NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 538 R 4.3131 8.1133 119.7021 55.7845 33.0623 177.0333 539 E 3.7205 8.1653 116.7606 59.0792 29.5475 177.8318 540 L 3.9937 8.1544 120.0412 58.2093 42.4058 178.5054 541 Q 3.8967 7.8022 118.8457 59.0815 29.1434 177.5999 542 S 4.0350 8.0445 114.0603 61.2852 62.2695 175.5310 543 L 3.9020 8.0989 121.7671 58.4356 41.8960 178.6093 544 A 4.2365 7.6388 118.4282 54.9846 18.3908 178.8918 545 A 4.1616 8.0176 117.4285 52.8848 19.3206 177.9720 546 A 4.0830 7.5250 120.8970 51.9219 19.0782 177.6792 547 V 3.7215 8.1530 121.0502 62.5809 32.3173 175.9820 548 V 4.2135 8.0284 125.4746 60.0935 31.8250 173.6680 549 P 4.4353 0.0000 0.0000 62.4138 31.8341 176.6060 550 S 4.3912 8.3673 114.0554 58.0408 64.6107 175.1373 551 A 3.9403 8.4285 123.6233 55.1573 18.0855 179.4445 552 Q 3.9823 8.1211 117.5804 59.8982 28.9494 178.4740 553 T 3.9047 7.7317 115.1772 66.8808 68.6844 176.1107 554 L 4.2496 7.9939 118.1993 54.9944 41.9642 177.6702 555 K 3.9917 8.1586 117.6483 57.1616 30.2731 176.6825 556 I 3.4162 7.3232 109.5467 62.2189 37.4014 176.6749 557 T 4.3956 7.7113 116.9200 64.3981 69.4087 174.3773 558 D 4.6781 7.9008 123.0312 53.2160 41.8190 177.7646 559 F 4.3552 8.6479 122.1203 60.6460 39.1454 176.4579 560 S 4.5308 8.1839 113.8225 58.2845 62.9239 173.8001 561 F 4.0362 7.6665 122.6552 58.8497 39.4691 174.5012 562 S 4.3291 7.4002 120.5436 56.4139 65.3377 172.9707 563 D 4.7233 7.9009 124.3879 52.9804 39.7103 177.9047 564 F 4.3205 7.5880 119.4504 60.1827 38.8904 175.7992 565 E 4.5765 8.1233 117.3021 55.9005 30.1470 175.5853 566 L 4.7859 7.3826 119.2023 53.2600 43.4268 176.4264 567 S 4.5684 9.9400 117.0755 57.4536 63.4561 174.9975 568 D 4.3806 8.8091 122.2693 57.8518 40.5051 179.3831 569 L 4.1728 7.7815 120.1514 58.0193 42.2526 178.5383 570 E 4.0383 8.3336 118.9900 59.5584 29.3753 179.4402 571 T 3.5754 7.4429 109.9861 64.2792 68.6156 176.6303 572 A 4.0481 7.7551 123.6180 55.1109 18.3789 179.5524 573 L 4.0173 7.9083 117.0544 57.9929 41.6902 179.3394 574 C 4.1316 8.2009 116.7116 63.2438 28.1588 176.1480 575 T 4.1162 8.2052 117.1682 66.9678 68.1451 176.5745 576 I 3.8396 8.0448 121.5227 64.5715 37.1559 178.4946 577 R 3.9691 8.2491 119.5511 59.4494 29.8889 178.5616 578 M 3.5628 8.0311 118.6051 58.4133 31.9668 178.6769 579 F 4.1550 8.4332 117.8618 60.8067 39.0272 178.0600 580 T 3.9854 8.2536 115.3033 66.9281 68.2391 176.6182 581 D 4.6225 8.7099 118.6820 56.1742 40.9744 177.6292 582 L 4.4604 7.8148 117.9280 53.8005 42.3593 176.1532 583 N 4.3845 8.2248 115.9820 54.7152 36.6566 176.5732 584 L 4.3863 8.5319 121.7069 57.8229 41.7592 179.1322 585 V 3.7088 7.9322 117.8500 66.3315 31.4158 177.2057 586 Q 4.0604 8.0863 119.2313 58.6766 28.9209 177.2179 587 N 4.0906 8.0099 118.6784 55.2439 38.6416 175.8763 588 F 4.8557 7.3227 116.9878 56.3765 40.4758 175.6939 589 Q 3.2794 8.0990 118.0689 57.2734 26.3210 174.2053 590 M 4.3445 8.2322 117.3411 54.7863 33.6812 177.3606 591 K 4.4198 8.3152 121.3658 55.2456 34.1175 176.7549 592 H 3.9654 8.9847 124.6312 59.7814 29.6677 176.8053 593 E 4.1085 8.2121 118.4323 59.3184 29.3968 179.1022 594 V 3.9523 7.5291 120.1582 65.0725 31.7316 177.5649 595 L 3.8165 8.2422 120.4679 58.4064 42.0165 178.4499 596 C 3.9571 8.4365 116.9215 62.9712 28.0171 176.3405 597 R 3.8275 8.2825 120.2585 59.0886 29.7286 178.1356 598 W 4.4354 8.5927 129.8101 59.9508 30.6110 177.6568 599 I 3.3930 8.3684 119.8166 64.5648 36.6352 178.2866 600 L 3.6638 7.7525 119.3806 57.9253 41.1882 179.8707 601 S 3.9984 7.8902 114.4503 61.3612 63.0631 176.7921 602 V 3.4309 7.2181 120.7596 65.6624 31.2220 177.7284 603 K 3.5353 7.4461 119.4137 59.5202 31.5805 178.2255 604 K 3.7252 7.9686 118.3654 59.6746 31.9835 177.3660 605 N 4.6719 7.5581 113.2981 52.5401 38.5632 173.9818 606 Y 4.6362 7.5102 119.7264 55.9511 39.5910 175.9668 607 R 4.1735 8.6211 124.4445 56.2288 30.8730 176.9854 608 K 4.2858 8.6556 121.3546 58.2338 32.6590 178.1905 609 N 4.5578 8.1551 114.1379 53.7585 37.2615 174.6533 610 V 4.0213 7.3582 120.1334 61.5497 32.1298 175.1344 611 A 4.1853 8.9712 130.8930 55.3880 18.3537 176.6797 612 Y 4.5817 8.0432 112.8292 59.9296 40.6742 176.5208 613 H 4.3086 9.7324 118.2968 55.2369 26.9941 173.1523 614 N 5.2266 7.1163 119.0661 50.1101 40.8665 175.3619 615 W 3.2196 8.6861 125.8166 60.8925 30.3098 178.3327 616 R 3.5254 8.0077 117.8510 59.1503 29.3350 178.5381 617 H 3.8507 7.8673 117.4337 58.9314 29.8041 177.1909 618 A 3.7668 7.2557 122.0722 54.9828 18.2306 179.1499 619 F 3.6061 7.4358 119.4390 61.3864 39.2743 177.1824 620 N 3.9736 8.0508 116.3696 56.2570 38.3324 177.6308 621 T 3.8844 7.8689 117.5512 66.4132 68.4380 176.6230 622 A 3.9145 7.7783 122.8090 55.0724 18.3548 179.4894 623 Q 3.5634 7.5742 118.1244 59.2273 28.8863 178.0353 624 C 4.1405 8.1263 119.9513 62.4399 31.5064 175.2083 625 M 3.9842 7.7599 119.4840 58.5287 31.7500 177.9662 626 F 3.9111 8.3232 120.6139 61.1966 39.5637 176.9555 627 A 3.6131 8.2145 120.2502 54.9164 18.1556 179.4661 628 A 4.2497 8.3260 119.6499 55.4032 18.4919 179.9395 629 L 4.0068 8.0342 117.6453 58.0627 41.7334 178.6553 630 K 3.9789 8.2147 118.8487 57.9494 31.3475 178.8173 631 A 4.0488 7.8117 126.1326 55.4470 19.1556 179.3826 632 G 3.9837 8.4508 102.0883 44.6461 0.0000 173.5411 633 K 3.9476 7.8242 119.2542 57.7059 30.2613 176.1202 634 I 4.2907 7.6057 119.0320 62.0406 38.7305 178.1973 635 Q 3.9499 8.1227 122.4693 59.4171 28.6821 178.2638 636 N 4.6388 8.1116 111.1975 54.6382 38.6165 175.5799 637 K 4.3511 8.1625 117.4896 56.4584 32.7322 175.9189 638 L 5.0141 7.6178 117.9431 52.5324 45.3766 176.3485 639 T 4.4756 8.7929 111.5567 60.7752 71.5841 175.6792 640 D 4.4763 8.4957 120.5474 57.5071 40.8077 179.0332 641 L 4.0392 8.0319 119.1466 57.7850 41.6012 179.2621 642 E 3.9755 8.2378 118.5338 59.3965 29.4410 179.3909 643 I 3.6734 7.8066 119.9142 64.1674 37.1695 178.1268 644 L 3.8621 8.2614 121.1964 58.1473 41.8302 178.9573 645 A 3.9019 7.9079 120.5257 55.1625 18.3286 179.5603 646 L 3.8299 8.1596 117.8742 57.8335 41.7655 179.6121 647 L 3.9197 7.9381 120.2414 58.1508 42.1102 179.1280 648 I 4.1150 7.7925 119.6290 64.3842 37.0119 178.3301 649 A 4.1107 8.8001 122.0199 54.9895 17.9819 179.4570 650 A 3.8968 8.2783 118.8034 55.5089 18.5759 179.6949 651 L 4.2641 8.0258 115.7123 56.9935 42.2204 178.7266 652 S 4.8783 8.1210 113.1851 58.5258 63.6772 175.5574 653 H 4.3946 8.6939 117.4702 57.9027 28.3157 175.9139 654 D 4.9958 7.6707 118.2767 53.8240 41.0196 176.3540 655 L 3.4632 7.5806 119.8932 55.7506 42.4389 176.3523 656 D 4.2074 8.3791 119.7368 55.3828 38.7005 173.7692 657 H 4.2264 7.9940 118.7191 56.2460 30.8781 174.4871 658 R 4.4284 8.0704 125.6172 53.9918 31.8885 176.0836 659 G 3.4640 8.4097 108.5953 46.5631 0.0000 172.7955 *677 C 4.5403 8.5313 125.3956 59.3790 33.4412 174.3176 678 H 4.5289 8.0020 118.1329 58.3256 29.9726 177.2359 679 S 4.4273 8.2737 114.7248 60.8860 62.7302 174.9754 680 I 4.4344 7.7718 111.5358 62.0081 38.3899 175.5211 681 M 4.4397 8.0020 122.5825 55.1977 31.6017 176.3382 682 E 4.0255 7.9765 117.2416 56.6766 30.5820 176.4871 683 H 4.9870 8.3659 120.1514 54.7899 31.4387 173.4370 684 H 4.6103 9.5336 124.7819 55.3327 29.7965 174.5507 685 H 4.8293 8.2886 117.4466 53.6850 32.3614 174.2564 686 F 4.8715 7.6061 116.0959 56.8944 38.4354 177.3213 687 D 4.4185 7.6648 120.4487 58.1554 40.7096 178.3878 688 Q 3.9921 8.0401 119.1177 59.0520 29.0543 177.4965 689 C 4.1574 8.1942 119.4326 62.7036 31.7133 175.5478 690 L 4.1352 8.0827 120.3361 58.0365 41.1812 179.3343 691 M 4.1358 8.1368 118.6638 58.5559 31.6839 178.9321 692 I 3.8599 7.5968 120.0534 63.9152 37.5008 178.3418 693 L 4.3595 8.3571 119.5253 57.2959 41.1418 178.7011 694 N 4.6720 7.7947 114.6912 53.3159 39.4963 175.7474 695 S 4.0329 7.8508 116.6392 58.0325 63.3512 172.2252 696 P 4.1409 0.0000 0.0000 64.8162 31.1207 175.9713 697 G 4.0574 9.2738 110.2834 45.2600 0.0000 174.1082 698 N 5.1852 8.6227 116.4601 53.3406 38.8214 175.0179 699 Q 4.8992 7.9650 120.0345 54.1174 27.1962 176.3491 700 I 3.8312 7.5209 112.4552 61.9790 38.5441 177.5686 701 L 4.4283 7.5692 120.5189 54.6966 42.5941 178.0476 702 S 3.7557 7.6004 113.2202 61.1746 62.5814 175.8166 703 G 3.8331 7.9567 107.1900 46.1986 0.0000 173.4512 704 L 4.4638 8.2585 121.3913 53.6645 42.6871 177.4540 705 S 4.4237 8.4281 117.4073 57.7696 65.1573 175.2703 706 I 3.6870 8.2439 121.1100 64.5229 37.6225 177.5432 707 E 4.0161 8.1580 118.7011 59.5117 29.3295 179.0656 708 E 3.9990 8.0437 118.8016 59.4448 29.4362 178.8104 709 Y 3.9954 8.3729 119.8087 60.6843 38.8128 178.2101 710 K 3.8176 8.2669 119.3933 59.6523 32.1191 179.5338 711 T 3.7830 8.0266 115.9211 66.9602 68.3451 176.8155 712 T 3.7399 8.0537 117.9555 66.6000 68.4425 176.5449 713 L 3.6843 7.6351 120.8614 57.4963 41.5750 179.4743 714 K 3.7355 7.5796 119.1327 59.6001 32.0603 178.8649 715 I 3.7870 7.6036 119.9627 64.3638 37.0081 178.3929 716 I 3.6432 7.8662 120.8810 64.3575 36.9457 178.6139 717 K 3.7233 7.7622 119.0807 59.5315 31.7638 179.4596 718 Q 3.9966 7.9724 118.0426 58.8284 28.3564 178.7798 719 A 3.9471 8.0656 121.2615 55.1745 18.7774 179.4911 720 I 3.8843 7.8969 118.3159 64.6271 37.1825 178.7691 721 L 4.1353 8.2912 119.6276 57.6241 41.2030 179.3090 722 A 4.0448 8.0571 120.3391 54.9800 18.3322 179.0340 723 T 4.1488 7.4641 105.8898 62.1940 69.1028 174.2800 724 D 4.6356 8.0716 124.0221 53.9984 41.1593 176.9281 725 L 4.1375 8.9314 125.3542 57.9352 41.5966 179.2829 726 A 4.0714 8.0981 120.1237 55.2482 18.3049 179.5500 727 L 3.9331 7.9666 117.3704 57.9524 41.6489 178.9724 728 Y 4.0619 8.0293 118.9469 60.9266 38.5582 178.1057 729 I 3.3062 7.9731 119.5604 64.2313 37.2566 178.1080 730 K 4.0244 7.9439 119.4341 58.7138 32.2177 178.2075 731 R 4.3159 7.8223 116.7237 56.4836 30.7095 178.1195 732 R 3.3021 7.6761 118.7796 59.2500 29.8694 178.5194 733 G 3.9115 7.5983 104.2860 48.0114 0.0000 174.7080 734 E 3.9122 8.0931 121.8570 58.7154 29.6676 178.4636 735 F 4.2071 7.6260 118.9858 61.5303 39.4320 177.0810 736 F 4.2854 7.8729 117.3616 60.6362 38.6675 177.6294 737 E 3.9784 8.5329 118.4553 59.3609 29.3129 179.2555 738 L 4.0515 8.1567 119.2581 57.7996 41.6859 179.8095 739 I 3.5287 7.4422 119.6456 64.3466 36.8274 178.4203 740 R 3.8583 7.8187 118.1953 58.7665 29.8718 177.6398 741 K 4.3701 7.8125 115.6000 54.8438 32.9020 176.1609 742 N 4.2222 7.7467 115.2051 55.1040 36.4842 174.7072 743 Q 4.5243 8.4282 114.0302 55.2519 30.5296 176.5231 744 F 4.4945 8.2739 121.1039 58.6042 39.7994 173.7712 745 N 4.4868 9.3233 126.1513 51.3079 39.9751 174.6014 746 L 3.6950 7.7249 126.3358 57.0151 41.8747 178.5309 747 E 3.9780 7.7955 118.0794 57.8551 30.1003 176.2893 748 D 4.5643 7.9219 119.4464 52.8839 42.3479 174.4417 749 P 4.2435 0.0000 0.0000 66.1604 31.4602 177.9795 750 H 4.1839 8.2601 116.0986 59.6073 29.8257 177.2442 751 Q 4.1456 9.3786 120.4802 58.5306 28.4252 178.6601 752 K 4.0652 8.5095 121.3528 59.5966 32.3352 178.4087 753 E 3.9535 8.2919 119.6005 59.2014 29.4541 178.5611 754 L 3.8655 7.9390 120.3335 58.1071 42.1195 178.7569 755 F 3.9465 8.7106 120.9696 61.2487 39.4401 177.0512 756 L 3.6688 8.4436 118.8665 57.5119 41.3281 179.4774 757 A 3.8632 7.7287 120.6990 55.4271 18.3490 179.5674 758 M 3.8454 7.7543 117.2639 58.2948 31.8667 178.8201 759 L 3.6785 7.5500 120.6105 58.1096 42.0995 178.8582 760 M 3.9132 7.6658 118.4435 58.7213 31.9307 178.8327 761 T 3.6637 7.6734 115.4623 66.5191 68.3381 176.4057 762 A 3.7257 7.5958 121.3511 55.4584 18.5832 179.2233 763 C 4.2918 8.1033 115.1289 62.9056 28.0264 175.8308 764 D 4.4044 8.3474 119.0897 56.3634 41.0193 177.1853 765 L 4.7598 7.9220 117.7682 54.3811 42.1955 177.9704 766 S 4.3132 8.1869 116.8217 60.0684 62.5661 176.1534 767 A 4.0716 8.2074 124.3943 55.0750 17.9118 178.5210 768 I 4.0610 8.4391 116.6109 62.8287 38.2076 176.7742 769 T 4.4531 7.9125 108.6100 62.0081 69.8331 174.8874 770 K 4.4565 7.5070 121.9445 55.3749 32.8476 175.4579 771 P 4.3993 0.0000 0.0000 62.4254 33.1146 177.0884 772 W 4.6322 8.9156 130.8693 60.7681 30.2313 176.5378 773 P 3.9126 0.0000 0.0000 65.4849 30.5950 178.7588 774 I 3.7521 7.4866 117.9524 64.3697 37.2795 177.8695 775 Q 3.9805 8.1326 120.5497 59.2649 28.6898 178.1357 776 Q 3.5720 7.7141 120.8178 58.9972 28.8820 178.4702 777 R 4.0910 7.5651 120.8670 58.9116 30.1930 178.5657 778 I 3.9863 8.2351 112.6625 63.6289 37.5829 177.9861 779 A 3.8840 8.2395 123.1626 54.9045 18.0234 179.4442 780 E 3.9666 7.9205 117.3285 59.5139 29.4592 179.4554 781 L 4.0710 7.9069 119.1615 57.7581 41.4862 179.7885 782 V 3.2694 7.6070 118.0793 65.5732 31.1093 178.0806 783 A 3.4771 7.5038 119.6130 55.1745 18.5365 179.2922 784 T 4.2487 8.8511 115.4656 67.0837 68.0759 176.4168 785 E 4.0788 8.6765 121.3155 59.1184 29.4693 178.1812 786 F 4.2670 8.0214 115.5922 58.4874 39.3500 176.7335 787 F 5.0190 7.8657 116.3762 57.5410 39.5914 175.4353 788 D 5.1873 7.8018 118.1927 54.0668 41.3523 177.0963 789 Q 4.2573 7.9415 116.1097 57.1317 32.6016 176.9825 *809 K 4.8179 8.0313 115.1035 55.3093 34.4674 176.5978 810 K 3.4947 7.9851 117.1744 57.5091 32.2333 171.6269 811 N 4.4727 8.0835 113.9186 55.3561 39.4449 176.8763 812 K 4.2829 7.9571 117.9603 57.1336 33.0420 178.6177 813 I 3.4717 7.6890 121.0931 63.9870 37.1453 175.9175 814 P 4.1705 0.0000 0.0000 65.8320 31.2567 178.8270 815 S 4.1520 7.9761 113.2352 61.9435 62.8121 176.5620 816 M 4.0524 7.9749 121.3595 58.3414 31.5373 178.8717 817 Q 3.8099 8.0097 118.6487 58.7298 28.7214 178.9555 818 V 3.7501 7.7263 119.1372 65.9445 31.5584 178.2928 819 G 3.6578 8.1872 105.4966 47.7449 0.0000 175.4246 820 F 4.2542 8.6750 123.5770 61.0200 39.3640 177.2669 821 I 3.5091 8.1530 119.7227 64.4643 36.7402 178.1613 822 D 4.2933 8.3399 118.2355 57.4845 40.7814 178.5278 823 A 4.1797 8.2504 120.2192 54.1017 18.4895 178.4998 824 I 4.3432 7.5698 116.2075 63.1740 39.1992 177.6495 825 C 4.0711 7.4231 116.7317 62.2565 28.2520 175.5023 826 L 3.9830 8.0362 120.5912 58.4265 41.4064 179.8180 827 Q 3.9397 7.9293 119.5949 58.1410 28.8410 178.0274 828 L 4.2058 7.8768 121.6619 58.5395 41.7241 178.6015 829 Y 4.2542 7.5679 115.9396 60.7078 37.8754 178.1623 830 E 4.0241 8.5504 120.0409 59.3463 29.7354 179.0942 831 A 4.0468 7.9905 120.8323 55.0634 18.4559 179.3937 832 L 4.1939 8.3210 118.9245 58.8150 42.0422 179.4141 833 T 4.2026 8.1555 115.6102 66.7294 68.0764 176.1740 834 H 4.2374 7.9089 119.5330 59.0880 29.9318 177.1858 835 V 4.0744 7.7124 119.0230 64.6011 31.7229 175.8805 836 S 4.3814 8.3352 114.4271 56.9076 64.2750 173.7919 837 E 4.1610 8.9702 129.6621 58.6481 29.3328 178.1644 838 D 4.6679 8.1983 116.9605 56.2092 41.2923 176.7709 839 C 4.5531 8.4292 117.4983 59.6098 28.2628 174.6892 840 F 4.1773 8.1235 126.2941 60.3546 38.7696 175.1469 841 P 3.9643 0.0000 0.0000 65.4854 30.9867 178.4743 842 L 3.4656 6.9995 117.5091 57.3764 41.3705 179.3098 843 L 3.7586 7.2946 119.7393 57.9067 42.1382 178.2393 844 D 4.0289 7.5433 118.4743 57.1989 41.0947 178.4442 845 G 3.9568 7.9409 107.8802 47.3222 0.0000 175.1528 846 C 4.3438 7.6543 122.3352 61.8554 31.6146 175.8888 847 R 3.9551 8.0914 119.7835 59.2065 29.6378 179.2381 848 K 3.9491 8.0829 118.2920 59.5533 31.9913 179.2257 849 N 4.4306 8.2529 116.8294 56.1068 38.4377 177.4271 850 R 4.1090 8.2348 120.3041 59.5912 30.0981 178.6022 851 Q 3.9697 8.0311 117.7503 58.7849 28.8237 178.9297 852 K 3.3808 7.6136 119.2378 59.1642 31.8618 179.5146 853 W 4.5545 8.2610 119.5342 59.8198 28.9604 178.4467 854 Q 4.0204 8.7706 119.8559 59.1222 28.2990 178.0466 855 A 3.9916 7.9229 120.8541 55.2774 18.6790 179.3484 856 L 4.1228 7.9471 116.8505 57.7963 41.5033 179.4723 857 A 4.1999 8.2952 120.4092 55.0740 18.4271 178.7753 858 E 4.3361 8.0486 114.3205 56.0976 29.8783 175.1529 859 Q 3.9719 10.0124 121.1791 56.7926 27.2259 173.4942 860 Q 4.1715 8.2077 120.4177 56.4028 29.7182 174.6521 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 538 R 8.11 4.31 0.00 1.86 1.93 0.00 3.10 0.00 0.00 3.32 7.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.64 0.00 539 E 8.17 3.72 0.00 2.02 1.96 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 2.36 2.38 0.00 540 L 8.15 3.99 0.00 1.71 1.65 0.90 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 541 Q 7.80 3.90 0.00 2.15 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.68 0.00 0.00 0.00 0.00 0.00 2.42 2.41 0.00 542 S 8.04 4.03 0.00 3.93 3.82 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 0.00 543 L 8.10 3.90 0.00 1.61 1.78 0.91 1.11 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 0.00 544 A 7.64 4.24 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 545 A 8.02 4.16 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 546 A 7.52 4.08 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 547 V 8.15 3.72 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 0.81 0.00 0.00 0.94 0.00 0.00 548 V 8.03 4.21 2.12 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 0.95 0.00 0.00 0.99 0.00 0.00 549 P 0.00 4.44 0.00 2.24 2.08 0.00 3.85 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.00 0.00 550 S 8.37 4.39 0.00 4.10 4.08 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 0.00 551 A 8.43 3.94 1.46 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 0.00 0.00 552 Q 8.12 3.98 0.00 2.17 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.79 0.00 0.00 0.00 0.00 0.00 2.46 2.50 0.00 553 T 7.73 3.90 4.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 554 L 7.99 4.25 0.00 1.77 1.77 1.01 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 555 K 8.16 3.99 0.00 2.24 2.21 0.00 1.73 0.00 0.00 1.77 0.00 0.00 2.96 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.44 1.60 7.81 556 I 7.32 3.42 1.27 0.00 0.00 0.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.20 0.44 0.00 0.00 557 T 7.71 4.40 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 1.13 0.00 0.00 558 D 7.90 4.68 0.00 2.94 2.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 559 F 8.65 4.36 0.00 3.07 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 0.00 560 S 8.18 4.53 0.00 3.94 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 0.00 561 F 7.67 4.04 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 0.00 562 S 7.40 4.33 0.00 3.74 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 0.00 563 D 7.90 4.72 0.00 2.98 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 0.00 564 F 7.59 4.32 0.00 3.06 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 0.00 565 E 8.12 4.58 0.00 1.94 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.25 2.35 0.00 566 L 7.38 4.79 0.00 1.70 1.62 1.15 0.68 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 0.00 567 S 9.94 4.57 0.00 3.84 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 0.00 568 D 8.81 4.38 0.00 2.75 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 0.00 569 L 7.78 4.17 0.00 1.72 1.63 0.88 0.99 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 0.00 570 E 8.33 4.04 0.00 2.31 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 2.36 2.33 0.00 571 T 7.44 3.58 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 0.93 0.00 0.00 572 A 7.76 4.05 1.36 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 0.00 0.00 573 L 7.91 4.02 0.00 1.89 1.77 1.01 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 574 C 8.20 4.13 0.00 3.53 3.18 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 0.00 575 T 8.21 4.12 4.68 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 1.76 0.00 0.00 576 I 8.04 3.84 2.10 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 1.43 1.26 0.98 0.00 0.00 577 R 8.25 3.97 0.00 1.91 2.06 0.00 3.34 0.00 0.00 3.25 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.52 0.00 578 M 8.03 3.56 0.00 1.98 2.24 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 1.63 0.00 579 F 8.43 4.16 0.00 3.32 3.17 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 0.00 580 T 8.25 3.99 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 1.28 0.00 0.00 581 D 8.71 4.62 0.00 2.99 3.03 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 0.00 582 L 7.81 4.46 0.00 1.82 1.75 0.98 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 583 N 8.22 4.38 0.00 2.97 2.90 0.00 0.00 6.99 6.36 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 0.00 584 L 8.53 4.39 0.00 2.14 2.09 0.75 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 585 V 7.93 3.71 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 1.15 0.00 0.00 1.05 0.00 0.00 586 Q 8.09 4.06 0.00 2.17 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.61 0.00 0.00 0.00 0.00 0.00 2.38 2.43 0.00 587 N 8.01 4.09 0.00 2.20 2.13 0.00 0.00 6.98 6.73 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 0.00 588 F 7.32 4.86 0.00 3.17 2.98 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 0.00 589 Q 8.10 3.28 0.00 2.12 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.25 6.88 0.00 0.00 0.00 0.00 0.00 2.33 2.36 0.00 590 M 8.23 4.34 0.00 1.95 2.01 0.00 0.00 0.00 0.00 0.00 2.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.73 2.67 0.00 591 K 8.32 4.42 0.00 1.79 1.92 0.00 1.71 0.00 0.00 1.91 0.00 0.00 2.88 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.48 1.48 7.81 592 H 8.98 3.97 0.00 3.25 3.36 0.00 5.87 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 0.00 593 E 8.21 4.11 0.00 2.20 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 0.00 2.37 2.32 0.00 594 V 7.53 3.95 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 1.24 0.00 0.00 0.93 0.00 0.00 595 L 8.24 3.82 0.00 1.61 1.70 0.07 0.70 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 0.00 596 C 8.44 3.96 0.00 3.06 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 0.00 597 R 8.28 3.83 0.00 1.98 2.10 0.00 3.18 0.00 0.00 3.09 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 1.62 0.00 598 W 8.59 4.44 0.00 3.44 3.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 599 I 8.37 3.39 2.00 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.85 0.86 0.00 0.00 600 L 7.75 3.66 0.00 1.70 1.56 0.84 0.64 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 0.00 601 S 7.89 4.00 0.00 3.72 3.79 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 0.00 602 V 7.22 3.43 1.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 -0.14 0.00 0.00 603 K 7.45 3.54 0.00 0.79 1.24 0.00 1.01 0.00 0.00 0.61 0.00 0.00 2.53 0.00 0.00 2.45 0.00 0.00 0.00 0.00 0.84 0.21 7.81 604 K 7.97 3.73 0.00 1.65 1.93 0.00 1.77 0.00 0.00 1.62 0.00 0.00 2.99 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.38 1.42 7.81 605 N 7.56 4.67 0.00 2.70 2.62 0.00 0.00 6.94 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 0.00 606 Y 7.51 4.64 0.00 3.23 2.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 607 R 8.62 4.17 0.00 1.81 2.25 0.00 3.24 0.00 0.00 3.25 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.69 0.00 608 K 8.66 4.29 0.00 1.85 1.89 0.00 1.69 0.00 0.00 1.91 0.00 0.00 2.99 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.57 1.46 7.81 609 N 8.16 4.56 0.00 2.85 2.96 0.00 0.00 5.94 7.68 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 0.00 610 V 7.36 4.02 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 0.80 0.00 0.00 1.01 0.00 0.00 611 A 8.97 4.19 1.46 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 0.00 0.00 612 Y 8.04 4.58 0.00 2.93 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 0.00 613 H 9.73 4.31 0.00 2.76 3.24 0.00 5.85 0.00 0.00 0.00 0.00 6.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 614 N 7.12 5.23 0.00 2.94 3.11 0.00 0.00 5.72 8.88 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 0.00 615 W 8.69 3.22 0.00 3.31 3.03 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 0.00 616 R 8.01 3.53 0.00 1.94 1.88 0.00 3.55 0.00 0.00 2.88 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.73 0.00 617 H 7.87 3.85 0.00 2.73 3.04 0.00 5.79 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 0.00 618 A 7.26 3.77 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 619 F 7.44 3.61 0.00 1.51 2.50 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 0.00 620 N 8.05 3.97 0.00 2.75 2.72 0.00 0.00 7.06 6.60 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 0.00 621 T 7.87 3.88 4.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.00 0.00 622 A 7.78 3.91 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 0.00 623 Q 7.57 3.56 0.00 1.25 1.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.75 0.00 0.00 0.00 0.00 0.00 1.55 1.16 0.00 624 C 8.13 4.14 0.00 3.13 3.04 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 0.00 0.00 0.00 625 M 7.76 3.98 0.00 2.31 1.99 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.54 0.00 626 F 8.32 3.91 0.00 3.06 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 0.00 627 A 8.21 3.61 0.99 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 0.00 0.00 628 A 8.33 4.25 1.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.03 4.01 0.00 1.60 1.59 0.87 0.80 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 0.00 630 K 8.21 3.98 0.00 1.30 1.33 0.00 1.45 0.00 0.00 1.36 0.00 0.00 2.64 0.00 0.00 2.89 0.00 0.00 0.00 0.00 0.42 0.32 7.81 631 A 7.81 4.05 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 632 G 8.45 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 0.00 0.00 0.00 633 K 7.82 3.95 0.00 1.97 1.92 0.00 2.08 0.00 0.00 1.72 0.00 0.00 2.99 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.39 1.61 7.81 634 I 7.61 4.29 2.07 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.18 1.16 0.00 0.00 635 Q 8.12 3.95 0.00 2.16 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.93 6.88 0.00 0.00 0.00 0.00 0.00 2.35 2.34 0.00 636 N 8.11 4.64 0.00 2.77 2.86 0.00 0.00 6.86 7.61 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 0.00 637 K 8.16 4.35 0.00 2.00 1.88 0.00 1.72 0.00 0.00 1.67 0.00 0.00 3.03 0.00 0.00 3.20 0.00 0.00 0.00 0.00 1.43 1.45 7.81 638 L 7.62 5.01 0.00 1.67 1.72 0.97 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 639 T 8.79 4.48 4.29 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 0.00 648 I 7.79 4.12 2.03 0.00 0.00 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 1.15 1.12 0.00 0.00 649 A 8.80 4.11 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 650 A 8.28 3.90 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 651 L 8.03 4.26 0.00 2.09 2.08 1.54 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 652 S 8.12 4.88 0.00 4.09 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 0.00 653 H 8.69 4.39 0.00 3.32 3.69 0.00 5.53 0.00 0.00 0.00 0.00 7.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 654 D 7.67 5.00 0.00 2.96 2.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 655 L 7.58 3.46 0.00 1.59 1.41 0.90 0.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 656 D 8.38 4.21 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1.41 1.45 7.81 731 R 7.82 4.32 0.00 1.79 1.86 0.00 3.21 0.00 0.00 3.13 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.77 0.00 732 R 7.68 3.30 0.00 1.34 1.16 0.00 3.31 0.00 0.00 2.58 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.50 0.00 733 G 7.60 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 0.00 734 E 8.09 3.91 0.00 2.05 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 0.00 2.47 2.43 0.00 735 F 7.63 4.21 0.00 3.01 2.90 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 0.00 736 F 7.87 4.29 0.00 3.17 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 0.00 737 E 8.53 3.98 0.00 2.19 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 2.47 2.50 0.00 738 L 8.16 4.05 0.00 1.85 1.85 1.17 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 739 I 7.44 3.53 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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 2.25 2.32 0.00 748 D 7.92 4.56 0.00 2.74 2.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 749 P 0.00 4.24 0.00 2.22 2.12 0.00 3.67 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.17 0.00 750 H 8.26 4.18 0.00 3.26 3.58 0.00 5.87 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 0.00 751 Q 9.38 4.15 0.00 2.38 2.32 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 2.53 2.68 0.00 752 K 8.51 4.07 0.00 2.06 2.01 0.00 1.67 0.00 0.00 1.79 0.00 0.00 3.22 0.00 0.00 3.20 0.00 0.00 0.00 0.00 1.56 1.56 7.81 753 E 8.29 3.95 0.00 2.10 2.12 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 2.29 2.31 0.00 754 L 7.94 3.87 0.00 1.84 1.95 0.89 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 755 F 8.71 3.95 0.00 3.59 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 0.00 756 L 8.44 3.67 0.00 1.80 1.62 0.93 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 757 A 7.73 3.86 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 758 M 7.75 3.85 0.00 1.51 1.48 0.00 0.00 0.00 0.00 0.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 2.30 0.00 759 L 7.55 3.68 0.00 1.09 1.45 0.80 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 760 M 7.67 3.91 0.00 1.98 2.13 0.00 0.00 0.00 0.00 0.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.79 0.00 761 T 7.67 3.66 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 0.33 0.00 0.00 762 A 7.60 3.73 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 763 C 8.10 4.29 0.00 3.06 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 0.00 764 D 8.35 4.40 0.00 2.63 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 0.00 765 L 7.92 4.76 0.00 1.85 1.86 0.77 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 766 S 8.19 4.31 0.00 4.07 4.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 767 A 8.21 4.07 1.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 768 I 8.44 4.06 2.21 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 1.80 1.39 1.12 0.00 0.00 769 T 7.91 4.45 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 0.55 0.00 0.00 770 K 7.51 4.46 0.00 1.79 1.85 0.00 1.80 0.00 0.00 1.77 0.00 0.00 3.08 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.78 1.63 7.81 771 P 0.00 4.40 0.00 2.18 2.03 0.00 3.68 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 2.15 2.19 0.00 772 W 8.92 4.63 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 0.00 773 P 0.00 3.91 0.00 2.11 1.98 0.00 3.61 0.00 0.00 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.22 0.00 774 I 7.49 3.75 2.07 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.72 1.15 0.00 0.00 775 Q 8.13 3.98 0.00 2.24 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.79 0.00 0.00 0.00 0.00 0.00 2.78 2.34 0.00 776 Q 7.71 3.57 0.00 0.93 1.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.59 0.00 0.00 0.00 0.00 0.00 2.07 1.90 0.00 777 R 7.57 4.09 0.00 1.62 1.83 0.00 3.15 0.00 0.00 3.22 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.77 1.51 0.00 778 I 8.24 3.99 2.02 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 1.83 0.72 1.19 0.00 0.00 779 A 8.24 3.88 1.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 780 E 7.92 3.97 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 2.35 2.64 0.00 781 L 7.91 4.07 0.00 2.01 1.92 1.18 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 782 V 7.61 3.27 1.73 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 0.22 0.00 0.00 -0.21 0.00 0.00 783 A 7.50 3.48 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 784 T 8.85 4.25 4.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 785 E 8.68 4.08 0.00 2.34 2.26 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 2.30 2.42 0.00 786 F 8.02 4.27 0.00 2.71 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 0.00 787 F 7.87 5.02 0.00 3.28 2.98 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 0.00 788 D 7.80 5.19 0.00 2.72 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 0.00 789 Q 7.94 4.26 0.00 1.95 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.33 6.65 0.00 0.00 0.00 0.00 0.00 2.17 2.40 0.00 *809 K 8.03 4.82 0.00 1.95 2.24 0.00 2.08 0.00 0.00 1.99 0.00 0.00 2.86 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.60 1.57 7.81 810 K 7.99 3.49 0.00 1.87 1.85 0.00 1.92 0.00 0.00 1.69 0.00 0.00 2.93 0.00 0.00 3.21 0.00 0.00 0.00 0.00 1.40 1.42 7.81 811 N 8.08 4.47 0.00 2.75 2.68 0.00 0.00 6.83 6.68 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 0.00 812 K 7.96 4.28 0.00 1.80 1.80 0.00 1.77 0.00 0.00 1.82 0.00 0.00 2.93 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.52 1.48 7.81 813 I 7.69 3.47 2.05 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.99 0.47 0.00 0.00 814 P 0.00 4.17 0.00 2.27 2.58 0.00 3.73 0.00 0.00 4.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.62 0.00 815 S 7.98 4.15 0.00 3.97 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 0.00 816 M 7.97 4.05 0.00 1.92 2.03 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.69 2.52 0.00 817 Q 8.01 3.81 0.00 1.30 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.81 0.00 0.00 0.00 0.00 0.00 1.60 1.16 0.00 818 V 7.73 3.75 2.26 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 0.97 0.00 0.00 1.12 0.00 0.00 819 G 8.19 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 820 F 8.68 4.25 0.00 3.03 3.23 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 0.00 821 I 8.15 3.51 2.12 0.00 0.00 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.76 0.95 0.00 0.00 822 D 8.34 4.29 0.00 2.67 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 0.00 823 A 8.25 4.18 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 0.00 824 I 7.57 4.34 1.18 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.07 0.88 0.00 0.00 825 C 7.42 4.07 0.00 3.00 3.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 826 L 8.04 3.98 0.00 1.65 1.74 0.97 1.14 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 0.00 827 Q 7.93 3.94 0.00 1.87 1.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 6.93 0.00 0.00 0.00 0.00 0.00 1.16 1.52 0.00 828 L 7.88 4.21 0.00 2.01 1.52 1.05 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 829 Y 7.57 4.25 0.00 3.12 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 0.00 830 E 8.55 4.02 0.00 2.07 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 2.34 2.50 0.00 831 A 7.99 4.05 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 0.00 832 L 8.32 4.19 0.00 2.04 2.00 1.18 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 833 T 8.16 4.20 4.51 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 1.38 0.00 0.00 834 H 7.91 4.24 0.00 3.15 3.48 0.00 5.95 0.00 0.00 0.00 0.00 7.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 835 V 7.71 4.07 2.39 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 0.86 0.00 0.00 0.91 0.00 0.00 836 S 8.34 4.38 0.00 3.95 3.79 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 0.00 837 E 8.97 4.16 0.00 2.09 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 2.34 2.36 0.00 838 D 8.20 4.67 0.00 3.05 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 0.00 839 C 8.43 4.55 0.00 3.19 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 0.00 840 F 8.12 4.18 0.00 3.36 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 0.00 841 P 0.00 3.96 0.00 1.61 2.08 0.00 3.46 0.00 0.00 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.32 0.00 842 L 7.00 3.47 0.00 1.51 0.93 0.93 0.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.63 0.00 0.00 0.00 0.00 0.00 0.00 843 L 7.29 3.76 0.00 1.71 1.56 0.94 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 844 D 7.54 4.03 0.00 1.58 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 0.00 0.00 0.00 0.00 845 G 7.94 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 0.00 0.00 0.00 846 C 7.65 4.34 0.00 2.88 3.01 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 0.00 847 R 8.09 3.96 0.00 1.99 1.94 0.00 3.14 0.00 0.00 3.18 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.75 0.00 848 K 8.08 3.95 0.00 1.96 1.82 0.00 1.63 0.00 0.00 1.63 0.00 0.00 2.94 0.00 0.00 3.30 0.00 0.00 0.00 0.00 1.42 1.60 7.81 849 N 8.25 4.43 0.00 3.06 3.20 0.00 0.00 6.65 7.69 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 0.00 850 R 8.23 4.11 0.00 1.97 2.13 0.00 3.17 0.00 0.00 3.26 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.76 0.00 851 Q 8.03 3.97 0.00 2.22 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.58 0.00 0.00 0.00 0.00 0.00 2.35 2.60 0.00 852 K 7.61 3.38 0.00 0.79 0.74 0.00 0.61 0.00 0.00 1.00 0.00 0.00 2.65 0.00 0.00 2.67 0.00 0.00 0.00 0.00 1.19 0.82 7.81 853 W 8.26 4.55 0.00 3.45 3.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 854 Q 8.77 4.02 0.00 2.24 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.79 0.00 0.00 0.00 0.00 0.00 2.37 2.43 0.00 855 A 7.92 3.99 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 856 L 7.95 4.12 0.00 2.15 1.90 1.11 0.72 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 0.00 857 A 8.30 4.20 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 0.00 858 E 8.05 4.34 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 2.35 2.45 0.00 859 Q 10.01 3.97 0.00 2.13 2.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.06 6.67 0.00 0.00 0.00 0.00 0.00 2.28 2.31 0.00 860 Q 8.21 4.17 0.00 1.98 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.65 0.00 0.00 0.00 0.00 0.00 2.26 2.44 0.00 * Residues marked with a * may have inaccurate shift predictions.