NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 542 S 4.4128 8.1933 115.3003 58.0769 64.2798 175.0506 543 H 4.4138 8.2249 115.7348 56.3390 29.0650 174.4011 544 H 4.6289 8.4865 113.5879 56.3231 30.5058 175.1413 545 V 4.0079 7.4358 120.8339 61.9339 32.3763 174.8322 546 R 5.1120 8.6187 124.8440 53.9557 33.2556 176.8710 547 V 2.3782 8.7210 120.3902 65.7249 31.4559 178.3117 548 E 3.8838 7.8057 116.4972 59.0193 29.4848 177.9376 549 H 4.4934 8.0646 117.2541 57.7947 28.8316 175.9083 550 F 4.9467 7.3571 110.4011 56.0196 38.8693 175.0786 551 M 3.9775 7.3958 119.1455 55.1399 31.7362 175.3069 552 N 4.5905 8.8822 119.8174 53.4114 39.3750 175.5322 553 H 4.5253 8.7560 122.2667 57.1601 29.9759 176.0683 554 S 4.5661 8.5082 118.5054 57.9337 61.2790 173.6161 555 I 4.5752 7.2910 113.1171 59.2094 40.3957 175.9642 556 T 4.5250 8.4445 118.6972 62.0166 69.9232 173.9391 557 T 4.5307 8.3547 117.0962 61.0327 70.5103 174.0212 558 L 4.7705 8.6471 123.0739 52.9954 44.7136 175.5587 559 A 5.4720 8.6411 125.0854 49.1396 21.6539 177.9091 560 K 3.8492 8.1725 118.6064 59.0272 32.2871 178.6398 561 D 5.0051 7.8234 115.7753 53.0668 39.8365 176.1896 562 T 3.9989 7.7856 118.2261 62.9739 69.0716 172.4598 563 P 4.6980 0.0000 0.0000 62.5701 33.2556 177.2768 564 L 3.9440 8.7545 123.5272 58.2799 42.0704 179.2342 565 E 3.9149 8.0901 118.9175 59.2096 29.5724 178.2884 566 E 3.9427 8.0534 118.9556 58.9945 29.6982 178.7061 567 V 3.4384 7.7033 118.4835 65.9069 31.6095 178.1423 568 V 3.5230 7.8276 117.9439 65.8616 31.1270 177.8521 569 K 3.9175 7.6725 117.8804 59.4007 32.4157 178.6435 570 V 3.7127 7.9120 118.5758 66.1127 31.2779 178.1797 571 V 3.8895 7.9371 118.2893 65.3547 31.4618 177.1415 572 T 4.4014 7.8311 106.6628 61.9637 69.1289 175.0062 573 S 4.7155 7.7860 114.4189 58.1477 64.0162 173.4797 574 T 4.8279 7.7816 110.0871 60.2878 71.5949 172.9396 575 D 4.8911 8.4327 118.5697 52.8528 40.3138 176.3139 576 V 3.7285 7.5710 112.3696 62.0377 32.1821 176.0596 577 T 4.2194 8.2561 116.6757 64.6734 68.3206 173.6987 578 E 5.1067 7.6643 116.5449 55.2350 32.8019 174.0728 579 Y 5.0465 9.1967 118.1188 55.4345 42.1006 173.3156 580 P 4.0523 0.0000 0.0000 62.3660 33.1165 174.5065 581 L 5.0410 8.7615 126.1836 53.8246 43.9341 175.5717 582 V 4.8009 8.5491 119.3347 59.3780 33.3801 176.2863 583 E 4.0791 9.1880 125.0819 59.1639 30.3711 177.0089 584 S 4.9273 7.7202 111.3463 56.9661 65.9895 174.8855 585 T 3.9763 8.6978 118.5452 66.8868 68.4433 176.2799 586 E 4.1222 8.2035 120.0752 59.2923 29.7648 178.2738 587 S 4.2054 8.0472 112.2612 59.3080 63.7186 174.8104 588 Q 3.5065 8.3972 117.6408 56.3902 26.8321 172.8128 589 I 4.2493 7.4091 119.7605 60.5634 37.3998 175.4565 590 L 4.3967 8.4623 128.6984 55.4638 42.1165 176.6941 591 V 4.3608 8.6982 117.8455 60.3723 33.9985 175.4101 592 G 4.0078 7.0604 105.5403 46.4829 0.0000 171.6388 593 I 5.3347 8.0750 119.5350 59.4197 41.7926 175.0954 594 V 4.7111 8.7768 125.6515 59.9135 34.2396 175.0591 595 Q 4.6290 8.6953 123.7501 55.2312 29.9508 176.7197 596 R 4.1402 9.1096 123.0931 59.7723 30.1525 178.7012 597 A 4.0936 8.0831 119.8913 55.4647 18.3282 179.5253 598 Q 3.9724 8.0231 115.9902 58.9467 28.9377 178.4278 599 L 3.9900 8.1421 121.5036 57.9242 42.0963 179.1791 600 V 3.5993 8.3635 118.6847 66.1266 31.5536 177.9359 601 Q 3.9900 8.0616 117.4749 59.0476 28.5595 178.8745 602 A 4.0135 8.0286 121.6661 55.2256 17.8903 179.7451 603 L 3.9944 8.0860 117.4559 57.8532 41.4226 179.7439 604 Q 4.0380 8.1345 117.4169 58.6477 28.6962 178.1678 605 A 4.2767 7.8533 121.0795 53.7200 19.8168 177.7037 606 E 4.5929 7.8690 116.4955 52.9645 29.6786 173.4417 607 P 4.4930 0.0000 0.0000 61.1463 32.1184 175.6041 608 P 4.3308 0.0000 0.0000 62.7517 32.2620 175.9599 *613 G 3.8810 7.9988 105.5485 45.9399 0.0000 172.2090 614 H 4.8073 8.3531 112.8256 53.9555 29.7121 173.1902 615 Q 4.2443 8.0182 120.6987 55.6473 29.6995 175.5694 616 Q 4.9646 8.6535 120.8647 54.2439 33.6202 173.5892 617 C 5.3195 9.4285 115.2310 55.6286 33.5624 174.7213 618 L 3.8623 8.6728 120.1297 58.5902 41.3492 178.5758 619 Q 3.9847 8.3140 119.3386 59.4404 28.6653 178.3672 620 D 4.3443 8.1091 119.9366 57.3978 40.8542 178.7935 621 I 3.7828 7.5606 119.8689 64.1835 37.2921 178.3474 622 L 3.9980 8.0838 119.7947 57.7204 41.2619 179.3884 623 A 4.0724 8.1724 119.9258 54.6845 18.3599 179.1155 624 R 4.0920 7.4666 116.3007 57.7082 30.3219 175.6580 625 G 3.3175 7.4004 108.7413 45.1913 0.0000 173.4808 626 C 4.1030 7.5486 122.1446 58.7142 31.7683 171.6028 627 P 4.4268 0.0000 0.0000 62.9462 31.5669 175.5206 628 T 4.8514 8.2006 111.0515 59.9969 72.2233 172.6365 629 E 4.9393 9.3919 121.8729 53.9117 32.8814 174.0475 630 P 4.8159 0.0000 0.0000 62.2916 33.0226 175.5541 631 V 4.0834 8.2299 121.1595 62.3097 32.1482 175.7566 632 T 4.5741 8.0679 115.1144 61.0143 70.2387 173.4851 633 L 4.3737 7.5681 120.7032 54.6794 44.6669 172.8732 634 T 4.6360 8.1988 113.9785 60.8792 72.1944 172.2818 635 L 4.7375 8.6057 122.2998 53.4067 44.7324 175.5764 636 F 5.1575 8.7083 117.5544 55.6510 42.8094 176.8002 637 S 4.0062 8.7847 117.5093 61.8115 62.7729 176.2609 638 E 4.4235 8.0564 115.9766 56.3515 29.9772 176.4899 639 T 4.1326 7.9212 118.1082 63.8015 69.2077 174.2039 640 T 4.6948 9.0856 116.8890 60.9786 71.2425 175.7714 641 L 4.0973 8.9436 124.2355 58.6293 42.1068 178.8425 642 H 4.1182 8.2385 119.3996 58.8548 29.7613 177.2956 643 Q 4.0636 8.3881 119.5646 58.8982 28.5191 178.6273 644 A 4.0283 8.4613 122.2384 55.2293 18.4097 179.4927 645 Q 3.6971 8.3181 118.4529 59.2671 29.0720 177.9557 646 N 4.3563 8.1441 118.0625 56.4330 38.9675 176.6441 647 L 4.0113 8.2621 121.9074 58.3092 42.2174 179.0161 648 F 4.0127 8.6540 117.8484 60.2963 38.6479 177.6129 649 K 4.2188 8.6400 119.3014 59.8525 31.9456 179.0004 650 L 4.0428 8.1164 117.9182 57.4036 41.6451 178.1364 651 L 4.3118 7.9825 115.7052 53.7260 42.3321 175.6833 652 N 4.2249 7.5304 116.5916 54.5071 37.5547 173.4654 653 L 4.4658 7.9757 116.9701 53.8927 43.6421 177.1737 654 Q 4.7088 7.9974 118.7814 57.4208 30.5240 175.6974 655 S 4.9524 7.2134 108.2690 57.9524 65.3991 174.8701 656 L 4.5424 8.4392 119.5897 53.4211 46.4406 175.6611 657 F 4.8669 8.5859 119.8388 57.1819 41.0148 174.4616 658 V 4.8305 8.9767 120.8956 61.3432 34.2390 174.5514 659 T 5.1553 8.2889 116.7643 60.0366 72.6084 173.0016 660 S 4.5742 8.6583 117.0071 57.2302 65.7530 174.1104 661 R 3.9703 9.9464 126.9501 57.3163 27.6696 177.6718 662 G 4.0288 8.4221 106.1192 45.5146 0.0000 174.2699 663 R 5.2261 7.9778 118.6500 54.2392 31.1518 175.6509 664 A 4.4834 8.3936 125.1768 52.2866 18.6058 177.6616 665 V 4.3366 8.3393 115.6609 60.5976 34.0076 175.7184 666 G 3.9643 7.3763 106.4144 45.9607 0.0000 171.2784 667 C 5.1438 7.8537 112.4715 56.9374 33.6355 173.2672 668 V 4.7672 8.8089 119.8575 61.2796 34.7323 174.4717 669 S 5.2964 8.9063 120.8068 54.4816 66.6381 174.8362 670 W 4.1456 8.9028 118.3148 59.2547 28.4096 178.9043 671 V 3.6472 7.7090 118.6646 66.1705 31.0270 177.9196 672 E 4.0266 8.1123 117.8454 59.3816 29.3886 178.7630 673 M 3.4828 7.9212 118.2527 58.6111 32.3116 178.4812 674 K 3.9959 8.4728 118.9052 59.2699 32.1710 179.3324 675 K 3.9217 7.8501 119.9597 59.3084 31.9103 178.8276 676 A 3.8524 7.5105 120.0675 55.1396 18.6072 179.3818 677 I 3.6906 7.6480 118.3881 64.4608 37.0603 178.6328 678 S 4.0894 8.1345 114.0149 61.4430 62.0402 175.8948 679 N 4.5287 8.0384 117.7016 55.6592 38.2303 176.9429 680 L 4.1432 7.5297 120.2798 57.2743 41.7695 177.9181 681 T 4.4337 7.8165 106.4232 61.9670 70.7282 174.2973 682 N 4.9915 8.0729 118.7566 50.0462 38.7458 171.6749 683 P 4.2956 0.0000 0.0000 61.8545 32.2582 175.7834 684 P 4.3532 0.0000 0.0000 62.1749 31.9513 176.0152 685 A 4.1974 8.2401 122.7292 51.0819 19.0131 175.8806 686 P 4.3825 0.0000 0.0000 62.5190 31.8610 176.7762 687 K 4.0751 8.4691 120.2969 56.6129 32.6504 176.1891 688 E 4.8201 8.2905 120.7256 54.6442 32.2046 175.4648 689 F 4.8788 8.6690 119.1172 55.6607 41.7876 175.1311 690 L 4.8979 8.3865 122.2811 53.0127 44.5009 175.8762 691 E 4.6192 8.3842 119.3018 55.0384 32.3429 175.4656 692 V 3.9435 8.0487 119.9654 61.4910 30.4478 175.8754 693 L 4.1852 8.2436 125.4507 54.8294 41.4492 177.4164 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 542 S 8.19 4.41 0.00 3.86 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 0.00 543 H 8.22 4.41 0.00 3.32 3.34 0.00 5.74 0.00 0.00 0.00 0.00 6.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 544 H 8.49 4.63 0.00 3.31 3.44 0.00 5.52 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 545 V 7.44 4.01 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 1.12 0.00 0.00 0.69 0.00 0.00 546 R 8.62 5.11 0.00 1.75 1.90 0.00 3.20 0.00 0.00 3.29 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.63 0.00 547 V 8.72 2.38 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 0.60 0.00 0.00 0.88 0.00 0.00 548 E 7.81 3.88 0.00 2.05 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 2.29 2.07 0.00 549 H 8.06 4.49 0.00 3.48 3.47 0.00 5.59 0.00 0.00 0.00 0.00 6.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 550 F 7.36 4.95 0.00 3.03 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 0.00 551 M 7.40 3.98 0.00 1.90 1.90 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 2.20 0.00 552 N 8.88 4.59 0.00 2.95 2.85 0.00 0.00 7.46 7.43 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 0.00 553 H 8.76 4.53 0.00 3.19 3.34 0.00 5.75 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 554 S 8.51 4.57 0.00 4.00 3.87 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 0.00 555 I 7.29 4.58 2.01 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 1.46 0.70 1.03 0.00 0.00 556 T 8.44 4.53 4.46 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 1.24 0.00 0.00 557 T 8.35 4.53 4.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 558 L 8.65 4.77 0.00 1.52 1.47 0.43 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 559 A 8.64 5.47 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 560 K 8.17 3.85 0.00 2.03 1.86 0.00 1.80 0.00 0.00 1.79 0.00 0.00 2.94 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.44 1.36 7.81 561 D 7.82 5.01 0.00 2.75 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 0.00 562 T 7.79 4.00 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 1.16 0.00 0.00 563 P 0.00 4.70 0.00 2.13 1.95 0.00 3.58 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.12 0.00 564 L 8.75 3.94 0.00 1.90 1.65 0.89 1.07 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 0.00 565 E 8.09 3.91 0.00 2.10 1.91 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 2.37 2.41 0.00 566 E 8.05 3.94 0.00 2.09 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.38 0.00 567 V 7.70 3.44 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.90 0.00 0.00 0.91 0.00 0.00 568 V 7.83 3.52 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 0.93 0.00 0.00 0.98 0.00 0.00 569 K 7.67 3.92 0.00 1.82 1.97 0.00 1.86 0.00 0.00 1.77 0.00 0.00 2.98 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.45 1.45 7.81 570 V 7.91 3.71 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.78 0.00 0.00 0.94 0.00 0.00 571 V 7.94 3.89 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 0.86 0.00 0.00 572 T 7.83 4.40 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 1.28 0.00 0.00 573 S 7.79 4.72 0.00 4.00 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 0.00 574 T 7.78 4.83 4.35 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 1.36 0.00 0.00 575 D 8.43 4.89 0.00 2.75 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 0.00 576 V 7.57 3.73 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 0.32 0.00 0.00 577 T 8.26 4.22 4.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 578 E 7.66 5.11 0.00 2.13 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.47 0.00 579 Y 9.20 5.05 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 0.00 580 P 0.00 4.05 0.00 1.62 0.54 0.00 3.94 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 1.64 0.00 581 L 8.76 5.04 0.00 1.72 1.57 0.91 0.80 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 0.00 582 V 8.55 4.80 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 0.71 0.00 0.00 0.94 0.00 0.00 583 E 9.19 4.08 0.00 2.03 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.30 0.00 584 S 7.72 4.93 0.00 3.97 3.87 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 0.00 585 T 8.70 3.98 4.22 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 1.20 0.00 0.00 586 E 8.20 4.12 0.00 1.95 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 2.30 2.28 0.00 587 S 8.05 4.21 0.00 3.99 3.97 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 0.00 0.00 0.00 588 Q 8.40 3.51 0.00 2.25 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.11 7.04 0.00 0.00 0.00 0.00 0.00 2.39 2.44 0.00 589 I 7.41 4.25 1.85 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.84 0.90 0.00 0.00 590 L 8.46 4.40 0.00 1.49 1.52 0.77 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 591 V 8.70 4.36 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.83 0.00 0.00 0.97 0.00 0.00 592 G 7.06 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 0.00 0.00 0.00 593 I 8.08 5.33 1.93 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.93 1.17 0.00 0.00 594 V 8.78 4.71 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 1.06 0.00 0.00 0.99 0.00 0.00 595 Q 8.70 4.63 0.00 2.18 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.88 6.91 0.00 0.00 0.00 0.00 0.00 2.47 2.38 0.00 596 R 9.11 4.14 0.00 1.95 1.96 0.00 3.27 0.00 0.00 3.30 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.89 0.00 597 A 8.08 4.09 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 0.00 598 Q 8.02 3.97 0.00 2.25 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.86 0.00 0.00 0.00 0.00 0.00 2.47 2.38 0.00 599 L 8.14 3.99 0.00 1.82 1.88 0.89 0.51 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 0.00 600 V 8.36 3.60 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 1.00 0.00 0.00 1.03 0.00 0.00 601 Q 8.06 3.99 0.00 2.34 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.58 0.00 0.00 0.00 0.00 0.00 2.39 2.68 0.00 602 A 8.03 4.01 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 0.00 603 L 8.09 3.99 0.00 1.87 1.72 0.93 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 604 Q 8.13 4.04 0.00 2.19 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.97 0.00 0.00 0.00 0.00 0.00 2.64 2.52 0.00 605 A 7.85 4.28 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 0.00 606 E 7.87 4.59 0.00 1.92 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 0.00 2.22 2.34 0.00 607 P 0.00 4.49 0.00 2.17 2.06 0.00 3.44 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.93 0.00 608 P 0.00 4.33 0.00 2.19 2.10 0.00 3.79 0.00 0.00 3.65 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 *613 G 8.00 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 614 H 8.35 4.81 0.00 3.01 3.19 0.00 5.93 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 0.00 615 Q 8.02 4.24 0.00 1.94 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.51 6.58 0.00 0.00 0.00 0.00 0.00 2.35 2.32 0.00 616 Q 8.65 4.96 0.00 1.90 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.69 0.00 0.00 0.00 0.00 0.00 2.49 2.26 0.00 617 C 9.43 5.32 0.00 2.98 2.97 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 0.00 0.00 0.00 618 L 8.67 3.86 0.00 1.73 1.95 0.87 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 619 Q 8.31 3.98 0.00 2.28 2.08 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 2.35 2.45 0.00 620 D 8.11 4.34 0.00 2.89 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 0.00 621 I 7.56 3.78 2.01 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.99 0.90 0.00 0.00 622 L 8.08 4.00 0.00 1.82 1.70 0.91 0.79 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 0.00 623 A 8.17 4.07 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 0.00 624 R 7.47 4.09 0.00 1.99 2.11 0.00 3.26 0.00 0.00 3.23 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.64 0.00 625 G 7.40 3.32 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 0.00 0.00 0.00 0.00 626 C 7.55 4.10 0.00 2.95 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 0.00 627 P 0.00 4.43 0.00 2.09 1.98 0.00 3.68 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 2.18 2.08 0.00 628 T 8.20 4.85 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 1.26 0.00 0.00 629 E 9.39 4.94 0.00 1.86 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.36 2.38 0.00 630 P 0.00 4.82 0.00 2.08 2.05 0.00 3.76 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.96 0.00 631 V 8.23 4.08 2.08 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 0.85 0.00 0.00 0.92 0.00 0.00 632 T 8.07 4.57 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 633 L 7.57 4.37 0.00 1.54 1.48 0.96 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 634 T 8.20 4.64 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 1.16 0.00 0.00 635 L 8.61 4.74 0.00 1.53 1.60 0.92 1.51 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 0.00 636 F 8.71 5.16 0.00 3.02 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 0.00 637 S 8.78 4.01 0.00 3.93 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 0.00 638 E 8.06 4.42 0.00 1.97 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 2.26 2.33 0.00 639 T 7.92 4.13 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 1.36 0.00 0.00 640 T 9.09 4.69 4.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 641 L 8.94 4.10 0.00 1.82 1.91 0.43 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 642 H 8.24 4.12 0.00 3.24 3.25 0.00 5.69 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 0.00 643 Q 8.39 4.06 0.00 2.37 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.58 0.00 0.00 0.00 0.00 0.00 2.47 2.48 0.00 644 A 8.46 4.03 1.34 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 0.00 0.00 645 Q 8.32 3.70 0.00 2.11 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.75 0.00 0.00 0.00 0.00 0.00 2.53 2.58 0.00 646 N 8.14 4.36 0.00 3.00 2.95 0.00 0.00 6.87 6.63 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 0.00 647 L 8.26 4.01 0.00 2.02 2.03 0.97 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 648 F 8.65 4.01 0.00 2.86 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 0.00 649 K 8.64 4.22 0.00 2.18 2.02 0.00 1.71 0.00 0.00 1.72 0.00 0.00 2.97 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.52 1.57 7.81 650 L 8.12 4.04 0.00 1.80 1.76 1.02 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 651 L 7.98 4.31 0.00 1.72 1.66 0.91 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 652 N 7.53 4.22 0.00 2.77 2.83 0.00 0.00 7.08 8.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 653 L 7.98 4.47 0.00 0.66 0.90 0.44 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 0.00 0.00 0.00 0.00 654 Q 8.00 4.71 0.00 2.04 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.79 0.00 0.00 0.00 0.00 0.00 2.40 2.29 0.00 655 S 7.21 4.95 0.00 3.77 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 656 L 8.44 4.54 0.00 1.67 1.50 0.88 1.08 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 0.00 657 F 8.59 4.87 0.00 3.03 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 0.00 658 V 8.98 4.83 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 0.96 0.00 0.00 0.85 0.00 0.00 659 T 8.29 5.16 4.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.00 0.00 660 S 8.66 4.57 0.00 3.88 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 0.00 661 R 9.95 3.97 0.00 2.00 2.00 0.00 3.31 0.00 0.00 3.24 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.63 0.00 662 G 8.42 4.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 663 R 7.98 5.23 0.00 2.01 1.83 0.00 3.13 0.00 0.00 3.27 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.52 0.00 664 A 8.39 4.48 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 665 V 8.34 4.34 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 0.78 0.00 0.00 0.94 0.00 0.00 666 G 7.38 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 0.00 667 C 7.85 5.14 0.00 2.84 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 0.00 668 V 8.81 4.77 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 0.68 0.00 0.00 0.72 0.00 0.00 669 S 8.91 5.30 0.00 4.03 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 0.00 670 W 8.90 4.15 0.00 3.49 3.31 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 0.00 671 V 7.71 3.65 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 1.06 0.00 0.00 0.99 0.00 0.00 672 E 8.11 4.03 0.00 2.29 2.33 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 2.43 2.48 0.00 673 M 7.92 3.48 0.00 1.95 1.52 0.00 0.00 0.00 0.00 0.00 0.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 2.00 0.00 674 K 8.47 4.00 0.00 1.93 1.88 0.00 1.78 0.00 0.00 1.59 0.00 0.00 2.78 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.57 1.90 7.81 675 K 7.85 3.92 0.00 1.92 1.93 0.00 1.65 0.00 0.00 1.67 0.00 0.00 2.97 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.43 1.45 7.81 676 A 7.51 3.85 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 677 I 7.65 3.69 1.82 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 1.30 1.03 0.88 0.00 0.00 678 S 8.13 4.09 0.00 3.95 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 0.00 679 N 8.04 4.53 0.00 2.86 2.85 0.00 0.00 7.09 7.13 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 0.00 680 L 7.53 4.14 0.00 1.81 1.73 0.89 0.60 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 0.00 681 T 7.82 4.43 4.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 682 N 8.07 4.99 0.00 2.77 2.75 0.00 0.00 7.01 8.86 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 0.00 683 P 0.00 4.30 0.00 2.17 2.07 0.00 3.85 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.96 0.00 684 P 0.00 4.35 0.00 2.19 2.09 0.00 3.77 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 1.99 1.96 0.00 685 A 8.24 4.20 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 686 P 0.00 4.38 0.00 2.22 2.10 0.00 3.78 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 2.00 2.01 0.00 687 K 8.47 4.08 0.00 1.50 1.60 0.00 1.60 0.00 0.00 1.73 0.00 0.00 3.09 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.37 1.48 7.81 688 E 8.29 4.82 0.00 1.89 1.85 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 2.23 2.28 0.00 689 F 8.67 4.88 0.00 2.95 2.97 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 0.00 0.00 0.00 690 L 8.39 4.90 0.00 1.61 1.56 0.93 0.86 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 0.00 691 E 8.38 4.62 0.00 2.04 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 2.22 2.31 0.00 692 V 8.05 3.94 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 0.83 0.00 0.00 0.94 0.00 0.00 693 L 8.24 4.19 0.00 1.68 1.57 0.93 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.