NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 526 M 4.5095 8.3049 120.3267 55.2610 33.2902 174.5925 527 V 4.3551 8.0217 116.1531 58.2062 35.5198 173.0551 528 P 4.4625 0.0000 0.0000 61.8959 32.9182 175.9934 529 A 4.1509 8.2915 122.5131 52.5172 18.9278 176.9391 530 A 4.4712 7.8267 120.8633 51.3939 21.8286 176.3483 531 L 4.3792 8.3592 120.6262 53.0368 42.7317 175.5973 532 P 4.2436 0.0000 0.0000 63.0073 31.5510 175.9439 533 Q 4.1521 8.4636 121.7384 55.3124 28.7313 175.8042 534 L 4.3011 8.3511 125.8121 54.8762 42.4204 176.4483 535 T 4.7226 8.1522 110.3336 59.1889 72.1588 172.8481 536 P 4.6525 0.0000 0.0000 62.0435 30.0244 176.1312 537 T 4.7256 7.1050 110.0872 59.6898 73.7587 174.7774 538 L 4.0331 8.3694 122.6245 58.0062 41.7836 180.1918 539 V 3.6404 8.2665 119.1950 64.7444 31.1055 178.3924 540 S 4.2592 7.8871 114.0439 61.1453 62.2462 175.9592 541 L 3.9991 7.7228 122.8024 58.1549 41.7478 178.7627 542 L 4.0999 8.3042 119.2873 58.0515 41.3070 179.4346 543 E 4.0642 8.1934 117.6285 59.4678 29.4654 179.4173 544 V 3.9418 7.4650 111.9088 63.4196 31.8676 177.7256 545 I 4.2750 7.7487 110.6361 60.2777 38.1745 175.7016 546 E 4.0222 7.5194 123.2320 55.6268 29.8696 174.7840 547 P 4.4849 0.0000 0.0000 62.3569 32.1193 176.1662 548 E 4.2001 8.4718 120.6551 55.9198 30.1330 177.1984 549 V 3.7160 8.1984 121.8580 62.9836 32.1565 175.8285 550 L 4.5632 8.3243 126.7957 54.2989 42.7965 175.6715 551 Y 4.4716 8.3971 118.4851 56.4431 39.5816 176.1619 552 A 4.0374 9.4956 127.0574 53.4302 18.9767 177.8615 553 G 3.7370 8.4278 104.3487 46.1712 0.0000 171.9058 *557 S 4.0766 7.7319 111.8821 57.8670 63.4455 173.4172 558 V 3.5174 8.5289 126.8262 62.9402 31.5461 174.0176 559 P 4.4994 0.0000 0.0000 63.0045 31.8221 175.5107 560 D 4.8570 8.4698 118.4022 54.2742 41.1832 176.8126 561 S 4.6544 7.6898 113.1910 55.6414 65.7620 173.8762 562 A 3.7143 8.4060 130.7039 55.1181 17.9390 179.6477 563 W 4.2208 7.3460 116.6863 60.0372 29.1951 178.8997 564 R 4.0030 8.0204 117.5962 59.0990 29.5025 179.0619 565 I 3.5725 7.8850 119.7709 64.6718 37.0942 178.2345 566 M 3.8845 8.2031 119.7511 58.7386 31.7721 178.9598 567 T 3.8270 7.5810 115.7000 66.9454 68.6420 176.7116 568 T 3.8037 7.7846 117.4948 66.6268 68.4818 176.6159 569 L 3.7497 8.0536 121.1465 57.8050 41.5973 179.3193 570 N 4.3160 8.0999 116.4052 56.5594 38.0144 177.3711 571 M 4.0562 8.0863 120.0735 58.2365 31.9628 178.5944 572 L 4.1292 8.0408 120.6408 58.1350 42.2208 179.1581 573 G 3.8562 8.6975 106.2287 47.8687 0.0000 175.8407 574 G 3.5990 8.2846 107.9193 47.7057 0.0000 176.1020 575 R 4.0166 7.7514 119.1919 59.1040 29.9850 179.1598 576 Q 4.0557 8.4304 118.1645 58.9262 28.7022 179.0156 577 V 3.6898 8.2615 119.7201 65.9475 31.6780 178.1024 578 I 3.7202 7.9196 119.4155 64.3893 36.9765 178.2175 579 A 4.0573 8.0834 121.3038 55.2239 18.1565 179.6018 580 A 4.1369 8.4936 119.5553 55.1185 18.4089 180.1042 581 V 3.6075 7.9781 117.1930 66.1512 31.3926 178.4691 582 K 4.0647 7.8690 116.9587 58.9874 32.1531 178.9452 583 W 4.2614 8.4493 128.5457 60.4857 30.7899 177.8161 584 A 2.8551 8.2428 120.8611 54.8597 17.4051 179.7566 585 K 4.0787 7.7436 115.5737 59.0831 32.1795 178.5535 586 A 4.3740 7.4783 118.8703 51.6658 19.3759 177.4814 587 I 3.5074 6.7007 120.0828 60.0321 37.4467 173.7479 588 P 4.3813 0.0000 0.0000 64.8694 31.6545 175.3498 589 G 4.1125 9.2220 111.4370 45.6665 0.0000 174.8908 590 F 4.0199 8.5125 122.1785 61.2900 39.2333 177.2514 591 R 4.2541 8.0389 113.6496 57.9781 29.3975 176.6492 592 N 4.5556 7.7683 115.3766 54.0534 39.0796 175.4721 593 L 4.1928 7.2860 118.3786 53.9311 42.6202 176.8367 594 H 4.0914 8.4173 119.9335 56.3568 31.5715 176.0288 595 L 3.8718 8.1979 127.7166 58.5683 41.8888 179.2351 596 D 4.3481 8.2356 118.2948 57.2203 40.7492 178.3353 597 D 4.2072 7.8369 119.0622 57.2502 40.9169 178.4281 598 Q 3.5977 7.8435 118.4323 59.2182 28.6478 178.9175 599 M 4.0866 8.0955 119.4632 58.8148 31.9519 179.0006 600 T 3.5190 7.8224 115.6502 66.5055 68.5429 176.7012 601 L 3.9993 8.2349 121.2391 57.8396 41.6580 179.6640 602 L 4.2056 8.1927 118.9832 57.9685 41.3674 179.5524 603 Q 4.3303 8.3523 117.4572 59.2149 28.7526 177.9875 604 Y 4.6946 8.4437 116.8930 59.5496 37.9288 176.8806 605 S 4.7168 8.3032 113.8256 57.7384 64.0927 175.7745 606 W 4.4890 8.3221 121.6954 60.4018 27.5202 177.8670 607 M 3.1089 6.4420 118.2495 57.7656 31.5235 177.8395 608 S 4.0002 7.7040 112.7606 61.3533 62.6016 175.9898 609 L 3.9806 8.0187 121.5704 58.1603 41.3664 179.4986 610 M 4.1518 8.4096 118.9660 58.4341 31.8569 179.0749 611 V 3.6255 8.2624 118.9348 65.7607 31.6687 177.8990 612 F 4.3580 8.6081 120.5286 61.3675 39.1794 177.0531 613 A 4.6066 8.1654 121.7865 54.5954 18.1281 179.3126 614 L 3.8670 8.2768 119.1885 58.1171 42.1068 179.4618 615 G 3.4920 8.3527 106.1406 47.4125 0.0000 175.4931 616 W 4.0014 8.0592 130.9047 60.2219 30.5914 178.2985 617 R 3.6917 8.1987 118.2324 59.3896 29.3977 179.3260 618 S 3.9424 8.0872 114.9746 61.3100 62.3213 176.2589 619 Y 4.0397 7.7120 122.3415 60.9266 38.3914 178.1045 620 R 3.1454 7.2916 117.7494 58.2339 30.0865 178.2053 621 Q 4.2824 7.8367 115.9363 56.3157 29.6386 176.7566 622 A 4.4500 7.0960 119.5652 51.5952 20.7175 176.0480 623 S 4.0269 8.4292 111.1342 59.3316 60.9831 173.6312 624 G 3.9709 8.3673 106.2532 45.7591 0.0000 174.8059 625 N 4.6348 7.9264 117.3945 53.7753 39.4632 175.2510 626 L 4.8595 7.3606 115.6167 52.5339 46.0503 176.5290 627 L 3.9464 8.2866 122.0743 54.6788 42.4448 176.1480 628 C 4.2824 8.4486 124.7622 58.1612 26.1605 173.9458 629 F 4.0349 8.4734 120.9606 60.0259 39.3047 175.4539 630 A 4.4903 7.8508 120.5500 50.3544 22.1349 175.2893 631 P 4.0232 0.0000 0.0000 64.8902 31.3619 177.4448 632 D 4.8407 7.7062 115.2678 52.8020 39.8469 176.7300 633 L 4.6191 8.0832 123.6670 54.0269 43.5498 173.0979 634 I 4.9275 8.1060 123.3852 59.0236 39.8522 174.7029 635 I 4.4501 8.8334 128.5569 59.5047 38.7892 175.7343 636 N 4.8548 8.5860 125.2190 51.6573 38.5976 175.6033 637 E 3.9062 8.7361 118.3413 59.4509 29.8208 178.0312 638 Q 4.1104 7.9954 118.9172 59.4414 29.3637 178.3891 639 R 3.9607 8.5569 119.2451 59.4302 30.1967 178.8351 640 M 4.2681 8.6761 118.7166 57.2373 31.5811 177.6789 641 T 4.7571 7.1776 108.2692 60.5512 69.8580 174.5318 642 L 4.1844 7.1849 121.5511 54.4443 42.4264 176.1920 643 P 4.2189 0.0000 0.0000 66.1632 31.1976 177.3626 644 C 4.4850 7.8719 111.2220 60.1139 28.3779 174.4638 645 M 4.2192 7.8819 121.1443 56.3189 32.6604 177.2623 646 Y 4.4896 7.9624 120.9762 60.1046 38.8076 177.8547 647 D 4.1047 8.0934 118.0851 57.3500 41.5032 177.9674 648 Q 3.7212 7.6078 117.6849 59.4856 28.5302 178.1455 649 C 4.1085 8.2009 118.9567 62.1167 27.9427 175.9320 650 K 3.7846 7.6476 121.3339 59.7847 31.4846 178.6665 651 H 4.2384 7.6748 115.0589 59.0428 28.7212 177.4847 652 M 4.2050 8.2853 120.0785 57.7401 32.1653 177.8356 653 L 4.1684 7.9968 119.9424 56.4431 42.4363 178.1134 654 F 4.0962 7.8779 121.2410 61.7510 39.1720 177.1777 655 I 3.4755 7.8334 118.5058 64.2259 36.7333 178.1748 656 S 4.0175 7.8631 114.0924 61.4970 62.0953 176.3589 657 T 3.7267 7.5269 111.9840 64.6541 68.4446 176.3117 658 E 3.7068 7.3992 120.9539 58.9791 29.5755 179.0907 659 L 3.6629 7.7489 119.2627 57.5602 41.2698 179.4431 660 Q 3.4382 7.5606 119.3953 58.9080 28.8027 178.0467 661 R 3.8339 7.7352 118.7349 59.3824 30.2444 177.8070 662 L 4.1853 7.7894 115.2768 54.1205 42.8671 176.3992 663 Q 3.5075 7.4957 116.6078 55.5112 26.7677 174.6295 664 V 3.9839 7.4509 116.2449 62.9644 32.7203 176.2212 665 S 4.9144 9.3970 122.6528 57.6716 65.5858 174.8821 666 Y 4.0168 8.7916 122.5498 60.9309 38.6929 177.9309 667 E 3.8379 8.2790 119.0295 59.3383 29.6033 178.9197 668 E 3.9947 8.2244 118.6213 59.5439 29.6906 178.6664 669 Y 4.1427 8.3071 119.8129 60.8792 38.8249 178.2439 670 L 3.4409 7.7705 119.9936 57.7719 41.6270 179.4585 671 C 4.1733 7.8609 116.1655 63.0857 28.1237 176.0236 672 M 3.9762 8.1583 120.4237 58.2520 31.4541 178.7687 673 K 3.6881 8.1367 120.0970 59.6754 32.0523 179.0431 674 T 3.9639 7.5498 115.1232 66.5375 68.5399 176.3462 675 L 4.1201 7.8448 120.9424 57.7030 41.7094 179.5556 676 L 3.9078 7.8130 119.0687 57.6184 41.2871 179.1302 677 L 4.2030 7.5722 120.4045 56.6114 41.9095 177.9953 678 L 5.0759 7.5920 117.3476 54.7470 43.0746 176.9287 679 S 4.8361 8.1753 114.2995 58.3810 65.2804 173.8465 680 S 5.2227 8.2578 115.3831 56.9061 65.5416 173.6143 681 V 4.6901 8.9831 117.6602 58.4966 36.3984 173.4718 682 P 5.0689 0.0000 0.0000 62.5007 31.7464 177.9081 683 K 3.8059 8.7617 125.4668 59.4182 32.1955 177.3780 684 E 4.1414 8.1198 113.7991 56.0481 29.9338 177.2939 685 G 3.9337 8.0356 104.7334 45.7126 0.0000 173.1864 686 L 4.3542 7.8328 119.0887 53.1721 42.8889 177.9033 687 K 4.0216 9.0212 120.4770 59.3585 32.5839 179.5713 688 S 4.6774 8.9719 117.0405 57.2723 60.9260 175.2849 689 Q 3.9777 7.8314 125.9295 59.5264 29.2531 176.9272 690 E 3.9326 8.1431 119.5026 59.1876 29.6897 178.3337 691 L 3.9243 7.8745 119.8474 58.0617 42.2405 178.2950 692 F 4.0859 8.4517 120.7765 61.6414 39.2112 176.8086 693 D 4.2635 8.4994 118.4209 57.1617 40.5996 178.4139 694 E 3.8466 8.1644 119.7542 59.3434 29.6039 178.8810 695 I 3.6264 7.9121 120.1061 64.4279 37.2171 178.3675 696 R 3.8300 7.9328 119.7911 59.7978 29.7662 178.5236 697 M 4.1630 8.2752 118.8040 58.2236 31.8785 178.7447 698 T 3.6701 7.7577 110.3258 65.0667 68.6834 176.0683 699 Y 4.0545 7.6143 118.9165 60.2393 37.9048 178.0910 700 I 3.9116 7.9674 121.2416 64.3822 37.1587 178.5438 701 K 3.9588 8.3316 119.5869 59.2840 31.8339 179.0452 702 E 3.8849 8.2076 119.7750 58.9858 29.5257 178.5282 703 L 4.1012 8.3619 120.7814 58.1306 42.1052 178.9870 704 G 3.7132 8.1235 105.5951 48.0839 0.0000 175.6590 705 K 3.9845 8.2592 121.0602 59.0572 31.7947 179.3564 706 A 4.0706 7.9484 120.2755 54.9626 18.5387 179.6216 707 I 3.8827 7.9049 118.5055 64.6225 37.2227 178.5744 708 V 3.6114 8.1320 119.5120 66.0667 31.0669 177.8475 709 K 3.9403 8.0605 117.9476 59.1803 32.0175 178.5356 710 R 4.0585 7.8435 117.2856 57.1422 29.9139 176.6456 711 E 3.7682 8.3026 117.2529 57.1925 27.0771 174.8731 712 G 3.9075 8.0140 108.2241 44.7277 0.0000 173.7482 713 N 4.7745 9.0830 118.5155 51.6183 40.1383 176.1107 714 S 4.1524 8.5055 115.6523 61.9292 62.7076 176.9888 715 S 4.1231 8.1011 115.1708 61.5420 62.2002 176.0223 716 Q 4.0675 8.9337 121.2212 58.9425 28.3152 178.5914 717 N 4.4082 8.5277 117.7342 56.0431 38.5548 177.1345 718 W 4.1190 8.3501 129.7224 60.6231 30.7618 177.7111 719 Q 4.1631 8.6431 119.6316 59.3493 28.4767 178.2707 720 R 4.1069 8.5639 120.1717 59.3171 30.1670 178.1615 721 F 3.9940 8.6031 120.8471 61.4155 39.3766 176.3889 722 Y 3.9019 8.4067 119.4079 60.8263 38.6019 178.1899 723 Q 3.9793 8.3820 119.0355 59.0402 28.8437 178.8176 724 L 3.9628 8.1962 120.6777 57.7338 41.6082 179.5933 725 T 3.3040 7.3452 109.7530 64.0853 68.4814 177.0679 726 K 3.7944 7.7056 121.5894 59.0086 31.7666 178.9382 727 L 3.9136 7.5086 119.5309 58.1270 42.4564 178.5079 728 L 4.0066 7.8377 118.8551 58.1279 41.6151 179.3339 729 D 4.4781 8.2907 118.8254 57.4193 40.6292 179.0501 730 S 4.2783 8.3276 114.6038 61.4046 62.8675 176.3650 731 M 4.0924 7.8785 122.3926 58.5766 31.5794 178.1833 732 H 4.1797 8.0210 116.0819 59.0337 28.7306 177.5500 733 D 4.3681 7.9420 120.7166 57.1920 40.6616 178.9927 734 V 3.5987 7.7213 118.3158 66.0894 31.7040 178.0985 735 V 3.5167 7.9782 118.0561 65.9311 31.2424 177.7231 736 E 3.9661 8.2473 118.4111 59.5233 28.7858 179.1225 737 N 4.2957 7.8518 116.5474 56.2624 38.4793 177.5106 738 L 4.1546 7.7788 120.3400 57.6074 41.8054 179.4195 739 L 3.3375 8.1839 119.2880 57.3251 41.3041 179.4947 740 S 3.9812 7.6007 112.9224 61.4316 62.2104 175.9024 741 Y 3.9200 7.6336 118.6865 61.0719 37.6894 177.7507 742 C 4.4154 8.3649 119.8411 62.8294 31.6136 175.7719 743 F 4.6716 8.5884 119.7080 60.7403 38.4771 177.8835 744 Q 4.1190 8.3593 118.0704 59.2409 28.3661 178.8452 745 T 4.1871 8.4152 110.0775 64.5773 68.8635 176.2410 746 F 4.0516 8.3319 123.0475 61.1197 39.5001 176.9996 747 L 4.1181 8.1728 117.7676 56.5638 42.2955 177.4911 748 D 4.5842 8.0234 119.8365 52.8223 40.4662 176.5921 749 K 4.0054 8.2900 126.7167 58.8372 32.5394 179.7513 750 S 4.1649 7.7669 112.7404 60.8978 61.5193 175.1518 751 M 4.0352 8.2491 120.7035 56.3402 32.1033 176.4146 752 S 3.9446 7.9113 112.9833 59.8456 61.0700 171.5975 753 I 4.3669 7.2589 119.7774 60.1122 38.0313 175.6293 754 E 4.7824 8.6197 125.2267 55.1073 30.9670 175.6994 755 F 4.8204 8.5585 119.4419 54.3798 42.8500 173.8498 756 P 4.6372 0.0000 0.0000 62.0093 33.4749 177.0705 757 E 3.9099 8.7046 118.3659 59.7205 29.4523 178.2067 758 M 3.9244 8.0579 117.4435 58.8777 32.2217 178.0574 759 L 3.5628 7.7785 118.0421 57.5319 41.7995 179.0717 760 A 3.5106 8.2010 120.9618 55.0513 18.4210 179.3214 761 E 3.7925 8.2667 117.7506 59.3895 29.6459 179.0984 762 I 3.6070 7.4006 119.6327 64.4721 37.1388 178.5151 763 I 3.6819 7.6776 120.9436 64.6388 36.5873 178.5049 764 T 3.7777 7.4396 115.7116 66.8180 68.8880 175.9357 765 N 4.5331 8.0387 117.8045 55.8185 38.5905 177.4051 766 Q 4.0430 8.3397 121.5783 58.9002 29.1447 177.7988 767 I 3.0927 7.5442 121.0062 64.0597 37.2082 176.6086 768 P 4.3302 0.0000 0.0000 65.3453 31.0415 178.9480 769 K 4.0226 7.5859 115.9198 59.4152 32.0319 178.7378 770 Y 3.9381 8.2477 119.9810 61.0199 38.6462 178.4562 771 S 4.1772 8.4367 114.5450 60.9266 63.0013 175.4371 772 N 4.6723 7.8901 117.1547 52.7761 38.4524 175.4268 773 G 3.7107 7.5968 108.4345 46.4048 0.0000 174.3802 774 N 4.5082 8.2189 120.0079 54.6543 40.2834 174.4916 775 I 4.0951 7.4551 119.2269 60.4958 37.7069 175.0231 776 K 4.3441 9.2174 130.3342 54.9265 33.7623 175.3615 777 K 4.6996 8.4154 127.2973 55.1685 32.9085 176.4284 778 L 4.2300 8.8684 126.9879 54.3981 42.1967 176.8235 779 L 4.9361 8.2154 123.0014 52.8433 44.7095 176.8452 780 F 4.0918 9.6292 122.3118 59.7243 39.1596 175.5770 781 H 4.9930 8.2105 118.2655 54.4345 30.7165 174.4361 782 Q 3.4292 8.0781 118.4676 59.2595 28.8983 179.6351 *783 K 4.1936 7.7270 124.5850 54.6831 32.4458 177.9279 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 526 M 8.30 4.51 0.00 2.03 2.09 0.00 0.00 0.00 0.00 0.00 -0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.57 0.00 527 V 8.02 4.36 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 0.72 0.00 0.00 0.94 0.00 0.00 528 P 0.00 4.46 0.00 2.04 1.99 0.00 3.68 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.08 0.00 529 A 8.29 4.15 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 530 A 7.83 4.47 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 531 L 8.36 4.38 0.00 1.67 1.62 0.94 1.05 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 0.00 532 P 0.00 4.24 0.00 2.21 2.10 0.00 3.79 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.00 0.00 533 Q 8.46 4.15 0.00 2.03 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 7.07 0.00 0.00 0.00 0.00 0.00 2.35 2.45 0.00 534 L 8.35 4.30 0.00 1.69 1.60 0.94 0.90 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 0.00 535 T 8.15 4.72 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 1.23 0.00 0.00 536 P 0.00 4.65 0.00 2.19 2.13 0.00 3.71 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.95 0.00 537 T 7.10 4.73 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 0.00 538 L 8.37 4.03 0.00 1.96 1.81 0.38 0.77 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 0.00 539 V 8.27 3.64 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 0.87 0.00 0.00 0.91 0.00 0.00 540 S 7.89 4.26 0.00 3.89 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 0.00 541 L 7.72 4.00 0.00 1.82 1.83 0.94 0.58 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 0.00 542 L 8.30 4.10 0.00 1.89 1.73 0.98 1.11 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 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0.00 612 F 8.61 4.36 0.00 3.18 3.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 613 A 8.17 4.61 1.44 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 0.00 0.00 0.00 614 L 8.28 3.87 0.00 1.72 1.86 0.08 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 0.00 0.00 0.00 0.00 615 G 8.35 3.49 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 0.00 616 W 8.06 4.00 0.00 2.64 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 0.00 617 R 8.20 3.69 0.00 1.84 1.83 0.00 3.12 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 1.65 1.91 0.00 618 S 8.09 3.94 0.00 3.71 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 0.00 619 Y 7.71 4.04 0.00 2.78 2.85 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 0.00 620 R 7.29 3.15 0.00 1.12 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0.00 0.00 0.00 0.00 0.00 0.00 0.00 637 E 8.74 3.91 0.00 1.96 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 2.30 2.45 0.00 638 Q 8.00 4.11 0.00 2.16 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.68 0.00 0.00 0.00 0.00 0.00 2.43 2.46 0.00 639 R 8.56 3.96 0.00 1.96 1.94 0.00 3.17 0.00 0.00 3.14 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.78 0.00 640 M 8.68 4.27 0.00 2.00 2.22 0.00 0.00 0.00 0.00 0.00 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.97 2.55 0.00 641 T 7.18 4.76 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 1.44 0.00 0.00 642 L 7.18 4.18 0.00 1.70 1.59 0.91 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 643 P 0.00 4.22 0.00 2.07 2.17 0.00 3.67 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.15 0.00 644 C 7.87 4.48 0.00 2.38 2.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 645 M 7.88 4.22 0.00 1.93 2.20 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 2.54 2.48 0.00 646 Y 7.96 4.49 0.00 3.09 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 0.00 647 D 8.09 4.10 0.00 2.97 2.77 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 7.61 3.72 0.00 1.84 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 6.68 0.00 0.00 0.00 0.00 0.00 2.13 2.20 0.00 649 C 8.20 4.11 0.00 2.94 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 0.00 650 K 7.65 3.78 0.00 1.44 1.59 0.00 1.50 0.00 0.00 1.47 0.00 0.00 2.58 0.00 0.00 2.67 0.00 0.00 0.00 0.00 1.24 1.30 7.81 651 H 7.67 4.24 0.00 3.25 3.35 0.00 5.91 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 0.00 652 M 8.29 4.20 0.00 1.95 2.13 0.00 0.00 0.00 0.00 0.00 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.79 2.57 0.00 653 L 8.00 4.17 0.00 1.82 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7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.64 0.00 662 L 7.79 4.19 0.00 1.66 1.67 0.88 0.85 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 0.00 663 Q 7.50 3.51 0.00 2.23 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.82 0.00 0.00 0.00 0.00 0.00 2.46 2.40 0.00 664 V 7.45 3.98 2.23 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 1.10 0.00 0.00 0.94 0.00 0.00 665 S 9.40 4.91 0.00 4.25 4.13 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 0.00 666 Y 8.79 4.02 0.00 3.24 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 0.00 667 E 8.28 3.84 0.00 2.10 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 2.58 2.49 0.00 668 E 8.22 3.99 0.00 2.32 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 0.00 2.40 2.40 0.00 669 Y 8.31 4.14 0.00 2.54 2.54 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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0.00 678 L 7.59 5.08 0.00 1.76 1.57 0.85 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 679 S 8.18 4.84 0.00 3.92 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 0.00 680 S 8.26 5.22 0.00 3.90 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 681 V 8.98 4.69 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 0.46 0.00 0.00 0.94 0.00 0.00 682 P 0.00 5.07 0.00 2.19 2.01 0.00 3.47 0.00 0.00 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.97 0.00 683 K 8.76 3.81 0.00 1.86 1.84 0.00 1.75 0.00 0.00 1.73 0.00 0.00 3.00 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.44 1.36 7.81 684 E 8.12 4.14 0.00 2.10 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 2.23 2.22 0.00 685 G 8.04 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 0.00 0.00 0.00 686 L 7.83 4.35 0.00 1.48 1.82 -0.07 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 0.00 0.00 0.00 0.00 687 K 9.02 4.02 0.00 1.61 1.74 0.00 1.31 0.00 0.00 1.12 0.00 0.00 2.78 0.00 0.00 2.68 0.00 0.00 0.00 0.00 1.34 1.27 7.81 688 S 8.97 4.68 0.00 3.90 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 0.00 689 Q 7.83 3.98 0.00 2.30 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.91 0.00 0.00 0.00 0.00 0.00 2.44 2.67 0.00 690 E 8.14 3.93 0.00 2.09 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 2.38 2.38 0.00 691 L 7.87 3.92 0.00 1.81 1.83 0.92 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 692 F 8.45 4.09 0.00 3.15 3.26 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 0.00 693 D 8.50 4.26 0.00 2.95 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 0.00 694 E 8.16 3.85 0.00 2.03 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 0.00 2.25 2.31 0.00 695 I 7.91 3.63 1.90 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.33 1.07 0.00 0.00 696 R 7.93 3.83 0.00 1.11 1.56 0.00 3.20 0.00 0.00 3.05 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.58 0.00 697 M 8.28 4.16 0.00 2.06 2.11 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.54 0.00 698 T 7.76 3.67 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 699 Y 7.61 4.05 0.00 3.05 3.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 700 I 7.97 3.91 2.12 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 0.98 1.25 0.00 0.00 701 K 8.33 3.96 0.00 1.85 1.79 0.00 1.62 0.00 0.00 1.51 0.00 0.00 2.83 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.39 1.52 7.81 702 E 8.21 3.88 0.00 2.12 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 2.36 2.39 0.00 703 L 8.36 4.10 0.00 1.87 2.03 0.95 0.89 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 0.00 704 G 8.12 3.71 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 0.00 0.00 0.00 705 K 8.26 3.98 0.00 1.96 1.88 0.00 1.64 0.00 0.00 1.81 0.00 0.00 2.96 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.44 1.63 7.81 706 A 7.95 4.07 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 0.00 707 I 7.90 3.88 2.12 0.00 0.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.89 1.00 0.00 0.00 708 V 8.13 3.61 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 1.10 0.00 0.00 0.97 0.00 0.00 709 K 8.06 3.94 0.00 1.97 2.02 0.00 1.88 0.00 0.00 1.85 0.00 0.00 3.08 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.49 1.52 7.81 710 R 7.84 4.06 0.00 2.15 2.03 0.00 3.36 0.00 0.00 3.28 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.73 0.00 711 E 8.30 3.77 0.00 2.15 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 2.24 2.26 0.00 712 G 8.01 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 0.00 0.00 0.00 713 N 9.08 4.77 0.00 2.99 3.00 0.00 0.00 7.43 7.22 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 0.00 714 S 8.51 4.15 0.00 3.90 4.01 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 0.00 0.00 0.00 715 S 8.10 4.12 0.00 3.86 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 716 Q 8.93 4.07 0.00 2.39 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.58 0.00 0.00 0.00 0.00 0.00 2.42 2.58 0.00 717 N 8.53 4.41 0.00 2.99 2.94 0.00 0.00 6.62 7.93 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 0.00 718 W 8.35 4.12 0.00 3.63 3.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 719 Q 8.64 4.16 0.00 2.35 2.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.59 0.00 0.00 0.00 0.00 0.00 2.46 2.46 0.00 720 R 8.56 4.11 0.00 2.03 2.00 0.00 3.21 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 1.69 1.68 0.00 721 F 8.60 3.99 0.00 3.17 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 0.00 722 Y 8.41 3.90 0.00 3.09 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 0.00 723 Q 8.38 3.98 0.00 2.32 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.59 0.00 0.00 0.00 0.00 0.00 2.51 2.77 0.00 724 L 8.20 3.96 0.00 1.41 1.56 0.94 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 725 T 7.35 3.30 2.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.70 0.00 0.00 726 K 7.71 3.79 0.00 1.77 1.72 0.00 1.47 0.00 0.00 1.02 0.00 0.00 2.66 0.00 0.00 3.04 0.00 0.00 0.00 0.00 0.38 0.95 7.81 727 L 7.51 3.91 0.00 1.59 1.84 0.92 0.85 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 0.00 728 L 7.84 4.01 0.00 1.90 1.74 0.83 0.71 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 0.00 729 D 8.29 4.48 0.00 2.92 2.77 0.00 0.00 0.00 0.00 0.00 0.00 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 S 8.33 4.28 0.00 4.16 4.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 731 M 7.88 4.09 0.00 1.99 2.18 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.39 2.71 0.00 732 H 8.02 4.18 0.00 3.30 3.31 0.00 5.62 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 0.00 733 D 7.94 4.37 0.00 2.80 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 0.00 734 V 7.72 3.60 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 1.15 0.00 0.00 1.16 0.00 0.00 735 V 7.98 3.52 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.65 0.00 0.00 0.87 0.00 0.00 736 E 8.25 3.97 0.00 2.21 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 2.51 2.53 0.00 737 N 7.85 4.30 0.00 2.72 2.59 0.00 0.00 7.06 6.61 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 0.00 738 L 7.78 4.15 0.00 1.61 1.66 0.91 0.64 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 0.00 739 L 8.18 3.34 0.00 1.12 0.31 0.63 0.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 740 S 7.60 3.98 0.00 3.85 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 0.00 741 Y 7.63 3.92 0.00 3.25 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 0.00 742 C 8.36 4.42 0.00 3.16 2.93 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 0.00 743 F 8.59 4.67 0.00 3.06 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 0.00 744 Q 8.36 4.12 0.00 2.25 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.80 0.00 0.00 0.00 0.00 0.00 2.44 2.55 0.00 745 T 8.42 4.19 4.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 746 F 8.33 4.05 0.00 2.42 3.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 747 L 8.17 4.12 0.00 1.72 1.71 0.97 1.14 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 0.00 748 D 8.02 4.58 0.00 2.80 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 0.00 749 K 8.29 4.01 0.00 1.77 1.79 0.00 1.53 0.00 0.00 1.72 0.00 0.00 2.74 0.00 0.00 2.73 0.00 0.00 0.00 0.00 1.52 1.27 7.81 750 S 7.77 4.16 0.00 3.89 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 0.00 751 M 8.25 4.04 0.00 2.24 2.27 0.00 0.00 0.00 0.00 0.00 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.69 2.66 0.00 752 S 7.91 3.94 0.00 4.06 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 0.00 753 I 7.26 4.37 2.11 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 1.50 0.93 0.83 0.00 0.00 754 E 8.62 4.78 0.00 1.95 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 2.34 2.29 0.00 755 F 8.56 4.82 0.00 3.13 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 0.00 756 P 0.00 4.64 0.00 2.29 2.21 0.00 3.85 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.15 0.00 757 E 8.70 3.91 0.00 2.08 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 2.39 2.40 0.00 758 M 8.06 3.92 0.00 2.12 2.03 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.66 0.00 759 L 7.78 3.56 0.00 1.76 1.76 0.25 1.09 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 0.00 760 A 8.20 3.51 1.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 761 E 8.27 3.79 0.00 2.01 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 2.26 2.32 0.00 762 I 7.40 3.61 1.54 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 1.42 0.49 0.65 0.00 0.00 763 I 7.68 3.68 0.89 0.00 0.00 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.45 0.44 0.00 0.00 764 T 7.44 3.78 4.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 765 N 8.04 4.53 0.00 2.89 2.88 0.00 0.00 6.66 7.35 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 0.00 766 Q 8.34 4.04 0.00 2.41 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.74 0.00 0.00 0.00 0.00 0.00 2.61 2.69 0.00 767 I 7.54 3.09 1.60 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 -0.30 -0.36 0.72 0.00 0.00 768 P 0.00 4.33 0.00 2.16 2.09 0.00 3.55 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 2.11 2.16 0.00 769 K 7.59 4.02 0.00 2.07 1.96 0.00 1.82 0.00 0.00 1.64 0.00 0.00 3.00 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.73 1.88 7.81 770 Y 8.25 3.94 0.00 3.16 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 0.00 771 S 8.44 4.18 0.00 3.87 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 0.00 772 N 7.89 4.67 0.00 2.85 2.83 0.00 0.00 7.01 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 0.00 773 G 7.60 3.71 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 0.00 0.00 0.00 774 N 8.22 4.51 0.00 2.78 2.93 0.00 0.00 7.24 8.79 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 0.00 775 I 7.46 4.10 1.68 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 -0.30 0.22 0.65 0.00 0.00 776 K 9.22 4.34 0.00 1.76 1.84 0.00 1.59 0.00 0.00 1.62 0.00 0.00 2.79 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.35 1.37 7.81 777 K 8.42 4.70 0.00 1.35 0.74 0.00 1.71 0.00 0.00 1.55 0.00 0.00 2.95 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.23 1.33 7.81 778 L 8.87 4.23 0.00 1.48 1.50 1.15 0.80 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 0.00 779 L 8.22 4.94 0.00 1.56 1.68 0.92 1.02 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 0.00 780 F 9.63 4.09 0.00 2.82 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 0.00 781 H 8.21 4.99 0.00 3.20 3.21 0.00 5.69 0.00 0.00 0.00 0.00 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 782 Q 8.08 3.43 0.00 2.08 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.79 6.65 0.00 0.00 0.00 0.00 0.00 2.29 1.99 0.00 *783 K 7.73 4.19 0.00 1.51 1.65 0.00 1.58 0.00 0.00 1.74 0.00 0.00 3.18 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.26 1.50 7.81 * Residues marked with a * may have inaccurate shift predictions.