NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 501 I 4.2121 8.0249 121.4522 61.8591 38.3424 173.8441 502 T 4.3871 8.0898 120.7365 63.3625 74.8625 168.8461 503 R 3.7057 8.0878 126.4717 55.4852 31.2109 175.4434 504 K 4.3537 8.5775 123.8211 54.9256 32.9540 176.1838 505 L 4.5371 8.4182 126.0834 55.4874 43.2770 176.1285 506 I 4.9106 8.5768 120.6281 59.8187 42.0243 173.9792 507 L 5.0617 9.3610 128.7537 53.3625 44.4499 174.7192 508 A 5.2717 9.3197 128.9627 50.0116 22.4675 174.8825 509 G 4.1594 9.4043 109.0053 44.7097 0.0000 172.1065 510 N 4.9878 9.6715 127.4015 51.5589 38.1467 175.0029 511 W 4.5489 8.4316 124.3287 57.6402 29.6730 178.0751 512 K 4.4413 7.4734 117.7329 57.2912 29.8570 177.1680 513 M 4.3743 8.2744 115.9151 55.5861 30.6742 175.4867 514 H 4.8421 8.2161 116.0526 55.3143 32.6893 173.9943 515 K 4.8766 8.1830 116.4443 54.6773 34.8674 175.4296 516 T 4.6211 8.2547 110.9850 60.1016 70.8630 175.7466 517 I 3.8269 8.5069 123.6407 65.3386 36.9093 178.1250 518 S 4.2218 8.1174 114.7298 60.9824 63.2325 175.7895 519 E 3.9137 8.1828 121.1676 58.7217 29.3706 179.6264 520 A 4.1227 8.5683 120.8017 55.3206 18.5656 179.5645 521 K 3.8988 8.3337 116.7669 60.5179 32.1505 178.7879 522 K 4.0913 8.4252 118.8835 58.0370 31.8641 178.6953 523 F 4.4001 8.5244 120.3096 61.9134 39.5934 178.2567 524 V 3.4212 8.0375 117.3977 66.1205 31.1299 178.0024 525 S 4.1052 7.8976 114.4295 61.5778 62.7089 176.0921 526 L 4.0273 7.9110 122.9119 58.5597 41.7248 179.1548 527 L 3.9966 7.9435 118.1068 58.0197 41.4455 179.5455 528 V 3.5838 7.8492 117.0858 65.9960 31.2719 176.9869 529 N 4.7160 7.6374 114.3302 55.1759 39.2662 176.7628 530 E 4.1143 8.0299 118.9662 58.8525 31.0095 178.3598 531 L 4.4277 7.5976 119.2806 53.8602 40.6010 176.2853 532 H 4.3673 7.9045 120.0846 58.4653 30.8191 175.3719 533 D 4.4004 7.9420 115.8637 54.9832 41.4408 175.7251 534 V 3.6695 7.5831 117.7868 63.7960 30.6357 174.7846 535 K 4.4791 8.1720 123.8739 56.2179 33.5989 176.6444 536 E 4.3575 7.8983 115.9444 56.6677 30.1195 174.9247 537 F 4.7972 6.8274 113.1280 57.0175 40.7504 172.2426 538 E 4.7357 8.7814 118.1453 54.8000 32.1357 175.4723 539 I 5.0145 8.3129 124.7627 59.6770 39.9238 174.6203 540 V 4.8043 9.0591 126.7632 61.1075 34.6427 174.3683 541 V 4.4161 8.5514 120.7770 59.8995 34.2766 174.7640 542 C 5.7100 8.1442 122.2569 56.1320 28.9375 171.8795 543 P 3.7825 0.0000 0.0000 60.5178 32.7824 174.7094 544 P 4.1392 0.0000 0.0000 62.1420 32.2681 177.5272 545 F 4.2685 8.4035 120.6672 61.2869 39.0526 177.9592 546 T 3.8812 8.2262 108.2414 64.4252 68.1398 174.5968 547 A 4.8005 8.0705 124.6701 51.7532 20.0040 178.8179 548 L 4.1007 8.0607 122.1951 58.7421 42.0885 178.4705 549 S 4.0889 8.0378 111.3187 61.4669 62.6679 175.4529 550 E 4.0316 8.0867 121.3685 59.4037 29.4630 178.6781 551 V 3.7379 7.5025 118.3894 65.8973 31.0362 178.0666 552 G 3.7390 8.4938 105.8711 48.1284 0.0000 175.3658 553 E 4.2206 8.0627 121.4854 57.9108 29.3937 178.7110 554 I 4.0503 7.4073 118.0860 62.6704 37.4113 176.3030 555 L 4.5111 7.5683 118.3439 54.5908 43.3016 174.7295 556 S 4.2742 7.3242 114.4710 61.9131 62.1729 174.5971 557 G 3.9964 8.7785 113.8304 45.4221 0.0000 172.3667 558 R 4.3015 8.0089 118.7419 55.3384 31.4672 175.9328 559 N 4.5020 8.5221 115.1857 55.7731 37.9073 176.1204 560 I 3.9794 7.5888 118.4223 61.2934 37.8775 175.8183 561 K 4.6702 8.7808 124.9978 54.6007 35.1514 175.1959 562 L 4.4857 8.4160 125.0281 54.6341 43.6973 175.6619 563 G 4.5409 8.8716 111.8207 44.7956 0.0000 171.4595 564 A 4.8481 9.0218 125.0014 50.3654 21.8084 177.7659 565 Q 4.1930 7.8962 116.5133 55.4317 29.4206 175.1777 566 N 4.5836 7.3874 115.4426 53.9296 41.4105 172.9987 567 V 4.5073 8.1907 119.6550 61.9836 34.4100 172.6522 568 F 4.8345 8.4802 126.3905 56.6201 40.8472 175.4466 569 Y 4.1099 5.5582 121.0232 57.5926 38.3565 175.2297 570 E 4.5231 6.7541 119.8980 55.1958 31.4700 175.4545 571 D 4.5609 8.4452 119.6094 56.4924 41.4766 176.8942 572 Q 4.5398 7.2515 113.4345 55.2067 30.3560 173.7527 573 G 3.9439 8.3583 105.5713 44.8414 0.0000 173.4516 574 A 4.1119 7.1484 121.6419 51.2548 16.7192 177.3352 575 F 4.7424 7.3403 119.7860 54.7455 40.5272 173.3349 576 T 3.9330 7.8479 118.5678 65.2153 68.9435 175.0172 577 G 3.8880 8.9110 113.8539 45.2214 0.0000 172.7490 578 E 4.5081 7.4800 118.2216 54.8701 31.6183 175.4260 579 I 4.3711 7.9063 122.5923 59.6139 39.7795 175.2097 580 S 4.9426 8.2821 120.3682 56.3457 65.4148 173.3611 581 P 4.2642 0.0000 0.0000 65.7369 31.0474 179.0559 582 L 3.9901 7.8343 117.4949 57.9729 41.1180 179.2081 583 M 4.0929 7.8592 118.2754 58.2495 31.8169 178.7935 584 L 3.9167 7.7661 119.2999 57.6401 41.7648 179.1640 585 Q 3.9792 8.4183 119.9053 58.8174 28.6849 177.9314 586 E 3.8881 7.8663 119.6436 59.4279 29.9150 178.7942 587 I 3.8798 7.0071 117.4664 62.3934 37.2843 176.3481 588 G 3.7824 7.7553 107.4952 46.0022 0.0000 173.8469 589 V 3.9358 7.5103 118.7460 62.2639 32.5681 175.0952 590 E 4.5536 9.3971 125.2602 56.6359 32.4636 175.4417 591 Y 5.0698 8.0139 115.6905 55.9969 42.2399 175.1402 592 V 4.8384 8.6727 121.6859 61.1838 34.8552 174.5884 593 I 4.2961 8.6694 129.9695 61.3801 37.8957 175.8923 594 V 4.2753 8.7624 126.1879 61.7229 35.0528 175.7211 595 G 3.6916 9.0676 114.9755 47.1176 0.0000 173.6039 596 H 4.2105 8.1447 118.2774 55.4568 31.7350 175.0502 597 S 4.1324 8.6294 123.7903 62.2043 62.6784 176.9630 598 E 3.9502 8.5188 120.2323 59.7191 29.2355 179.6799 599 R 4.3405 8.0580 117.4041 59.2894 30.0360 179.1687 600 R 4.2089 7.9746 118.3282 59.0473 30.1966 179.0983 601 R 4.0513 8.5704 117.1947 59.3504 30.2765 178.3575 602 I 3.6160 7.8670 119.0865 63.7823 37.2073 177.5363 603 F 4.6811 7.7009 116.6659 57.9843 39.4929 175.8995 604 K 3.8765 7.8986 116.8530 57.2474 29.2969 175.0995 605 E 3.8683 7.9116 121.4625 55.3482 30.0793 175.5305 606 D 4.7267 8.2766 126.6607 51.9744 42.7489 176.8577 607 D 4.4126 8.5594 118.8786 57.8349 40.6544 178.8884 608 E 4.1094 8.3052 118.9849 59.0814 29.4843 178.5149 609 F 3.9252 8.9150 121.1171 61.3981 39.5570 177.3170 610 I 3.8787 8.2861 119.8784 64.2683 36.8411 177.9079 611 N 4.2863 8.7808 118.4237 56.8101 38.7158 177.1862 612 R 3.7116 7.6185 119.4300 59.0601 29.9079 179.2353 613 K 3.9720 7.7294 118.5306 59.0726 31.9655 179.7001 614 V 3.4861 7.6615 118.7213 65.9051 31.4212 178.2539 615 K 3.8408 7.9126 117.9904 59.2436 31.8497 179.0001 616 A 3.9079 8.0189 121.1120 55.3332 18.3579 179.7337 617 V 3.5983 7.9402 116.7476 66.2613 31.5219 178.2086 618 L 4.0653 7.8443 118.5843 57.7878 41.1922 179.1485 619 E 3.8865 8.1249 117.7696 59.4790 29.4933 178.1119 620 K 4.2364 7.6262 113.8684 56.1440 31.9284 176.9646 621 G 3.7622 8.0377 106.7209 46.9781 0.0000 173.5579 622 M 4.5725 7.6674 117.8429 53.4273 35.5371 175.4896 623 T 4.3606 8.4125 116.8770 61.4832 70.3325 173.0883 624 P 4.8191 0.0000 0.0000 62.4751 33.3077 175.6944 625 I 4.8377 8.4292 123.2395 59.2722 39.4297 173.2592 626 L 4.6419 8.8407 129.4494 54.8750 43.1251 174.9613 627 C 5.1719 8.5991 124.5736 58.6297 29.7779 173.6504 628 V 4.7008 8.9459 115.4134 59.3231 36.0192 174.8755 629 G 4.7321 8.8598 113.0939 46.0502 0.0000 172.4343 630 E 4.8980 8.2828 120.6853 55.6244 32.6339 174.7387 631 T 4.8618 8.2659 116.2602 61.8870 71.3074 176.1714 632 L 3.9305 8.8915 124.0796 58.7565 42.0567 178.8852 633 E 3.9639 8.2892 117.7936 59.5835 29.3080 179.1784 634 E 3.9954 8.0886 117.9426 59.5494 29.7876 179.3064 635 R 4.0063 8.4381 120.3740 58.7750 29.8922 178.2582 636 E 4.0849 8.2326 117.6255 58.1801 29.5483 178.1696 637 K 4.4492 7.6380 116.2010 55.5135 32.5409 177.0729 638 G 3.9181 7.6593 106.9775 46.8123 0.0000 174.7250 639 L 4.5062 8.1709 118.1543 54.7268 41.0509 178.3696 640 T 3.8361 7.8762 117.6070 67.1432 68.3008 176.1648 641 F 3.6947 7.9557 118.6727 60.5881 38.8852 177.3433 642 C 4.3060 8.1372 115.7378 62.1706 28.1887 176.2022 643 V 3.6237 8.0683 120.4337 65.9443 31.1112 178.2799 644 V 3.6653 8.0227 118.1528 65.9351 31.4230 177.5072 645 E 4.0032 8.7520 119.4019 59.2099 29.4566 178.5170 646 K 3.9057 8.2703 119.6171 59.9516 32.2818 178.7693 647 Q 4.0792 8.1273 117.8762 58.7536 28.4959 178.9793 648 V 3.8555 8.1127 119.6529 65.9701 31.6573 178.3317 649 R 4.0229 8.5760 118.1921 59.3411 29.7148 178.7447 650 E 4.0503 8.4259 117.4288 59.5458 29.6261 179.1980 651 G 3.8881 8.0532 104.2776 48.0807 0.0000 175.1078 652 F 4.3081 8.8593 119.2945 57.7154 39.0805 175.1305 653 Y 4.4665 7.5175 119.3992 59.6375 38.7828 175.8335 654 G 3.7756 8.6203 115.0673 45.3480 0.0000 173.6229 655 L 4.5695 8.1260 118.4972 53.6805 42.5558 175.7246 656 D 5.3091 8.1590 119.2708 50.8766 43.6117 176.9265 657 K 3.9329 8.6018 119.7967 59.7815 32.0173 177.6101 658 E 3.9553 8.1105 117.0728 59.6950 29.4763 178.9982 659 E 4.0456 8.3577 117.6661 59.3069 29.5228 179.0658 660 A 4.1246 8.5585 121.1939 55.2674 18.0757 179.8431 661 K 3.9418 7.5146 116.0830 59.6100 32.1629 179.4969 662 R 4.0590 7.6556 116.8526 57.6975 30.2942 177.3744 663 V 3.8516 6.7585 117.9886 62.7846 32.7211 175.5678 664 V 4.6375 8.3545 124.4044 61.3436 34.4302 174.5949 665 I 5.0517 8.7740 128.1120 60.0730 40.1831 174.9893 666 A 4.9082 8.8371 125.8254 50.6753 22.3165 174.8448 667 Y 4.6595 9.1252 125.4749 57.8895 39.5912 173.9797 668 E 3.7787 9.1848 129.1365 52.3220 30.9119 170.8885 669 P 3.8592 0.0000 0.0000 62.3336 31.8021 177.5276 670 V 3.3709 8.2593 125.6404 65.4964 31.5659 177.4905 671 W 4.4746 7.4689 112.2421 57.2862 27.6997 175.7068 672 A 4.6816 7.3837 119.8978 50.8841 19.1552 176.3880 673 I 4.0277 7.6819 121.3152 61.8462 37.1853 177.2321 674 G 3.9915 8.6798 113.4810 46.0496 0.0000 173.0352 675 T 4.1821 7.6298 109.5644 61.3738 69.5114 176.3880 676 G 4.2043 8.2522 111.6536 46.2837 0.0000 174.8513 677 R 4.3646 7.5808 119.3099 55.8695 27.8154 176.0838 678 V 3.8635 7.5573 118.2845 61.9124 32.4136 175.8348 679 A 5.1260 8.4238 123.0606 50.4333 20.6825 177.3757 680 T 4.0336 8.7015 112.6455 61.0936 69.4987 173.8544 681 P 4.2326 0.0000 0.0000 65.3783 31.2333 178.7663 682 Q 3.9802 7.9946 117.2738 58.7246 28.8903 177.7959 683 Q 4.0532 8.2169 118.5721 59.4796 28.9239 179.0562 684 A 4.2899 8.0659 121.1453 55.6577 18.2774 179.1523 685 Q 3.8905 8.1840 117.0248 59.3653 29.1997 178.2386 686 E 3.9877 8.7588 120.3823 59.6271 29.5412 179.0281 687 V 3.4952 7.7514 117.4175 66.4981 31.2725 177.5646 688 H 4.0594 8.5610 115.7229 59.0703 28.5756 177.6230 689 A 4.3135 8.4335 124.0475 54.4697 18.2056 179.3200 690 F 4.2008 8.2292 118.7840 61.7079 39.6446 177.2814 691 I 3.6611 8.2055 119.6082 64.2653 36.6662 177.9233 692 R 4.0680 7.3223 117.8303 58.0961 30.3700 177.9909 693 K 4.0349 7.7228 119.7162 59.0305 32.1352 178.3420 694 L 3.6785 7.9217 120.9440 58.3435 41.9746 178.9341 695 L 3.8557 7.6389 118.5904 57.7770 41.3804 179.8050 696 S 4.2349 7.8897 113.1483 61.3824 62.1554 176.0542 697 E 4.0084 7.9193 119.4812 59.5876 29.3938 178.5404 698 M 3.9987 7.9922 117.8456 57.0593 32.2257 176.2688 699 Y 4.2409 7.9415 111.8171 57.1572 39.9571 176.9539 700 D 4.7116 8.4549 125.6965 52.7165 44.2335 175.9766 701 E 3.9088 8.6014 118.4882 59.6257 29.1720 178.8255 702 E 3.9156 8.2206 117.1625 59.8852 29.8001 178.6565 703 T 3.9324 8.4049 115.0835 66.7619 68.4059 176.5051 704 A 4.1757 7.9983 121.0658 54.7504 18.3734 179.0992 705 G 3.7832 7.7645 102.0009 46.3771 0.0000 175.5918 706 S 4.5885 8.1045 116.8839 59.3546 63.2765 174.5796 707 I 3.9445 7.2862 122.5742 60.9372 37.2983 175.6019 708 R 4.4815 8.6347 125.4023 56.0805 31.6282 175.6749 709 I 4.9488 9.5523 124.9205 59.7934 39.5221 175.0377 710 L 5.0700 8.9860 127.9177 53.9194 43.9910 175.6282 711 Y 5.1304 8.8700 122.2032 56.6688 41.2123 176.4215 712 G 3.9552 6.3993 105.9814 46.1557 0.0000 173.8321 713 G 4.3705 5.3800 106.4206 46.3460 0.0000 176.0101 714 S 4.6829 9.0388 114.7619 56.5181 63.2214 174.5305 715 I 3.8977 7.7587 120.4783 62.0841 37.4605 176.2536 716 K 4.6612 8.8520 125.0215 53.4894 34.3252 176.2625 717 P 4.4073 0.0000 0.0000 65.4185 31.5521 177.7020 718 D 4.5548 8.1906 118.4122 55.9656 40.0796 177.5679 719 N 4.4866 8.1331 117.8030 54.5349 38.1839 176.4391 720 F 4.1445 8.2394 120.9460 61.4782 39.2541 176.9774 721 L 3.8686 7.9547 119.5453 57.6279 41.8012 178.2050 722 G 3.7423 8.0367 103.2925 45.6088 0.0000 174.0494 723 L 4.3600 6.9139 119.4315 56.3549 43.0446 178.6285 724 I 3.5522 6.6605 110.9208 63.4637 37.1871 178.0589 725 V 3.6483 7.3954 120.3142 63.7434 31.7455 176.5479 726 Q 4.0239 7.1004 117.1567 55.5794 29.4880 177.3606 727 K 4.0912 8.7286 121.0150 59.5355 32.3346 178.5733 728 D 4.9530 7.8695 117.7145 54.2482 41.3277 176.2119 729 I 4.7717 7.6905 120.1439 60.0480 39.0586 175.3005 730 D 4.7177 9.3760 125.4713 53.4589 41.6634 177.5993 731 G 4.6734 6.4382 105.5211 45.9395 0.0000 171.1717 732 G 4.5626 7.8822 105.0222 44.7451 0.0000 172.1021 733 L 4.9561 9.0536 125.8640 53.2728 43.0330 174.7451 734 V 3.8891 9.2432 127.3047 63.1635 33.2868 173.8935 735 G 3.7193 9.1093 116.7398 46.4545 0.0000 175.4326 736 G 3.7834 9.6004 110.0714 48.2193 0.0000 174.3219 737 A 3.5794 8.1464 122.4958 54.1792 18.4013 178.8611 738 S 4.4758 8.0121 110.9413 59.8458 63.4369 176.2003 739 L 3.8086 8.3409 123.9993 58.4339 42.3418 177.5621 740 K 3.9674 7.6505 116.8744 55.7974 33.9012 176.8365 741 E 4.3674 8.4589 117.2962 58.4002 29.5340 178.4507 742 S 4.3349 8.1417 114.5823 61.2858 62.6668 176.1983 743 F 4.0965 7.9391 123.8839 61.4248 38.9694 177.1136 744 I 3.8210 8.3900 118.3195 63.6975 37.0902 177.9232 745 E 4.0565 7.9408 120.3254 59.1816 29.6900 178.0736 746 L 3.8846 7.9756 118.9517 58.1249 41.4976 179.5820 747 A 3.9769 7.5578 118.8574 54.9925 18.4705 179.5752 748 R 4.0143 8.3885 117.6773 59.6892 30.2044 178.3375 749 I 3.7274 7.8939 119.1239 65.1851 36.9579 177.9755 750 M 3.9142 8.1197 117.5812 58.5122 31.9838 178.6341 751 R 4.3966 8.3501 118.7741 58.3228 30.4508 176.6825 752 G 4.0637 8.0251 106.0566 43.8928 0.0000 175.0712 753 V 4.4254 7.1970 114.0131 63.3442 33.7235 172.8793 754 I 4.5678 7.3852 118.8876 60.0978 40.9470 176.2304 *755 S 4.2984 8.5999 117.4694 58.5286 62.8225 174.8011 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 501 I 8.02 4.21 1.88 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 1.42 1.07 0.92 0.00 0.00 502 T 8.09 4.39 4.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 503 R 8.09 3.71 0.00 1.98 1.98 0.00 3.52 0.00 0.00 3.20 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.75 0.00 504 K 8.58 4.35 0.00 1.77 1.79 0.00 1.85 0.00 0.00 1.93 0.00 0.00 2.98 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.51 1.55 7.81 505 L 8.42 4.54 0.00 1.53 1.44 0.94 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 506 I 8.58 4.91 1.91 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 1.17 0.89 0.82 0.00 0.00 507 L 9.36 5.06 0.00 1.62 1.58 0.56 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.00 0.00 0.00 0.00 0.00 0.00 508 A 9.32 5.27 1.16 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 0.00 0.00 509 G 9.40 4.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 510 N 9.67 4.99 0.00 2.83 2.88 0.00 0.00 6.77 6.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 511 W 8.43 4.55 0.00 3.21 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 0.00 512 K 7.47 4.44 0.00 2.17 1.80 0.00 1.69 0.00 0.00 1.60 0.00 0.00 2.90 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.46 1.61 7.81 513 M 8.27 4.37 0.00 1.90 1.95 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.52 0.00 514 H 8.22 4.84 0.00 3.28 3.24 0.00 5.90 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 0.00 515 K 8.18 4.88 0.00 1.97 1.75 0.00 0.86 0.00 0.00 1.49 0.00 0.00 2.21 0.00 0.00 2.39 0.00 0.00 0.00 0.00 1.24 1.29 7.81 516 T 8.25 4.62 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 1.24 0.00 0.00 517 I 8.51 3.83 1.91 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.59 0.95 0.00 0.00 518 S 8.12 4.22 0.00 4.06 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 0.00 519 E 8.18 3.91 0.00 2.07 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 2.31 2.36 0.00 520 A 8.57 4.12 1.68 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 0.00 0.00 521 K 8.33 3.90 0.00 1.99 1.94 0.00 1.71 0.00 0.00 1.68 0.00 0.00 2.96 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.51 1.83 7.81 522 K 8.43 4.09 0.00 2.03 1.78 0.00 1.71 0.00 0.00 1.57 0.00 0.00 2.93 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.48 1.73 7.81 523 F 8.52 4.40 0.00 2.99 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 0.00 524 V 8.04 3.42 2.14 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 0.97 0.00 0.00 1.17 0.00 0.00 525 S 7.90 4.11 0.00 4.05 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 0.00 526 L 7.91 4.03 0.00 1.87 2.02 0.99 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 527 L 7.94 4.00 0.00 1.91 1.71 1.25 0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 528 V 7.85 3.58 2.24 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 0.85 0.00 0.00 1.03 0.00 0.00 529 N 7.64 4.72 0.00 2.88 2.86 0.00 0.00 7.03 7.42 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 0.00 530 E 8.03 4.11 0.00 2.02 2.07 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 2.67 2.59 0.00 531 L 7.60 4.43 0.00 1.65 1.60 0.95 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 532 H 7.90 4.37 0.00 3.29 3.30 0.00 5.72 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 533 D 7.94 4.40 0.00 2.69 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 0.00 534 V 7.58 3.67 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 0.21 0.00 0.00 0.87 0.00 0.00 535 K 8.17 4.48 0.00 1.79 1.74 0.00 1.59 0.00 0.00 1.73 0.00 0.00 3.00 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.21 1.41 7.81 536 E 7.90 4.36 0.00 2.27 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.25 2.34 0.00 537 F 6.83 4.80 0.00 3.21 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 0.00 538 E 8.78 4.74 0.00 1.91 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 2.34 0.00 539 I 8.31 5.01 1.95 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 1.24 0.72 1.16 0.00 0.00 540 V 9.06 4.80 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.83 0.00 0.00 0.34 0.00 0.00 541 V 8.55 4.42 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.63 0.00 0.00 0.84 0.00 0.00 542 C 8.14 5.71 0.00 2.73 2.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 543 P 0.00 3.78 0.00 1.69 0.49 0.00 3.47 0.00 0.00 2.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.49 0.00 544 P 0.00 4.14 0.00 2.20 1.96 0.00 3.71 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 2.20 2.33 0.00 545 F 8.40 4.27 0.00 3.09 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 0.00 546 T 8.23 3.88 4.29 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 1.27 0.00 0.00 547 A 8.07 4.80 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 0.00 548 L 8.06 4.10 0.00 1.74 1.69 1.03 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 549 S 8.04 4.09 0.00 3.87 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 550 E 8.09 4.03 0.00 2.14 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 2.41 2.45 0.00 551 V 7.50 3.74 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 0.89 0.00 0.00 1.03 0.00 0.00 552 G 8.49 3.74 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 553 E 8.06 4.22 0.00 2.07 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 2.33 2.36 0.00 554 I 7.41 4.05 2.02 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 1.54 0.66 0.93 0.00 0.00 555 L 7.57 4.51 0.00 1.72 1.65 0.96 0.76 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 0.00 556 S 7.32 4.27 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 0.00 557 G 8.78 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 0.00 0.00 0.00 558 R 8.01 4.30 0.00 1.84 1.90 0.00 3.33 0.00 0.00 3.27 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.82 0.00 559 N 8.52 4.50 0.00 2.74 2.85 0.00 0.00 5.96 7.81 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 0.00 560 I 7.59 3.98 1.86 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 1.35 0.53 0.98 0.00 0.00 561 K 8.78 4.67 0.00 1.73 1.89 0.00 1.98 0.00 0.00 1.93 0.00 0.00 2.84 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.48 1.51 7.81 562 L 8.42 4.49 0.00 1.72 1.51 0.89 0.75 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 0.00 563 G 8.87 4.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 9.02 4.85 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 0.00 565 Q 7.90 4.19 0.00 1.76 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.99 6.90 0.00 0.00 0.00 0.00 0.00 2.43 2.07 0.00 566 N 7.39 4.58 0.00 2.63 2.78 0.00 0.00 6.78 7.71 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 0.00 567 V 8.19 4.51 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 0.84 0.00 0.00 1.01 0.00 0.00 568 F 8.48 4.83 0.00 2.92 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 0.00 569 Y 5.56 4.11 0.00 2.71 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 0.00 570 E 6.75 4.52 0.00 1.96 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 1.73 2.21 0.00 571 D 8.45 4.56 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 0.00 572 Q 7.25 4.54 0.00 2.13 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 7.16 0.00 0.00 0.00 0.00 0.00 2.15 2.26 0.00 573 G 8.36 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 0.00 0.00 0.00 574 A 7.15 4.11 0.93 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 0.00 575 F 7.34 4.74 0.00 2.75 2.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 576 T 7.85 3.93 4.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 577 G 8.91 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 578 E 7.48 4.51 0.00 1.77 1.61 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 2.02 1.67 0.00 579 I 7.91 4.37 1.40 0.00 0.00 0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.34 -0.36 0.66 0.00 0.00 580 S 8.28 4.94 0.00 4.08 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 0.00 581 P 0.00 4.26 0.00 2.16 2.12 0.00 3.65 0.00 0.00 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.22 0.00 582 L 7.83 3.99 0.00 1.72 1.70 0.96 0.98 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 0.00 583 M 7.86 4.09 0.00 2.03 2.16 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 2.63 2.55 0.00 584 L 7.77 3.92 0.00 1.80 1.73 1.03 1.02 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 0.00 585 Q 8.42 3.98 0.00 2.14 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.81 0.00 0.00 0.00 0.00 0.00 2.34 2.35 0.00 586 E 7.87 3.89 0.00 2.03 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 2.32 2.35 0.00 587 I 7.01 3.88 1.87 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 1.46 0.81 0.91 0.00 0.00 588 G 7.76 3.78 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 0.00 0.00 0.00 589 V 7.51 3.94 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.90 0.00 0.00 1.01 0.00 0.00 590 E 9.40 4.55 0.00 2.04 1.81 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 2.18 2.26 0.00 591 Y 8.01 5.07 0.00 2.90 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 0.00 592 V 8.67 4.84 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 1.01 0.00 0.00 0.94 0.00 0.00 593 I 8.67 4.30 1.87 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 1.13 0.76 0.96 0.00 0.00 594 V 8.76 4.28 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.00 0.00 1.01 0.00 0.00 595 G 9.07 3.69 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 0.00 0.00 0.00 596 H 8.14 4.21 0.00 3.22 3.18 0.00 5.71 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 597 S 8.63 4.13 0.00 3.92 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 0.00 598 E 8.52 3.95 0.00 2.02 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 2.43 2.44 0.00 599 R 8.06 4.34 0.00 2.07 2.05 0.00 3.09 0.00 0.00 3.36 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.77 0.00 600 R 7.97 4.21 0.00 1.92 2.02 0.00 3.46 0.00 0.00 3.10 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.81 0.00 601 R 8.57 4.05 0.00 1.70 1.94 0.00 3.33 0.00 0.00 3.23 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.81 0.00 602 I 7.87 3.62 1.53 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.33 -0.11 0.00 0.00 603 F 7.70 4.68 0.00 3.16 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 0.00 604 K 7.90 3.88 0.00 1.78 1.91 0.00 1.58 0.00 0.00 1.69 0.00 0.00 3.03 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.37 1.45 7.81 605 E 7.91 3.87 0.00 2.09 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 2.30 1.75 0.00 606 D 8.28 4.73 0.00 3.04 2.84 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 0.00 607 D 8.56 4.41 0.00 2.75 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 0.00 608 E 8.31 4.11 0.00 2.06 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.35 0.00 609 F 8.92 3.93 0.00 3.41 3.21 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 0.00 610 I 8.29 3.88 2.09 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.85 0.96 0.00 0.00 611 N 8.78 4.29 0.00 2.80 2.96 0.00 0.00 7.18 7.62 0.00 0.00 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 R 7.62 3.71 0.00 1.33 1.07 0.00 2.21 0.00 0.00 2.25 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 1.51 0.00 613 K 7.73 3.97 0.00 1.95 1.89 0.00 1.87 0.00 0.00 1.84 0.00 0.00 3.23 0.00 0.00 3.68 0.00 0.00 0.00 0.00 1.50 1.76 7.81 614 V 7.66 3.49 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.82 0.00 0.00 0.89 0.00 0.00 615 K 7.91 3.84 0.00 1.75 1.76 0.00 1.62 0.00 0.00 1.56 0.00 0.00 2.86 0.00 0.00 3.18 0.00 0.00 0.00 0.00 1.38 1.56 7.81 616 A 8.02 3.91 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 0.00 617 V 7.94 3.60 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.00 0.00 0.95 0.00 0.00 618 L 7.84 4.07 0.00 1.87 1.64 0.82 0.89 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 0.00 619 E 8.12 3.89 0.00 2.09 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 0.00 2.50 2.40 0.00 620 K 7.63 4.24 0.00 1.76 1.80 0.00 1.97 0.00 0.00 1.68 0.00 0.00 2.98 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.42 1.50 7.81 621 G 8.04 3.76 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 0.00 0.00 0.00 622 M 7.67 4.57 0.00 1.92 2.00 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 2.48 2.41 0.00 623 T 8.41 4.36 3.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 624 P 0.00 4.82 0.00 1.99 1.89 0.00 3.46 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 1.99 2.03 0.00 625 I 8.43 4.84 1.94 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 1.06 0.96 0.00 0.00 626 L 8.84 4.64 0.00 1.74 1.56 0.94 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 627 C 8.60 5.17 0.00 3.02 2.74 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 0.00 0.00 0.00 0.00 628 V 8.95 4.70 2.29 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 0.84 0.00 0.00 1.09 0.00 0.00 629 G 8.86 4.73 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 0.00 0.00 0.00 630 E 8.28 4.90 0.00 2.14 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 0.00 2.72 2.52 0.00 631 T 8.27 4.86 4.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 632 L 8.89 3.93 0.00 1.88 1.72 0.75 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 633 E 8.29 3.96 0.00 2.12 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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0.00 0.00 0.00 0.00 0.00 642 C 8.14 4.31 0.00 3.03 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 0.00 643 V 8.07 3.62 2.34 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 1.11 0.00 0.00 1.10 0.00 0.00 644 V 8.02 3.67 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 1.14 0.00 0.00 0.94 0.00 0.00 645 E 8.75 4.00 0.00 2.52 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.38 2.37 0.00 646 K 8.27 3.91 0.00 1.95 2.06 0.00 1.71 0.00 0.00 1.68 0.00 0.00 2.97 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.48 1.52 7.81 647 Q 8.13 4.08 0.00 2.38 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.61 0.00 0.00 0.00 0.00 0.00 2.44 2.75 0.00 648 V 8.11 3.86 2.14 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 1.15 0.00 0.00 1.05 0.00 0.00 649 R 8.58 4.02 0.00 2.08 1.99 0.00 3.21 0.00 0.00 3.17 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.83 0.00 650 E 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0.00 0.00 0.00 0.00 0.00 675 T 7.63 4.18 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 1.31 0.00 0.00 676 G 8.25 4.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 677 R 7.58 4.36 0.00 2.23 2.18 0.00 3.24 0.00 0.00 3.40 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.67 0.00 678 V 7.56 3.86 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 0.78 0.00 0.00 1.15 0.00 0.00 679 A 8.42 5.13 1.60 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 0.00 0.00 0.00 680 T 8.70 4.03 4.39 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 1.29 0.00 0.00 681 P 0.00 4.23 0.00 2.12 2.22 0.00 3.57 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.04 0.00 682 Q 7.99 3.98 0.00 2.16 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.82 0.00 0.00 0.00 0.00 0.00 2.46 2.51 0.00 683 Q 8.22 4.05 0.00 2.43 2.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.74 0.00 0.00 0.00 0.00 0.00 2.47 2.49 0.00 684 A 8.07 4.29 1.12 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 0.00 685 Q 8.18 3.89 0.00 2.20 2.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.67 0.00 0.00 0.00 0.00 0.00 2.37 2.46 0.00 686 E 8.76 3.99 0.00 2.18 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 2.59 2.50 0.00 687 V 7.75 3.50 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 0.02 0.00 0.00 0.66 0.00 0.00 688 H 8.56 4.06 0.00 3.41 3.58 0.00 5.69 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 0.00 689 A 8.43 4.31 1.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 690 F 8.23 4.20 0.00 3.41 3.45 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 0.00 691 I 8.21 3.66 1.98 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.73 0.88 0.00 0.00 692 R 7.32 4.07 0.00 1.94 2.08 0.00 3.32 0.00 0.00 3.16 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.73 0.00 693 K 7.72 4.03 0.00 2.00 1.79 0.00 1.71 0.00 0.00 1.60 0.00 0.00 2.92 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.39 1.42 7.81 694 L 7.92 3.68 0.00 1.16 1.46 0.74 0.54 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 0.00 695 L 7.64 3.86 0.00 1.82 1.63 0.44 0.84 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 0.00 696 S 7.89 4.23 0.00 3.99 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 0.00 697 E 7.92 4.01 0.00 2.01 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 2.51 0.00 698 M 7.99 4.00 0.00 1.53 2.03 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 2.62 2.47 0.00 699 Y 7.94 4.24 0.00 2.88 2.70 0.00 0.00 0.00 0.00 0.00 0.00 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 D 8.45 4.71 0.00 2.84 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 0.00 701 E 8.60 3.91 0.00 2.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.40 2.32 0.00 702 E 8.22 3.92 0.00 1.96 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 2.30 2.43 0.00 703 T 8.40 3.93 4.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.00 0.00 704 A 8.00 4.18 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 G 7.76 3.78 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 0.00 0.00 0.00 706 S 8.10 4.59 0.00 3.91 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 0.00 707 I 7.29 3.94 1.87 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.56 1.05 0.00 0.00 708 R 8.63 4.48 0.00 1.90 1.92 0.00 3.17 0.00 0.00 3.56 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 1.78 0.00 709 I 9.55 4.95 1.99 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 1.28 0.94 0.84 0.00 0.00 710 L 8.99 5.07 0.00 1.67 1.80 0.96 0.93 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 0.00 711 Y 8.87 5.13 0.00 3.20 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 0.00 712 G 6.40 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 0.00 713 G 5.38 4.37 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 0.00 714 S 9.04 4.68 0.00 3.90 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 715 I 7.76 3.90 1.90 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 1.80 0.65 0.86 0.00 0.00 716 K 8.85 4.66 0.00 1.89 1.87 0.00 1.71 0.00 0.00 1.73 0.00 0.00 3.00 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.39 1.56 7.81 717 P 0.00 4.41 0.00 2.40 2.20 0.00 3.78 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 2.01 1.97 0.00 718 D 8.19 4.55 0.00 2.83 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 0.00 719 N 8.13 4.49 0.00 3.00 3.15 0.00 0.00 5.75 8.12 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 0.00 720 F 8.24 4.14 0.00 3.35 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 0.00 721 L 7.95 3.87 0.00 1.69 1.60 0.86 1.14 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 0.00 722 G 8.04 3.74 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 723 L 6.91 4.36 0.00 1.68 1.47 0.77 0.26 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 0.00 724 I 6.66 3.55 1.56 0.00 0.00 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.65 -0.36 0.52 0.00 0.00 725 V 7.40 3.65 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.74 0.00 0.00 0.87 0.00 0.00 726 Q 7.10 4.02 0.00 2.12 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.99 0.00 0.00 0.00 0.00 0.00 2.37 2.39 0.00 727 K 8.73 4.09 0.00 1.71 2.05 0.00 1.76 0.00 0.00 1.72 0.00 0.00 3.03 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.43 1.47 7.81 728 D 7.87 4.95 0.00 2.90 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 0.00 729 I 7.69 4.77 1.92 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 1.02 0.49 0.92 0.00 0.00 730 D 9.38 4.72 0.00 2.77 2.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 731 G 6.44 4.67 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 0.00 0.00 0.00 732 G 7.88 4.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 733 L 9.05 4.96 0.00 1.65 1.51 0.96 0.75 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 0.00 734 V 9.24 3.89 2.27 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 0.95 0.00 0.00 0.93 0.00 0.00 735 G 9.11 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 736 G 9.60 3.78 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 0.00 0.00 0.00 737 A 8.15 3.58 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 0.00 738 S 8.01 4.48 0.00 3.92 4.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 739 L 8.34 3.81 0.00 1.46 1.46 0.69 0.70 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 0.00 740 K 7.65 3.97 0.00 1.71 1.66 0.00 1.53 0.00 0.00 1.58 0.00 0.00 2.77 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.38 1.31 7.81 741 E 8.46 4.37 0.00 2.05 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 2.37 2.36 0.00 742 S 8.14 4.33 0.00 4.06 4.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 743 F 7.94 4.10 0.00 3.67 3.40 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 0.00 744 I 8.39 3.82 2.01 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 1.67 1.06 0.98 0.00 0.00 745 E 7.94 4.06 0.00 2.06 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.39 2.41 0.00 746 L 7.98 3.88 0.00 1.44 1.11 0.71 0.75 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 0.00 747 A 7.56 3.98 1.29 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 0.00 0.00 748 R 8.39 4.01 0.00 2.20 1.95 0.00 3.38 0.00 0.00 3.19 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.75 0.00 749 I 7.89 3.73 2.26 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 1.70 0.73 0.96 0.00 0.00 750 M 8.12 3.91 0.00 1.20 2.11 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3.16 2.48 0.00 751 R 8.35 4.40 0.00 2.28 2.11 0.00 3.32 0.00 0.00 3.29 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 1.89 0.00 752 G 8.03 4.06 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 0.00 0.00 0.00 753 V 7.20 4.43 2.14 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 0.71 0.00 0.00 0.85 0.00 0.00 754 I 7.39 4.57 1.96 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 1.18 0.92 0.98 0.00 0.00 *755 S 8.60 4.30 0.00 3.61 3.69 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 * Residues marked with a * may have inaccurate shift predictions.