NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- *578 H 4.7186 8.4444 117.3752 53.9090 28.6301 172.2007 579 K 4.2043 8.3296 127.4861 53.8749 33.2838 174.4809 580 T 4.4797 9.3088 118.3935 61.3427 70.9449 173.7293 581 L 4.8593 8.7431 126.7430 52.8790 44.5730 176.9959 582 A 4.0051 8.6795 121.7562 55.6597 18.3860 179.9581 583 M 4.1791 7.6634 112.6240 57.7441 31.4911 177.1945 584 D 4.5551 7.6556 118.1648 55.2736 41.3464 176.9306 585 V 4.2571 7.4612 116.6774 62.7662 33.6306 175.4128 586 M 4.5048 7.6062 116.6799 55.3449 32.0715 175.9471 587 K 4.7482 8.4177 119.5571 54.1998 34.8504 174.4421 588 P 4.6804 0.0000 0.0000 62.6264 32.3373 177.3769 589 R 4.2840 8.2295 121.2088 55.0956 31.9754 175.9260 590 R 3.8530 8.5236 115.3374 58.3753 29.6442 176.2275 591 N 4.1558 8.7313 120.6410 54.7984 36.1107 173.0907 592 D 5.0686 7.7098 115.0561 51.1603 44.4073 174.7848 593 P 4.4118 0.0000 0.0000 62.7565 31.6277 176.3906 594 L 4.1857 8.2239 119.4959 54.2960 42.2311 177.1223 595 L 3.8273 8.4444 120.1746 55.8311 41.8873 177.5448 596 T 4.2099 8.5030 120.4023 63.3852 68.2365 173.9550 597 V 4.8189 8.1820 125.0989 59.7756 35.0044 174.4971 598 L 4.9957 8.6921 119.8801 53.1443 45.3762 176.4240 599 T 5.0734 8.4442 111.4803 60.6390 71.0193 174.4808 600 Q 4.7072 8.7236 118.6840 57.4037 29.2991 176.5159 601 D 4.7214 8.2016 115.6782 54.7945 46.1245 175.3785 602 S 4.7032 7.9625 110.7225 57.9894 64.0044 173.5338 603 M 4.4943 7.8124 121.6290 54.4694 33.7815 175.6505 604 T 4.8274 7.9100 112.4446 60.1473 72.3706 176.1239 605 V 3.5533 8.0632 119.9300 66.2327 31.3761 177.5018 606 E 3.9269 8.0448 118.4892 59.1669 29.5690 178.3528 607 D 4.3350 7.7118 117.7212 57.6463 41.0049 179.1799 608 V 3.5489 7.6397 117.9812 65.8654 31.4263 177.9225 609 E 3.9927 8.2501 118.8892 59.5168 29.3197 179.3631 610 T 3.9777 8.0430 109.8774 64.5453 68.8165 176.9351 611 I 3.6577 7.5938 122.3417 64.3349 36.9070 178.3898 612 I 3.8191 7.4833 119.2403 64.5198 36.9904 178.2009 613 S 4.2349 7.8599 113.0568 60.8984 62.3381 175.2253 614 E 4.3949 8.2005 119.2245 56.0047 29.8722 175.7849 615 T 4.5938 7.0730 108.4769 59.9472 71.7201 173.4474 616 T 4.6049 7.5610 109.2580 61.3726 69.4703 173.6164 617 Y 4.4378 7.5616 119.0720 58.4979 38.6544 176.3077 618 S 4.2118 8.8892 120.0340 61.5703 63.1659 174.0207 619 G 4.0256 7.2700 104.0281 45.0383 0.0000 172.0213 620 F 5.0565 8.1513 117.4554 54.8033 43.2973 173.6060 621 P 5.0579 0.0000 0.0000 62.6628 33.0915 175.2445 622 V 4.7500 8.8991 122.1438 61.3284 34.2597 175.0235 623 V 4.8210 8.5096 120.6221 59.3682 34.8045 177.0542 624 V 3.7754 8.5343 122.8824 65.9897 31.9262 175.9902 625 S 4.6169 7.7050 112.0858 57.4621 65.7996 175.9652 626 R 4.0100 8.4960 119.6464 58.9188 30.1606 178.1961 627 E 4.1484 8.2321 118.2225 58.8632 29.8181 177.7897 628 S 4.1537 8.0664 113.4561 60.4367 63.4462 175.4603 629 Q 4.0520 8.3221 117.6431 56.2664 26.9107 172.8524 630 R 4.4574 7.3457 117.8132 55.8035 31.0937 175.8260 631 L 4.2762 8.5774 126.8331 55.3396 42.2740 175.9936 632 V 4.1070 8.6887 126.2015 64.3129 33.5920 175.2146 633 G 4.1056 6.9901 104.0873 46.1331 0.0000 171.6308 634 F 5.6109 8.2979 120.8656 56.3987 43.2482 175.2904 635 V 4.6163 7.4605 123.2269 59.9684 34.9526 174.4240 636 L 4.4752 8.3514 123.3351 53.6644 43.2353 177.4615 637 R 4.0083 8.8472 123.7033 59.7657 29.6765 178.6437 638 R 3.9078 8.1296 117.8976 60.0812 29.9054 177.8659 639 D 4.4071 7.9964 117.6675 57.0451 40.8967 178.6386 640 L 4.0008 8.2268 119.7827 57.8177 41.6063 179.2972 641 I 3.6744 7.7808 119.6270 64.6791 37.1317 178.3842 642 I 3.6925 7.4277 119.8905 64.7744 36.7711 178.8370 643 S 4.1865 8.1569 115.7216 61.3187 62.2579 176.5762 644 I 3.7867 7.7969 122.4571 63.7338 36.5885 178.0958 645 E 4.0256 8.4486 119.8553 59.2481 29.1050 178.8409 646 N 4.4795 8.1712 115.2115 55.4248 38.2094 176.5773 647 A 4.2978 7.4277 121.8602 54.0691 19.0896 179.7083 648 R 3.8745 7.6284 116.5052 59.5686 29.9965 179.3572 649 K 3.9926 7.4594 115.4716 59.4608 32.0587 179.3050 650 K 4.0140 7.5229 118.3494 57.1288 32.9171 176.9601 651 Q 3.3818 7.7641 117.6012 57.5152 26.5621 173.4830 652 D 4.8910 7.9038 109.4104 53.4758 40.3392 177.4433 653 G 3.9329 8.5038 109.1928 46.3686 0.0000 174.7203 654 V 3.6909 7.5702 118.9056 62.8555 31.2124 175.0292 655 V 4.5678 8.1347 120.4694 58.6699 35.2859 176.9967 656 S 3.6525 8.5123 115.1323 61.6812 62.4704 176.0716 657 T 4.5055 7.6915 107.9369 61.2443 69.1141 174.4149 658 S 4.3975 8.7374 120.9065 58.7754 64.2122 173.5997 659 I 4.3983 8.4152 125.1624 61.3080 38.3248 174.7208 660 I 4.8524 8.7100 128.4831 60.0660 38.4745 174.8324 661 Y 5.0804 8.3751 123.8763 55.4339 41.4804 175.5550 662 F 4.9352 9.0783 118.1023 57.4897 40.4985 175.7819 663 T 4.3962 8.1998 109.5588 60.9186 69.8660 174.4113 664 E 4.1290 8.7993 120.5904 58.8989 29.6266 177.2296 665 H 4.9948 7.7416 113.2597 53.4971 31.5520 173.7757 666 S 2.9574 8.1476 116.1790 56.5495 62.8724 172.3787 667 P 4.2837 0.0000 0.0000 61.6435 31.6485 174.2627 668 P 4.3140 0.0000 0.0000 62.9676 31.6262 175.7555 669 L 4.7401 8.0765 121.7791 51.8482 45.3936 174.4148 670 P 4.4011 0.0000 0.0000 61.8082 32.1487 174.1284 671 P 4.3706 0.0000 0.0000 64.0579 31.8812 176.9345 672 Y 3.7187 8.2678 115.4643 58.4773 35.6446 169.8237 673 T 4.3195 7.3105 109.6082 59.8605 69.8874 173.1199 674 P 4.4510 0.0000 0.0000 61.7293 31.9953 173.9423 675 P 4.5744 0.0000 0.0000 63.6370 31.7308 175.4574 676 T 4.7232 8.3742 110.4295 60.3481 71.4828 173.5956 677 L 4.5009 9.0551 124.9125 53.2030 44.2783 174.9609 678 K 3.3700 8.2901 128.5182 54.5958 32.9483 176.0839 679 L 4.5539 7.6839 127.2147 54.3924 42.3555 178.5810 680 R 4.1710 7.7455 121.5988 58.7352 30.1429 177.2043 681 N 4.9146 8.0630 113.5033 52.9592 37.6090 175.0907 682 I 4.4726 7.6141 110.2099 60.4345 38.4130 174.6034 683 L 4.3151 7.4685 122.3850 53.8320 42.9763 175.7537 684 D 4.5525 8.8342 126.3662 53.9524 40.0734 175.6363 685 L 4.5067 8.3611 125.1575 55.1246 42.0519 178.3252 686 S 4.7122 8.0754 113.8085 56.7308 63.6541 172.6534 687 P 4.4192 0.0000 0.0000 62.4950 32.7469 176.4409 688 F 4.3570 8.4701 122.5616 58.4556 40.6531 174.1414 689 T 5.0729 6.8042 119.9690 62.0213 72.5852 173.5544 690 V 4.4696 8.1499 122.6803 61.7911 35.5242 173.7615 691 T 4.6832 8.6239 118.3394 61.4612 69.6504 175.2306 692 D 4.4402 8.9110 122.9579 56.0863 39.5275 178.1125 693 L 4.2756 7.7527 117.7893 55.7776 42.4638 177.1015 694 T 3.9432 7.8173 117.4414 62.9181 69.1172 172.2503 695 P 4.6835 0.0000 0.0000 62.6727 33.4387 177.5999 696 M 4.2211 8.6512 120.2791 57.9512 31.3678 179.1630 697 E 3.9842 8.1270 119.0482 59.5202 29.7057 179.0894 698 I 3.9145 7.7058 119.3446 64.0469 37.3009 178.5074 699 V 3.7160 7.7016 118.9361 66.0324 31.5356 178.2765 700 V 3.6603 8.1449 118.2813 66.0217 31.3083 177.5294 701 D 4.3868 7.9152 116.7610 57.1833 41.0507 178.3289 702 I 3.6540 7.8739 120.5448 64.2142 36.9312 178.3134 703 F 3.8180 8.3689 118.6959 60.5432 38.5055 178.0021 704 R 3.9417 7.7584 116.1058 59.3324 30.0216 179.0290 705 K 4.1376 7.9557 116.6112 58.1061 32.2295 178.3389 706 L 4.4825 7.6485 116.8005 52.9001 43.2543 176.1773 707 G 3.8406 7.7725 106.6126 46.3761 0.0000 174.3361 708 L 4.0103 7.5521 117.7290 54.5186 42.6867 177.7083 709 R 4.5383 8.3791 120.3464 58.2186 31.7221 176.0464 710 Q 5.1858 7.5615 113.9019 55.3228 32.0257 173.6572 711 C 4.7349 9.4857 119.5666 57.8994 35.6438 172.3510 712 L 5.0034 8.5315 125.5460 53.3862 43.4979 175.4935 713 V 5.4589 8.9059 123.9497 60.9787 33.8135 174.6403 714 T 5.2078 8.2760 115.8547 60.3759 73.3066 172.0132 715 H 4.8135 9.2281 121.3087 54.9206 33.0480 172.9517 716 N 4.0913 9.8744 124.7095 54.3493 36.0485 175.4380 717 G 3.9343 8.4910 103.9697 45.3685 0.0000 173.8908 718 R 4.6092 7.7117 119.3119 53.6274 32.3618 175.3485 719 L 4.3735 8.4432 124.7629 55.3221 42.8095 175.5423 720 L 4.5733 8.8889 124.8967 56.2762 44.0512 176.2011 721 G 4.1537 7.4555 103.0872 45.8330 0.0000 171.0357 722 I 5.2292 8.3748 118.6044 59.5376 42.2160 174.9943 723 I 4.9842 9.1450 128.6569 59.7367 40.7475 174.8007 724 T 4.9270 8.5102 116.0797 59.6901 71.6152 175.2664 725 K 3.6348 8.9889 123.7309 60.0079 31.9944 178.7929 726 K 3.9098 8.0424 118.8961 59.6203 32.1362 178.2427 727 D 4.2976 8.0114 119.2635 57.1575 40.6479 179.0033 728 V 3.4015 7.3159 118.2757 65.9188 31.6342 177.9051 729 L 3.9774 7.8880 118.7392 57.7939 41.2714 179.7638 730 K 3.9941 8.3985 118.8473 59.6434 31.7502 178.9421 731 H 4.2159 7.8856 117.6612 59.2070 30.0539 177.1095 732 I 3.8778 7.9912 121.6128 64.0630 36.5847 178.1878 733 A 3.9598 7.9885 121.5838 54.7956 17.9603 179.0768 734 Q 3.7077 7.6954 116.7469 58.4349 29.1652 177.2712 735 M 4.2099 7.6496 118.4486 58.0638 32.6379 177.2790 736 A 3.1240 6.9500 119.1998 54.1269 18.9805 178.1434 737 N 4.7485 7.5489 122.2483 51.5819 38.0672 174.4284 738 Q 4.4221 7.8484 131.9140 56.4111 32.3064 176.2798 *744 L 4.3685 8.9768 120.0053 54.7800 43.8737 177.5374 745 F 4.0505 8.1823 120.1972 60.8091 40.1530 176.6236 746 N 4.3612 8.5199 118.1386 56.4948 38.4230 176.9038 747 E 4.0021 7.8262 119.3591 59.1041 29.4261 179.2361 748 F 4.2639 7.7986 120.7773 61.1615 39.5497 177.1626 749 L 3.6877 7.4787 117.7893 57.0454 41.3693 178.9833 750 E 4.0741 7.6699 117.3515 58.7421 29.0166 179.1729 751 V 3.5497 7.1403 118.1983 65.9394 31.5987 177.5912 752 L 4.0003 7.6343 116.4755 56.2570 41.4980 177.0886 753 F 4.3182 7.9939 122.4199 57.4156 39.1540 175.3161 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 *578 H 8.44 4.72 0.00 2.95 2.99 0.00 7.17 0.00 0.00 0.00 0.00 6.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 579 K 8.33 4.20 0.00 1.85 1.74 0.00 1.74 0.00 0.00 1.74 0.00 0.00 2.93 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.43 1.51 7.81 580 T 9.31 4.48 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 1.24 0.00 0.00 581 L 8.74 4.86 0.00 1.61 1.77 0.92 0.62 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 0.00 582 A 8.68 4.01 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 0.00 583 M 7.66 4.18 0.00 2.08 2.20 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.61 0.00 584 D 7.66 4.56 0.00 2.79 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 0.00 585 V 7.46 4.26 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 0.78 0.00 0.00 0.78 0.00 0.00 586 M 7.61 4.50 0.00 2.15 2.05 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.71 0.00 587 K 8.42 4.75 0.00 1.67 1.73 0.00 1.69 0.00 0.00 1.65 0.00 0.00 2.82 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.36 1.54 7.81 588 P 0.00 4.68 0.00 1.94 2.11 0.00 3.67 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 2.03 2.11 0.00 589 R 8.23 4.28 0.00 1.81 1.91 0.00 3.38 0.00 0.00 3.37 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.57 0.00 590 R 8.52 3.85 0.00 1.92 1.96 0.00 3.35 0.00 0.00 3.23 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.61 0.00 591 N 8.73 4.16 0.00 2.87 2.92 0.00 0.00 6.95 8.06 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 0.00 592 D 7.71 5.07 0.00 2.65 2.59 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 0.00 593 P 0.00 4.41 0.00 2.23 2.11 0.00 3.81 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.05 0.00 594 L 8.22 4.19 0.00 1.68 1.67 0.94 0.99 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 0.00 595 L 8.44 3.83 0.00 1.64 1.66 0.95 0.87 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 0.00 596 T 8.50 4.21 4.62 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 0.00 0.00 0.00 1.38 0.00 0.00 597 V 8.18 4.82 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 0.76 0.00 0.00 1.02 0.00 0.00 598 L 8.69 5.00 0.00 1.52 1.60 0.93 0.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 599 T 8.44 5.07 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 1.24 0.00 0.00 600 Q 8.72 4.71 0.00 2.37 2.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.58 0.00 0.00 0.00 0.00 0.00 2.66 2.40 0.00 601 D 8.20 4.72 0.00 2.67 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 0.00 602 S 7.96 4.70 0.00 3.95 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 0.00 603 M 7.81 4.49 0.00 2.11 2.06 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.64 2.64 0.00 604 T 7.91 4.83 4.45 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 1.26 0.00 0.00 605 V 8.06 3.55 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 0.97 0.00 0.00 0.96 0.00 0.00 606 E 8.04 3.93 0.00 2.17 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 2.30 2.34 0.00 607 D 7.71 4.34 0.00 2.99 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 0.00 608 V 7.64 3.55 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 0.98 0.00 0.00 0.92 0.00 0.00 609 E 8.25 3.99 0.00 2.27 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 2.32 2.46 0.00 610 T 8.04 3.98 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 1.28 0.00 0.00 611 I 7.59 3.66 1.81 0.00 0.00 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.78 0.47 0.00 0.00 612 I 7.48 3.82 2.01 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 1.48 0.69 0.97 0.00 0.00 613 S 7.86 4.23 0.00 4.05 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 0.00 614 E 8.20 4.39 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 2.30 2.39 0.00 615 T 7.07 4.59 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 1.34 0.00 0.00 616 T 7.56 4.60 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 1.13 0.00 0.00 617 Y 7.56 4.44 0.00 2.65 2.59 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 0.00 618 S 8.89 4.21 0.00 3.94 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 0.00 619 G 7.27 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 0.00 620 F 8.15 5.06 0.00 2.80 2.79 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 0.00 621 P 0.00 5.06 0.00 2.13 2.07 0.00 3.84 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 2.25 0.00 622 V 8.90 4.75 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 0.40 0.00 0.00 0.36 0.00 0.00 623 V 8.51 4.82 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 0.78 0.00 0.00 1.01 0.00 0.00 624 V 8.53 3.78 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0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.60 0.96 0.00 0.00 699 V 7.70 3.72 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 1.20 0.00 0.00 1.08 0.00 0.00 700 V 8.14 3.66 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 0.95 0.00 0.00 0.99 0.00 0.00 701 D 7.92 4.39 0.00 3.03 2.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 702 I 7.87 3.65 1.97 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.60 0.39 0.00 0.00 703 F 8.37 3.82 0.00 3.34 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 0.00 704 R 7.76 3.94 0.00 2.05 1.98 0.00 3.15 0.00 0.00 3.36 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.70 0.00 705 K 7.96 4.14 0.00 1.77 1.81 0.00 1.89 0.00 0.00 1.68 0.00 0.00 3.00 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.44 1.45 7.81 706 L 7.65 4.48 0.00 1.37 1.41 0.32 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 707 G 7.77 3.84 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 0.00 0.00 0.00 708 L 7.55 4.01 0.00 0.74 1.05 0.19 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 709 R 8.38 4.54 0.00 1.74 1.98 0.00 3.13 0.00 0.00 3.42 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.62 0.00 710 Q 7.56 5.19 0.00 1.96 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.60 6.68 0.00 0.00 0.00 0.00 0.00 1.73 1.34 0.00 711 C 9.49 4.73 0.00 2.73 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 0.00 712 L 8.53 5.00 0.00 1.63 1.54 0.91 0.56 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 0.00 713 V 8.91 5.46 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 1.15 0.00 0.00 0.95 0.00 0.00 714 T 8.28 5.21 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 1.18 0.00 0.00 715 H 9.23 4.81 0.00 3.29 3.16 0.00 5.93 0.00 0.00 0.00 0.00 6.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 716 N 9.87 4.09 0.00 2.70 2.76 0.00 0.00 7.29 7.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 717 G 8.49 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 718 R 7.71 4.61 0.00 1.97 1.82 0.00 3.14 0.00 0.00 3.24 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.52 0.00 719 L 8.44 4.37 0.00 1.60 1.68 0.98 0.80 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 0.00 720 L 8.89 4.57 0.00 1.65 1.65 0.91 0.89 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 0.00 721 G 7.46 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 0.00 0.00 0.00 722 I 8.37 5.23 1.85 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 1.44 0.84 0.00 0.00 723 I 9.15 4.98 2.03 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 1.28 0.55 0.77 0.00 0.00 724 T 8.51 4.93 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 1.22 0.00 0.00 725 K 8.99 3.63 0.00 2.00 1.93 0.00 1.70 0.00 0.00 1.61 0.00 0.00 2.93 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.45 1.55 7.81 726 K 8.04 3.91 0.00 1.86 1.79 0.00 1.79 0.00 0.00 1.82 0.00 0.00 2.98 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.50 1.53 7.81 727 D 8.01 4.30 0.00 2.91 2.62 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 0.00 0.00 0.00 0.00 728 V 7.32 3.40 1.84 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 0.86 0.00 0.00 -0.20 0.00 0.00 729 L 7.89 3.98 0.00 1.87 1.69 0.92 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 730 K 8.40 3.99 0.00 1.91 1.85 0.00 1.66 0.00 0.00 1.57 0.00 0.00 2.90 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.45 1.62 7.81 731 H 7.89 4.22 0.00 3.14 3.53 0.00 5.94 0.00 0.00 0.00 0.00 7.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 732 I 7.99 3.88 1.90 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 1.47 1.01 1.10 0.00 0.00 733 A 7.99 3.96 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 0.00 734 Q 7.70 3.71 0.00 2.12 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.23 6.80 0.00 0.00 0.00 0.00 0.00 2.36 2.38 0.00 735 M 7.65 4.21 0.00 2.06 2.23 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.52 0.00 736 A 6.95 3.12 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 737 N 7.55 4.75 0.00 2.79 2.84 0.00 0.00 5.71 7.39 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 0.00 738 Q 7.85 4.42 0.00 1.99 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.72 0.00 0.00 0.00 0.00 0.00 2.28 2.44 0.00 *744 L 8.98 4.37 0.00 1.83 1.75 0.94 0.81 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 0.00 745 F 8.18 4.05 0.00 3.08 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 0.00 746 N 8.52 4.36 0.00 2.89 2.86 0.00 0.00 7.18 7.66 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 0.00 747 E 7.83 4.00 0.00 2.14 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 2.32 2.32 0.00 748 F 7.80 4.26 0.00 2.85 2.79 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 0.00 749 L 7.48 3.69 0.00 1.81 1.68 1.08 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 750 E 7.67 4.07 0.00 2.19 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 2.22 2.40 0.00 751 V 7.14 3.55 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 0.69 0.00 0.00 0.85 0.00 0.00 752 L 7.63 4.00 0.00 1.37 1.42 0.84 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 753 F 7.99 4.32 0.00 3.03 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 * Residues marked with a * may have inaccurate shift predictions.