NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 525 D 4.6265 8.3644 120.5287 54.4372 42.1171 173.5163 526 M 4.4921 8.3506 119.2327 52.9651 35.4116 174.2352 527 S 4.7464 8.1753 120.4947 56.5345 66.8103 174.7834 528 S 4.2025 8.5089 115.1179 61.8191 62.7152 176.5187 529 T 3.8769 7.8440 113.1122 64.3448 68.7689 176.2462 530 A 3.4317 7.8931 123.1142 54.8563 18.2131 178.9608 531 Q 3.7873 7.6083 117.8066 58.9082 29.1449 178.0455 532 R 4.1094 7.9916 118.5280 59.5803 30.3897 178.7212 533 L 3.9357 8.6383 119.3882 58.0514 41.7084 179.4692 534 K 3.7884 8.0128 119.0574 59.8200 31.9030 178.6691 535 F 4.4183 7.8061 117.3602 60.5768 38.7010 177.6379 536 L 3.9484 8.0262 118.7881 57.8010 41.1235 179.0448 537 D 4.3242 8.2018 118.0940 57.0597 41.0589 178.2836 538 E 4.1030 8.2913 119.4899 59.2802 29.3464 179.0205 539 G 3.8581 8.5409 104.9059 48.1539 0.0000 175.0119 540 V 3.7486 8.0103 121.3540 66.0477 31.4964 177.9000 541 E 3.9964 7.9683 117.6163 59.4578 29.1924 179.0653 542 E 3.9615 8.3557 119.4016 59.2890 29.6649 178.8192 543 I 3.6866 7.8194 119.6467 64.1411 37.0460 177.9646 544 D 4.4154 7.9580 120.0981 57.1311 40.6765 178.7339 545 I 3.7894 7.5250 119.9588 64.2034 37.2230 178.1201 546 E 3.8971 8.4439 119.8224 59.4444 29.0763 179.4573 547 L 3.9153 7.7735 117.7387 57.5732 42.0407 178.7340 548 A 4.0909 7.9153 121.1757 55.3378 18.0003 179.3259 549 R 4.0734 7.9634 110.5650 55.9836 29.5500 176.4505 550 L 2.8728 7.0917 116.2235 56.5677 39.7874 176.6105 551 R 4.2339 7.6163 120.2515 54.8422 27.9057 176.4259 552 F 4.3018 7.6931 121.7739 60.0884 39.2954 176.4160 553 E 4.7139 8.1594 119.8988 58.9823 29.6243 178.4575 554 S 4.0360 8.1263 112.3985 61.5458 62.4016 175.3011 555 A 3.9335 8.1016 123.1649 55.5741 18.0070 179.6462 556 V 3.5402 8.0775 115.4543 66.1293 31.7369 177.9758 557 E 3.9487 8.4063 118.5210 59.9178 29.3154 179.6990 558 T 3.8119 8.3771 115.6393 66.5902 68.6796 176.1827 559 L 3.9295 7.9285 122.2297 58.6746 41.9108 179.2401 560 L 4.2348 8.1917 118.4955 57.4200 41.3971 179.1051 561 D 4.3028 7.8426 117.8023 57.5714 41.3000 178.3275 562 I 3.7122 8.1476 120.6044 64.2905 36.7782 178.0452 563 E 4.1426 7.7776 118.0391 58.7824 29.5420 178.4894 564 S 4.2406 8.7796 114.0034 60.9850 62.4856 175.9916 565 Q 3.9580 8.4261 122.8939 59.1455 28.7051 178.0121 566 L 4.0545 7.6848 119.5008 57.6398 41.7666 178.1024 567 E 4.1314 7.8005 119.2269 59.1494 29.3815 178.2225 568 D 4.3781 7.7626 117.7013 57.3410 41.0850 177.8663 569 L 4.1156 7.9340 116.7232 56.1046 41.8870 176.7530 570 S 4.5360 7.4232 113.8595 56.4271 64.2561 173.7062 *578 L 4.3100 8.3962 126.7891 55.1576 43.8883 178.0036 579 M 3.9720 8.1524 117.8555 58.6721 31.7520 178.2015 580 L 3.9215 7.8814 119.3282 58.4601 42.2695 178.0831 581 L 3.9146 7.9207 119.5430 58.4165 42.0690 178.2203 582 N 4.3217 8.8137 116.5433 56.5237 38.5425 177.2884 583 L 3.9649 7.8691 121.5523 58.2471 42.2264 179.1349 584 I 3.8905 7.9591 120.0020 64.1361 37.0135 178.1327 585 S 4.1129 8.7112 114.4677 61.6134 62.2722 176.4079 586 L 4.0709 7.9162 121.2496 57.6158 41.2965 179.6251 587 K 4.0731 7.6966 117.2382 59.2207 31.4881 179.5438 588 I 3.7182 7.8372 120.3087 64.3577 37.0479 178.1194 589 E 4.1002 7.9660 119.0627 59.6743 29.2506 178.7225 590 Q 3.9416 7.9275 118.7204 59.8598 28.9251 179.0412 591 R 3.9089 8.3452 118.5049 59.0485 29.9688 178.8705 592 R 3.8772 8.8850 118.3394 59.6276 30.2964 177.5553 593 E 4.0154 8.7816 118.7487 59.4806 29.7292 178.3251 594 A 4.0048 8.1836 120.5567 55.6362 18.2896 179.6658 595 I 3.7538 8.1197 118.1173 64.5865 37.1736 178.6906 596 S 4.0686 8.0495 115.9059 61.7032 62.6771 176.3540 597 S 4.0724 8.1761 115.1564 61.7496 61.7148 176.1452 598 K 3.9374 7.9545 120.2506 59.5153 31.6871 178.9339 599 L 3.7530 8.0005 119.0554 58.0984 41.6120 179.8495 600 S 4.4558 8.5456 114.8021 61.8185 62.6089 176.7274 601 Q 3.9643 7.9452 119.3485 59.2688 28.7319 178.6358 602 S 4.0852 8.9486 114.9256 61.3926 62.3346 175.8237 603 I 3.6399 8.6649 123.1531 64.8411 36.8925 178.2503 604 L 4.1317 8.0816 118.5964 56.9060 41.5071 178.1721 605 S 4.7296 7.8013 112.1448 57.5386 63.7673 174.2683 606 S 4.2534 8.0127 115.4010 59.1037 62.8587 173.0578 607 N 4.6117 8.1410 120.3005 55.2619 39.5682 175.8665 608 E 4.2871 7.7088 116.2722 55.7368 32.1916 177.3398 609 I 3.6355 8.2716 120.4028 64.5112 37.9426 177.9779 610 V 3.5999 7.9386 118.4079 66.8410 31.0903 177.3704 611 H 4.1839 8.0942 115.0237 58.6206 28.7427 176.9719 612 L 3.9609 7.8059 122.0532 59.0402 41.9168 178.3671 613 K 3.7440 10.0462 118.4715 60.2154 31.7931 178.5307 614 S 4.3393 7.8360 114.5520 60.9816 63.1600 176.5295 615 G 3.8229 7.8911 110.1313 47.8224 0.0000 175.4477 616 T 3.8293 7.8999 118.2599 66.1804 68.2224 176.5158 617 E 3.6527 7.8242 120.1733 59.6002 29.5615 179.1313 618 N 4.2722 8.8687 117.1636 56.6451 38.4225 177.1830 619 M 4.0432 8.2844 119.8119 58.3683 32.0014 178.4547 620 I 3.6412 7.4897 120.1631 64.2490 37.1978 177.9243 621 K 3.7842 8.5155 120.2793 59.9449 31.9309 178.3059 622 L 4.1492 7.6752 118.1608 55.8737 41.6750 177.6574 623 G 3.9936 10.3863 106.5171 45.9605 0.0000 173.7510 624 L 4.8713 7.6819 114.3644 51.8523 42.6367 176.2270 625 P 4.3326 0.0000 0.0000 66.0373 31.7444 178.4982 626 E 3.9867 8.1407 117.9713 59.2481 29.4793 178.9433 627 Q 3.6301 8.1585 118.8380 58.9429 29.0508 178.1083 628 A 4.0224 8.2500 122.0063 54.9377 18.4404 179.2934 629 L 3.8701 8.6310 119.3030 58.3410 41.7989 178.2514 630 D 4.3429 8.8613 119.0674 57.6261 41.0793 178.5570 631 L 3.9746 8.1895 119.1745 57.8602 41.5713 179.1110 632 F 4.0789 8.6614 120.9644 61.5838 39.2210 177.2135 633 L 3.1059 8.0999 118.5001 57.1293 41.2722 179.1089 634 Q 3.8954 7.4343 119.2439 58.9446 28.9276 177.7361 635 N 4.1621 7.8495 118.0183 56.8905 38.7538 176.9990 636 R 3.8107 6.9259 117.5944 59.3194 30.2685 178.7989 637 S 4.5125 8.3719 115.2538 61.9162 62.8290 176.2737 638 N 4.2588 8.8206 119.0141 56.6700 38.4731 176.9212 639 F 4.0334 8.6399 122.0937 61.7042 39.2630 177.4684 640 I 3.6165 8.1254 119.2050 64.5017 36.9643 178.0304 641 Q 3.8840 7.9756 118.3038 59.0679 28.7103 178.2433 642 D 4.3348 8.3048 119.6519 57.7495 40.7928 179.3998 643 L 3.7852 7.1794 117.3914 57.9008 41.6368 179.4579 644 I 3.7365 7.3763 118.5044 64.1481 37.0017 178.2261 645 L 4.1802 7.6621 119.3328 57.4886 41.7941 180.7009 646 Q 4.3914 7.7702 118.6105 53.8919 28.6245 177.2902 647 I 4.3712 7.9287 123.3880 61.6743 37.2695 179.3983 *650 V 3.5087 8.6776 129.1002 63.6023 30.8548 173.9227 651 D 4.5236 8.4210 124.2942 56.1120 41.7114 176.4425 652 N 5.0787 7.7114 115.0658 50.7845 42.9986 173.5890 653 P 4.2936 0.0000 0.0000 66.1581 31.7789 178.5448 654 T 4.2157 7.8819 113.2790 65.6137 69.2493 176.5577 655 N 4.5387 8.1455 118.0780 55.3135 38.5148 176.2851 656 Y 4.0319 7.8992 121.3573 60.0138 39.2001 176.6937 657 L 3.9479 7.7961 121.2689 58.6673 42.1777 179.3194 658 T 3.8347 7.9097 115.2575 66.7317 68.5994 176.3981 659 Q 3.8930 7.4822 120.8360 59.0398 28.9678 178.0987 660 L 3.6338 7.9981 121.3508 58.0672 42.1843 178.6261 661 A 3.7382 7.9516 120.3975 56.0500 18.3572 178.9438 662 V 3.3200 8.3083 113.8777 67.2141 31.1478 178.8218 663 I 3.2751 7.7527 118.9316 64.0024 37.7211 177.7329 664 R 3.3061 8.5323 117.3976 60.2079 29.7522 178.1378 665 F 4.3159 6.7147 118.9975 60.9758 39.4694 177.6210 666 Q 4.1075 8.6706 118.0332 58.7842 28.5074 178.1792 667 T 4.2031 8.3476 116.7837 65.5497 68.4637 177.3506 668 I 3.8667 7.5609 121.7292 64.0771 37.2402 178.0950 669 K 4.0400 8.2723 120.4833 59.4649 32.0625 178.6892 670 K 4.3334 7.7622 121.2527 59.4936 32.2547 178.8862 671 T 4.0288 8.2705 115.7183 66.2998 68.3369 176.7862 672 V 3.8997 7.6543 120.1825 65.8208 31.2465 177.9546 673 E 4.1496 8.4270 118.3438 59.2595 28.7335 178.8116 674 D 4.5291 8.6192 119.1451 56.7533 41.1217 178.4805 675 F 4.2950 8.3291 120.6927 60.7691 39.0755 177.4392 676 Q 3.9705 7.8923 117.2948 58.9474 28.8603 177.3530 677 D 4.5269 7.6161 114.7601 55.4188 41.2589 175.9557 678 I 4.1480 7.0078 115.1790 63.3663 39.4159 177.2864 679 F 4.2231 7.5239 116.9499 57.2900 38.8710 176.4698 680 K 3.9568 7.7044 119.8629 58.0299 33.0453 176.6004 681 E 3.9402 8.7479 119.4264 57.5510 26.8748 175.5803 682 L 4.0915 7.4548 121.2048 55.8156 42.0135 176.1855 683 G 4.0378 8.0231 102.4717 43.3708 0.0000 174.2390 684 A 4.2090 8.6606 120.8287 54.8645 18.5411 179.4619 685 K 3.9507 8.0279 117.6683 59.7716 32.2772 178.5758 686 I 3.8321 7.9336 119.4658 64.8932 36.8931 178.0009 687 S 4.3324 7.9263 112.1965 60.7267 62.2115 176.2837 688 S 4.2672 8.5348 117.8760 61.2332 62.9731 176.3547 689 I 3.8334 7.7537 122.9752 64.1529 36.8917 177.3843 690 L 3.7189 7.4489 120.9262 58.6001 41.6484 179.1498 691 V 3.7075 7.4238 116.2503 66.2036 31.2672 177.9300 692 D 4.3833 8.0865 118.5629 57.0644 40.7242 178.3131 693 W 4.0886 8.1397 128.7122 60.8078 30.8223 177.4687 694 C 3.4556 8.2223 116.4871 62.7646 27.4674 176.2166 695 S 3.4704 8.0907 114.4226 61.4211 61.9950 175.9622 696 D 4.3330 8.0162 121.6101 57.2616 40.4961 178.5447 697 E 3.4825 7.7668 119.4073 59.1776 29.1914 179.5091 698 V 3.1066 6.8589 117.4522 65.9421 31.4882 177.4379 699 D 4.4837 7.8567 118.6272 57.7138 40.6815 178.3496 700 N 4.0572 8.5220 117.1330 56.8763 38.4557 176.4160 701 H 3.7639 7.6493 118.9946 59.7009 29.6941 177.1296 702 F 3.6290 7.0930 118.8990 60.1209 38.4479 177.8653 703 K 4.2739 7.8207 119.5571 58.6126 31.5016 179.2177 704 L 4.0599 7.9225 119.3131 57.1115 41.4359 179.2028 705 I 4.0096 7.2179 120.0899 63.8998 37.0996 177.5713 706 D 4.5754 8.4441 120.1219 57.5493 40.6544 179.3264 707 K 4.0496 7.8608 118.6769 59.7866 32.3246 179.3877 708 Q 4.0755 7.6941 116.7500 58.8256 28.2886 178.2463 709 L 4.4208 7.9301 118.0066 55.0365 41.6317 177.6377 710 L 4.6233 7.5087 118.1281 53.6714 41.7793 175.7604 711 N 4.5299 7.2425 117.5104 52.9188 39.5658 173.9161 *715 L 4.2125 7.8726 119.8707 55.9543 43.3016 175.4970 716 S 4.8674 7.9151 114.7073 56.1501 66.7431 173.7003 717 P 4.4779 0.0000 0.0000 64.2601 31.0953 176.9892 718 G 3.9852 7.9248 106.9619 46.0966 0.0000 175.0003 719 S 4.5642 7.9857 116.4602 60.0971 63.5458 176.4154 720 I 3.7623 7.6582 122.1407 64.5124 37.0386 178.2812 721 K 3.8834 8.0994 118.6859 59.6833 31.7772 178.8942 722 S 4.0606 8.0498 112.8247 61.4260 62.3401 176.0100 723 S 4.0156 8.4300 117.6699 61.7894 62.7711 176.3679 724 R 3.8106 8.5586 121.4109 59.6452 29.6079 177.8062 725 K 3.7137 8.0587 118.7733 59.9511 31.9844 178.3375 726 Q 3.7759 7.8919 117.9411 59.0463 29.1191 177.9682 727 I 3.7002 7.4574 120.3527 63.2909 37.4198 177.8644 728 D 4.4667 8.5252 120.4808 57.1947 40.8347 178.7836 729 G 3.7270 8.3191 105.8683 47.0779 0.0000 175.3864 730 L 4.2023 7.7256 120.7119 57.3066 41.6349 179.1613 731 K 4.4490 8.6539 120.0033 58.3444 31.6617 178.8092 732 A 4.2098 7.7691 120.1061 53.8092 18.3131 178.1350 733 V 4.3589 7.6995 110.9041 61.1924 32.3373 175.7984 734 G 3.9136 8.1185 105.3996 46.8119 0.0000 174.3208 735 L 4.5606 7.9119 118.6939 52.4044 44.3909 175.2893 736 D 5.0118 8.4021 123.2420 52.8702 41.3307 174.8103 737 F 5.0563 8.4099 124.4814 56.6823 40.6676 177.6999 738 V 3.7004 7.6788 124.1804 66.1614 31.0581 177.4129 739 Y 4.2447 8.3752 117.2235 60.2988 37.7756 178.6482 740 K 3.8010 7.1349 120.2598 58.6263 32.1497 179.1896 741 L 3.6303 7.7328 120.2186 58.2725 42.2389 178.5744 742 D 4.3920 8.1009 118.8093 57.3250 40.5784 178.7516 743 E 3.9207 8.3445 119.1739 59.4856 29.3193 179.1301 744 F 3.9783 7.5770 118.9529 61.3041 39.4555 176.8992 745 I 3.7130 7.5347 119.1405 63.8057 36.6944 178.1168 746 K 3.8442 7.7693 120.4848 59.0687 32.0526 177.6017 747 K 4.2381 7.4973 115.1343 57.6375 33.0797 176.6072 748 N 4.9020 7.3861 117.8319 52.9757 39.8959 176.9898 749 S 4.0459 8.2630 115.4272 62.0081 63.0518 176.7364 750 D 4.4491 8.1055 117.8566 56.6785 40.6130 177.3983 751 K 4.6737 7.4310 117.9201 56.4143 32.6896 177.1526 752 I 4.3443 7.4334 120.2576 62.0328 39.7030 176.1279 753 R 4.0550 8.1672 123.6766 56.7872 29.7363 175.7141 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 525 D 8.36 4.63 0.00 2.68 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 0.00 526 M 8.35 4.49 0.00 1.95 1.84 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 2.44 2.61 0.00 527 S 8.18 4.75 0.00 4.02 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 0.00 528 S 8.51 4.20 0.00 4.08 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 0.00 529 T 7.84 3.88 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 0.00 530 A 7.89 3.43 1.32 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 0.00 531 Q 7.61 3.79 0.00 2.40 2.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.66 0.00 0.00 0.00 0.00 0.00 2.44 2.53 0.00 532 R 7.99 4.11 0.00 1.95 2.04 0.00 3.42 0.00 0.00 3.29 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.89 0.00 533 L 8.64 3.94 0.00 1.81 1.72 0.92 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 534 K 8.01 3.79 0.00 1.84 1.47 0.00 1.53 0.00 0.00 1.49 0.00 0.00 2.89 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.29 1.41 7.81 535 F 7.81 4.42 0.00 3.32 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 0.00 536 L 8.03 3.95 0.00 1.88 1.75 0.95 1.02 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 0.00 537 D 8.20 4.32 0.00 2.80 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 0.00 538 E 8.29 4.10 0.00 2.35 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 2.47 2.51 0.00 539 G 8.54 3.86 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 0.00 0.00 0.00 0.00 0.00 0.00 540 V 8.01 3.75 2.31 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 1.03 0.00 0.00 0.94 0.00 0.00 541 E 7.97 4.00 0.00 2.22 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 2.34 2.38 0.00 542 E 8.36 3.96 0.00 2.04 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 0.00 2.30 2.35 0.00 543 I 7.82 3.69 2.10 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 1.53 0.60 0.92 0.00 0.00 544 D 7.96 4.42 0.00 2.92 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 0.00 545 I 7.53 3.79 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 1.73 0.84 0.89 0.00 0.00 546 E 8.44 3.90 0.00 1.93 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 2.30 2.47 0.00 547 L 7.77 3.92 0.00 1.74 1.72 1.00 0.97 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 0.00 548 A 7.92 4.09 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 0.00 549 R 7.96 4.07 0.00 1.91 1.98 0.00 3.15 0.00 0.00 3.18 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.78 0.00 550 L 7.09 2.87 0.00 1.71 1.56 0.93 0.62 0.00 0.00 0.00 0.00 0.00 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0.00 7.38 6.80 0.00 0.00 0.00 0.00 0.00 2.37 2.48 0.00 591 R 8.35 3.91 0.00 1.95 1.98 0.00 3.26 0.00 0.00 3.25 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.80 0.00 592 R 8.89 3.88 0.00 1.87 2.19 0.00 3.29 0.00 0.00 3.28 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.67 0.00 593 E 8.78 4.02 0.00 2.15 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 2.50 0.00 594 A 8.18 4.00 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 0.00 595 I 8.12 3.75 2.07 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 1.60 0.86 0.98 0.00 0.00 596 S 8.05 4.07 0.00 4.08 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 0.00 597 S 8.18 4.07 0.00 3.89 4.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 598 K 7.95 3.94 0.00 2.17 2.04 0.00 1.99 0.00 0.00 1.74 0.00 0.00 3.09 0.00 0.00 3.06 0.00 0.00 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0.00 0.00 2.43 2.58 0.00 667 T 8.35 4.20 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 1.21 0.00 0.00 668 I 7.56 3.87 2.01 0.00 0.00 0.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.80 0.79 0.00 0.00 669 K 8.27 4.04 0.00 2.00 1.87 0.00 1.69 0.00 0.00 1.62 0.00 0.00 3.19 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.50 1.52 7.81 670 K 7.76 4.33 0.00 1.92 1.86 0.00 1.61 0.00 0.00 1.65 0.00 0.00 2.88 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.46 1.35 7.81 671 T 8.27 4.03 4.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.00 0.00 672 V 7.65 3.90 2.37 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 1.20 0.00 0.00 1.10 0.00 0.00 673 E 8.43 4.15 0.00 2.27 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 2.75 0.00 674 D 8.62 4.53 0.00 3.01 2.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 675 F 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0.00 0.00 0.00 0.00 0.00 0.00 0.70 0.45 0.97 0.00 0.00 728 D 8.53 4.47 0.00 2.72 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 0.00 729 G 8.32 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 730 L 7.73 4.20 0.00 2.01 1.86 1.14 0.84 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 0.00 731 K 8.65 4.45 0.00 1.87 1.88 0.00 1.68 0.00 0.00 1.75 0.00 0.00 2.96 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.57 1.45 7.81 732 A 7.77 4.21 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 0.00 733 V 7.70 4.36 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 0.80 0.00 0.00 1.05 0.00 0.00 734 G 8.12 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 0.00 735 L 7.91 4.56 0.00 2.03 1.80 1.06 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 736 D 8.40 5.01 0.00 2.53 2.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 737 F 8.41 5.06 0.00 3.15 2.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 738 V 7.68 3.70 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 1.09 0.00 0.00 1.05 0.00 0.00 739 Y 8.38 4.24 0.00 3.29 3.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 740 K 7.13 3.80 0.00 1.84 1.77 0.00 1.55 0.00 0.00 1.60 0.00 0.00 3.17 0.00 0.00 3.05 0.00 0.00 0.00 0.00 0.83 0.48 7.81 741 L 7.73 3.63 0.00 1.83 1.92 0.96 1.37 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 0.00 742 D 8.10 4.39 0.00 3.00 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 0.00 743 E 8.34 3.92 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 2.38 2.58 0.00 744 F 7.58 3.98 0.00 2.44 2.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 745 I 7.53 3.71 1.97 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.38 0.89 0.00 0.00 746 K 7.77 3.84 0.00 1.81 1.91 0.00 1.77 0.00 0.00 1.74 0.00 0.00 3.01 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.41 1.35 7.81 747 K 7.50 4.24 0.00 1.76 1.82 0.00 1.56 0.00 0.00 1.68 0.00 0.00 2.91 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.47 1.13 7.81 748 N 7.39 4.90 0.00 2.27 2.52 0.00 0.00 6.89 8.70 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 0.00 749 S 8.26 4.05 0.00 3.83 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 0.00 750 D 8.11 4.45 0.00 2.62 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 0.00 751 K 7.43 4.67 0.00 1.63 1.78 0.00 1.63 0.00 0.00 1.68 0.00 0.00 2.93 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.35 1.33 7.81 752 I 7.43 4.34 1.98 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.73 0.92 0.00 0.00 753 R 8.17 4.06 0.00 1.76 1.83 0.00 3.26 0.00 0.00 3.26 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.65 0.00 * Residues marked with a * may have inaccurate shift predictions.