00 0.00 0.00 0.00 1.43 1.38 7.81 554 Y 9.66 5.33 0.00 3.46 3.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 555 V 7.91 4.37 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 0.86 0.00 0.00 0.69 0.00 0.00 556 N 8.62 4.72 0.00 2.76 2.68 0.00 0.00 7.17 7.34 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 0.00 557 L 8.89 4.57 0.00 1.93 1.62 0.89 1.16 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 0.00 558 E 9.01 3.98 0.00 2.07 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.37 2.33 0.00 559 E 8.11 4.45 0.00 1.93 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 2.23 2.22 0.00 560 A 7.79 4.25 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 561 D 8.25 4.63 0.00 2.90 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 0.00 562 N 8.43 4.24 0.00 2.71 2.86 0.00 0.00 6.45 7.74 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 0.00 563 Q 7.97 3.96 0.00 2.07 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.91 0.00 0.00 0.00 0.00 0.00 2.38 2.42 0.00 564 T 9.05 3.55 4.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.35 0.00 0.00 565 L 7.68 3.67 0.00 1.74 1.63 0.85 1.01 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 0.00 566 D 8.45 4.31 0.00 2.82 2.82 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 0.00 0.00 0.00 567 S 8.06 4.27 0.00 4.35 4.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 568 Y 8.26 4.20 0.00 3.11 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 0.00 569 R 8.32 3.93 0.00 2.02 1.96 0.00 3.19 0.00 0.00 3.08 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.72 0.00 570 N 8.31 4.30 0.00 2.97 3.05 0.00 0.00 6.83 7.05 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 0.00 571 E 8.40 4.13 0.00 2.10 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 2.10 2.19 0.00 572 I 7.78 3.50 1.77 0.00 0.00 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.62 0.09 0.00 0.00 573 A 8.20 3.92 1.23 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 0.00 0.00 0.00 574 Y 8.08 4.06 0.00 3.32 3.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 575 L 8.33 4.17 0.00 1.57 1.62 0.81 0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 576 N 8.00 4.35 0.00 2.96 3.06 0.00 0.00 7.26 6.02 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 0.00 577 K 7.81 4.12 0.00 1.89 1.98 0.00 1.74 0.00 0.00 1.65 0.00 0.00 3.09 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.41 1.51 7.81 578 L 8.62 4.12 0.00 1.77 1.65 0.46 0.42 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 0.00 579 Q 7.76 4.00 0.00 2.34 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.07 6.91 0.00 0.00 0.00 0.00 0.00 2.36 2.56 0.00 580 Q 8.08 4.27 0.00 2.15 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.61 6.93 0.00 0.00 0.00 0.00 0.00 2.28 2.29 0.00 581 H 8.19 4.59 0.00 3.31 3.43 0.00 5.82 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 582 S 7.72 4.63 0.00 3.93 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 583 D 8.74 4.83 0.00 2.83 2.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 584 K 8.15 4.45 0.00 1.74 1.88 0.00 1.64 0.00 0.00 1.65 0.00 0.00 2.83 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.58 1.60 7.81 585 I 7.17 4.71 1.94 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.91 1.11 0.00 0.00 586 I 7.99 3.84 1.82 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 1.08 0.60 0.81 0.00 0.00 587 R 9.02 4.05 0.00 1.83 1.63 0.00 3.12 0.00 0.00 2.94 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.68 0.00 588 L 8.98 4.61 0.00 1.57 1.57 1.06 0.94 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 0.00 589 Y 8.79 4.33 0.00 3.02 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 0.00 590 D 7.96 4.61 0.00 2.78 2.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 591 Y 8.02 5.42 0.00 3.10 2.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 592 E 9.73 4.83 0.00 2.20 2.20 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 2.43 2.35 0.00 593 I 8.54 4.97 1.98 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 1.38 1.01 1.09 0.00 0.00 594 T 7.89 4.69 4.02 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 0.86 0.00 0.00 595 D 8.51 4.45 0.00 2.65 2.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 596 Q 7.79 4.52 0.00 2.22 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.45 6.55 0.00 0.00 0.00 0.00 0.00 2.42 2.39 0.00 597 Y 7.03 5.25 0.00 2.95 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 0.00 598 I 8.67 5.09 1.77 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 1.18 0.62 0.95 0.00 0.00 599 Y 9.52 5.51 0.00 3.02 2.83 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 0.00 0.00 0.00 600 M 9.17 5.09 0.00 1.95 1.96 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.40 0.00 601 V 9.02 4.26 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 0.50 0.00 0.00 0.60 0.00 0.00 602 M 9.15 5.52 0.00 1.99 2.06 0.00 0.00 0.00 0.00 0.00 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.69 2.46 0.00 603 E 9.04 4.60 0.00 2.09 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 2.40 2.40 0.00 604 C 8.83 4.56 0.00 2.90 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 0.00 605 G 8.33 4.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 606 N 8.93 4.46 0.00 2.76 2.90 0.00 0.00 6.69 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 0.00 607 I 7.08 4.44 1.95 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.99 0.96 0.00 0.00 608 D 8.45 4.95 0.00 3.05 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 0.00 609 L 8.74 4.05 0.00 1.77 2.08 0.97 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 610 N 8.31 4.49 0.00 3.07 3.07 0.00 0.00 7.22 7.63 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 0.00 611 S 8.32 4.24 0.00 4.22 3.99 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 0.00 612 W 8.10 4.28 0.00 3.32 3.50 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 0.00 613 L 8.27 3.91 0.00 1.93 1.53 1.01 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 0.00 0.00 0.00 0.00 0.00 0.00 614 K 8.11 4.13 0.00 1.95 1.95 0.00 1.74 0.00 0.00 1.84 0.00 0.00 3.15 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.62 1.79 7.81 615 K 6.83 4.42 0.00 1.91 1.81 0.00 1.66 0.00 0.00 1.75 0.00 0.00 2.96 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.43 1.37 7.81 616 K 6.92 3.95 0.00 1.44 1.27 0.00 0.61 0.00 0.00 1.27 0.00 0.00 2.77 0.00 0.00 2.81 0.00 0.00 0.00 0.00 0.86 0.59 7.81 617 K 8.91 4.02 0.00 1.64 1.77 0.00 1.58 0.00 0.00 1.73 0.00 0.00 2.95 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.39 1.45 7.81 618 S 7.51 4.75 0.00 3.90 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 0.00 619 I 7.76 4.52 1.84 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 1.39 1.19 0.92 0.00 0.00 620 D 8.82 4.40 0.00 2.92 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 0.00 621 P 0.00 4.22 0.00 2.26 2.34 0.00 3.70 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 2.14 2.17 0.00 622 W 8.35 4.08 0.00 3.34 3.43 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 0.00 623 E 8.23 3.40 0.00 2.07 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.47 0.00 624 R 8.08 3.86 0.00 1.92 2.12 0.00 3.18 0.00 0.00 2.98 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.67 0.00 625 K 7.67 3.89 0.00 1.63 1.65 0.00 1.50 0.00 0.00 1.41 0.00 0.00 2.28 0.00 0.00 2.76 0.00 0.00 0.00 0.00 1.06 0.49 7.81 626 S 7.47 3.75 0.00 2.84 3.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 627 Y 8.05 4.29 0.00 3.08 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 0.00 628 W 8.55 4.33 0.00 3.56 3.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 629 K 8.09 3.73 0.00 1.96 1.75 0.00 1.59 0.00 0.00 1.56 0.00 0.00 3.01 0.00 0.00 2.75 0.00 0.00 0.00 0.00 1.38 1.57 7.81 630 N 7.83 4.21 0.00 2.87 2.99 0.00 0.00 7.11 6.94 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 0.00 631 M 7.80 3.80 0.00 1.59 1.77 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 2.19 0.99 0.00 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0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 7.34 0.00 0.00 0.00 0.00 0.00 2.28 2.31 0.00 641 H 7.32 4.69 0.00 2.81 3.34 0.00 5.89 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 642 G 8.23 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 0.00 643 I 7.47 3.96 1.63 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 0.47 0.04 0.66 0.00 0.00 644 V 7.99 4.25 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.90 0.00 0.00 0.86 0.00 0.00 645 H 9.74 4.33 0.00 3.23 3.47 0.00 5.77 0.00 0.00 0.00 0.00 6.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 646 S 9.55 4.26 0.00 4.19 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 0.00 647 D 7.72 4.78 0.00 2.70 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 0.00 648 L 8.06 4.24 0.00 1.75 1.66 1.07 0.70 0.00 0.00 0.00 0.00 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722 C 8.36 4.14 0.00 3.42 2.89 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 0.00 723 I 8.38 4.23 2.29 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.61 1.09 0.00 0.00 724 L 8.41 3.92 0.00 1.42 1.30 0.58 -0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 725 Y 8.16 4.01 0.00 3.19 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 0.00 726 Y 8.27 4.72 0.00 3.30 3.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 727 M 7.80 3.92 0.00 2.09 2.22 0.00 0.00 0.00 0.00 0.00 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.86 2.64 0.00 728 T 7.77 3.80 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.00 0.00 729 Y 8.22 4.59 0.00 2.73 2.73 0.00 0.00 0.00 0.00 0.00 0.00 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 G 9.17 4.07 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 0.00 0.00 0.00 731 K 7.67 4.77 0.00 1.95 1.96 0.00 1.34 0.00 0.00 1.71 0.00 0.00 3.00 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.60 1.52 7.81 732 T 8.55 4.16 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 0.60 0.00 0.00 733 P 0.00 3.25 0.00 1.06 0.95 0.00 3.31 0.00 0.00 3.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.72 0.00 734 F 7.57 4.79 0.00 2.98 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 0.00 735 Q 7.79 3.95 0.00 2.09 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.43 7.01 0.00 0.00 0.00 0.00 0.00 2.34 2.23 0.00 736 Q 7.95 4.04 0.00 2.19 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 7.03 0.00 0.00 0.00 0.00 0.00 2.34 2.32 0.00 737 I 7.20 4.14 1.91 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.64 0.98 0.00 0.00 738 I 8.06 3.75 1.87 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 1.30 0.40 0.91 0.00 0.00 739 N 8.05 4.49 0.00 2.77 2.74 0.00 0.00 7.25 7.12 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 0.00 740 Q 8.67 4.06 0.00 2.09 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.68 0.00 0.00 0.00 0.00 0.00 2.44 2.39 0.00 741 I 7.80 3.74 1.98 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 1.63 1.04 0.89 0.00 0.00 742 S 7.96 4.03 0.00 4.01 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 0.00 743 K 8.31 3.73 0.00 1.87 1.95 0.00 1.61 0.00 0.00 1.78 0.00 0.00 3.18 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.33 1.50 7.81 744 L 7.84 3.84 0.00 1.70 1.59 0.87 1.08 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 0.00 745 H 8.07 4.01 0.00 3.35 3.33 0.00 5.83 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 746 A 8.27 3.92 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 747 I 7.12 3.03 1.62 0.00 0.00 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.48 -0.36 0.62 0.00 0.00 748 I 7.06 4.26 1.75 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 1.49 0.48 0.80 0.00 0.00 749 D 7.39 4.68 0.00 2.88 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 0.00 750 P 0.00 4.33 0.00 2.11 2.16 0.00 3.75 0.00 0.00 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.15 0.00 751 N 8.27 4.46 0.00 2.86 2.90 0.00 0.00 6.79 8.16 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 0.00 752 H 8.02 4.56 0.00 3.37 3.61 0.00 5.94 0.00 0.00 0.00 0.00 6.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 753 E 8.26 4.41 0.00 2.01 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 2.37 2.37 0.00 754 I 8.23 3.69 1.76 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.74 0.47 -0.00 0.00 0.00 755 E 8.04 4.19 0.00 1.74 1.56 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 2.10 2.22 0.00 756 F 8.13 4.48 0.00 3.01 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 0.00 757 P 0.00 4.20 0.00 2.09 1.96 0.00 2.33 0.00 0.00 3.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.86 0.00 758 D 8.98 4.86 0.00 2.66 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 0.00 759 I 7.86 4.74 1.78 0.00 0.00 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.68 0.95 0.00 0.00 760 P 0.00 4.29 0.00 2.05 2.17 0.00 3.63 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.12 0.00 761 E 7.88 4.28 0.00 1.96 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.45 2.40 0.00 762 K 8.36 4.07 0.00 1.76 1.84 0.00 1.68 0.00 0.00 1.90 0.00 0.00 2.97 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.67 1.47 7.81 763 D 8.04 4.34 0.00 2.84 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 0.00 764 L 7.82 2.88 0.00 1.27 1.64 0.00 0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 0.00 0.00 0.00 0.00 765 Q 7.68 3.87 0.00 2.14 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.58 0.00 0.00 0.00 0.00 0.00 2.29 2.44 0.00 766 D 7.84 4.15 0.00 2.93 2.83 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 0.00 0.00 0.00 767 V 7.67 3.36 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 0.68 0.00 0.00 0.64 0.00 0.00 768 L 7.66 3.94 0.00 1.96 2.09 0.81 0.35 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 0.00 769 K 7.36 3.33 0.00 1.55 1.50 0.00 1.42 0.00 0.00 1.36 0.00 0.00 2.69 0.00 0.00 2.78 0.00 0.00 0.00 0.00 0.30 0.79 7.81 770 C 8.10 4.30 0.00 3.08 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 C 8.04 4.38 0.00 2.95 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 0.00 772 L 7.49 4.12 0.00 1.74 1.27 0.67 -0.35 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 0.00 773 K 7.86 4.51 0.00 1.87 1.87 0.00 1.99 0.00 0.00 1.75 0.00 0.00 3.02 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.48 1.79 7.81 774 R 9.09 4.04 0.00 1.89 2.02 0.00 3.29 0.00 0.00 3.21 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 1.87 0.00 775 D 8.10 4.52 0.00 2.71 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 0.00 776 P 0.00 4.34 0.00 2.09 2.14 0.00 3.75 0.00 0.00 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.26 0.00 777 K 8.04 4.12 0.00 1.86 1.90 0.00 1.71 0.00 0.00 1.71 0.00 0.00 3.00 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.49 1.44 7.81 778 Q 7.99 4.16 0.00 2.23 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.98 0.00 0.00 0.00 0.00 0.00 2.54 2.32 0.00 779 R 7.56 4.39 0.00 2.24 2.07 0.00 3.54 0.00 0.00 3.49 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.99 0.00 780 I 7.95 4.28 1.93 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 1.18 1.00 0.00 0.00 781 S 8.83 4.63 0.00 4.02 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 0.00 782 I 8.43 3.73 1.93 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 1.71 1.17 0.82 0.00 0.00 783 P 0.00 4.21 0.00 2.03 2.12 0.00 3.72 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.22 0.00 784 E 7.99 4.16 0.00 2.19 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.37 2.39 0.00 785 L 8.03 4.21 0.00 1.93 1.87 1.14 0.66 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 0.00 786 L 7.94 4.02 0.00 1.76 1.69 0.67 0.47 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 0.00 787 A 7.48 4.51 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 788 H 7.82 4.33 0.00 3.24 3.42 0.00 5.61 0.00 0.00 0.00 0.00 6.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 789 P 0.00 4.25 0.00 2.30 2.10 0.00 3.01 0.00 0.00 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.04 0.00 790 Y 8.57 4.29 0.00 3.05 3.14 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 0.00 791 V 7.71 3.91 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 1.03 0.00 0.00 1.16 0.00 0.00 792 Q 7.96 4.30 0.00 2.04 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.96 0.00 0.00 0.00 0.00 0.00 2.42 2.32 0.00 793 I 7.83 3.98 1.98 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 0.47 0.92 0.00 0.00 794 Q 8.65 4.18 0.00 2.19 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.87 6.65 0.00 0.00 0.00 0.00 0.00 2.34 2.37 0.00 * Residues marked with a * may have inaccurate shift predictions.