NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 515 S 4.4787 8.1933 116.7913 57.5617 64.6829 174.2733 516 P 4.3219 0.0000 0.0000 64.7205 31.0473 177.5044 517 L 4.0372 8.7023 118.6430 57.9062 42.1288 179.1025 518 L 3.6732 7.8709 118.3291 57.7646 41.6296 179.3489 519 E 3.9459 7.9704 118.1935 59.2439 29.2391 178.8948 520 Q 4.1249 8.2792 118.5875 57.9602 29.4248 177.6258 521 L 4.0696 7.4600 121.6727 57.9776 42.3745 178.6953 522 R 3.8491 7.6363 115.6547 59.4056 29.2895 178.4792 523 N 4.6898 7.6039 113.9183 53.0626 38.4569 175.8107 524 S 4.4018 7.9881 115.1448 58.9838 64.7840 174.3769 525 S 4.1732 7.6542 115.4403 58.8756 60.6483 173.6957 *532 S 4.3060 8.2392 119.0369 57.7659 64.2113 173.8529 533 N 4.6303 7.9271 119.4681 53.0313 39.5828 173.9930 534 M 4.5845 8.2048 120.8883 54.6427 33.1172 175.1192 535 S 4.9462 9.3126 114.2200 56.5421 66.5170 174.9338 536 L 4.0329 8.5181 119.3660 57.6011 41.3182 179.7842 537 K 4.1646 7.4640 116.3554 58.9465 32.7650 177.7255 538 D 4.5497 8.2080 119.1921 55.6036 41.2418 176.9015 539 I 4.2705 7.3913 112.3783 60.2121 37.6895 177.0651 540 F 4.4193 8.5054 124.8024 61.4992 39.2561 176.6966 541 G 3.8154 8.3109 108.6348 48.3255 0.0000 173.6187 542 H 5.0281 8.6741 117.5178 54.6502 30.1503 176.0876 543 S 4.0946 8.7419 117.8814 61.7819 63.0592 175.7838 544 L 3.9811 7.9572 122.5075 58.4116 42.0995 178.4461 545 E 4.1242 8.2289 118.1920 58.7910 29.2822 178.4763 546 F 3.8598 8.3884 118.3185 60.5422 38.7899 177.4827 547 C 4.3907 8.6022 116.2089 62.3254 28.0578 175.3000 548 K 4.3854 7.9449 117.1963 55.9096 32.4827 175.9656 549 D 4.9315 7.0110 118.9585 52.2019 43.3628 176.5903 550 Q 2.7746 8.0065 126.8232 59.2444 28.9389 178.4977 551 H 4.2322 7.7228 116.6287 58.7557 28.9000 177.5645 552 G 3.7996 8.2897 109.2082 47.1572 0.0000 175.4513 553 S 4.2356 8.3703 115.8528 61.3244 62.5570 176.4381 554 R 3.8612 7.9895 120.7075 59.0176 29.7284 178.7272 555 F 4.1634 8.4120 120.4554 61.6320 39.4058 177.3440 556 I 3.4729 8.1374 119.2509 64.2780 36.6485 178.3432 557 Q 3.9299 8.1366 118.4109 58.9963 28.5161 178.8704 558 R 3.8852 7.7323 119.3380 59.5052 30.1733 178.4659 559 E 3.7227 7.7760 118.3061 59.1999 29.1054 179.3407 560 L 3.7958 7.6134 117.9922 57.1245 41.6430 178.8293 561 A 2.5800 6.9637 119.5076 53.0695 18.3887 177.8062 562 T 4.3801 6.9739 103.5674 60.8312 70.2581 174.2090 563 S 4.3612 7.6769 119.2329 57.1584 63.8684 172.9535 564 P 4.4078 0.0000 0.0000 62.5162 32.9763 177.0803 565 A 3.9923 8.6473 120.5769 55.9580 18.0766 180.2821 566 S 4.1013 8.0228 112.6824 61.9096 63.0433 176.6875 567 E 4.0957 8.1146 120.7210 59.0675 29.2244 179.3521 568 K 4.1373 7.9792 118.3544 59.4607 32.1442 179.0494 569 E 4.0386 8.6256 119.3307 59.5965 29.5505 179.7275 570 V 3.7415 7.7553 117.6404 65.9997 31.7241 178.1253 571 I 3.8766 7.7902 119.0795 64.3618 37.1569 178.1641 572 F 3.5731 8.5722 121.5391 61.3545 39.0475 176.9270 573 N 4.4089 8.5990 114.4087 55.5010 38.3030 176.5202 574 E 4.0751 7.4848 119.5020 57.9113 30.2002 177.3537 575 I 4.1916 7.1869 110.6037 60.6729 38.1410 177.5494 576 R 3.2629 7.2335 119.1885 59.5309 28.9362 178.4431 577 D 4.4326 7.8649 117.6680 55.8325 40.9982 177.0945 578 D 4.9130 7.5670 119.1435 53.7967 41.9196 178.3004 579 A 3.9505 7.7743 124.1190 55.3455 18.1751 180.2749 580 I 3.7476 7.7769 116.4532 64.6682 37.6678 177.6587 581 E 4.0969 8.1756 119.2667 59.4683 29.4858 178.6165 582 L 4.0523 8.1103 118.9296 58.0549 41.5404 179.6940 583 S 4.2038 8.6242 115.4140 61.4351 62.5494 175.8345 584 N 4.6375 7.8274 116.5754 53.3096 39.1323 174.7988 585 D 4.6258 7.6535 121.5921 52.8662 42.3145 177.3769 586 V 2.0000 7.8653 125.5101 63.7953 30.9648 177.6424 587 F 5.2795 8.9047 117.4958 58.2275 40.6017 177.8629 588 G 3.6839 8.3394 104.6753 46.9379 0.0000 175.2725 589 N 4.5547 7.9048 119.5121 56.0701 37.3456 176.9685 590 Y 4.1994 7.4121 119.1362 60.8792 37.6745 178.5863 591 V 3.7778 7.6622 118.2579 65.9033 31.9562 177.8726 592 I 4.1254 7.9297 119.2216 64.6201 37.0674 178.0981 593 Q 4.3348 8.2675 118.7968 59.2393 28.5706 179.3119 594 K 4.1388 8.3742 119.2071 59.2724 32.0493 179.3869 595 F 4.2916 8.0624 117.6985 60.1102 38.5266 177.6584 596 F 4.2540 7.9528 116.6984 60.1094 38.9129 176.9515 597 E 2.7890 7.7509 118.3033 57.8825 29.4872 177.2920 598 F 4.6864 8.1686 113.9077 56.8860 40.0305 175.7008 599 G 4.4930 7.9824 109.5975 44.0892 0.0000 174.2104 600 S 4.4806 8.4331 115.0508 56.8781 65.5554 175.0139 601 K 3.7421 8.5485 123.5564 60.2380 31.6761 178.4949 602 I 3.6507 7.7876 119.0139 64.7638 37.1038 178.2985 603 Q 3.2696 7.4421 118.5248 58.4395 28.4229 178.6769 604 K 3.6728 8.2378 119.8519 59.6138 32.1033 179.0034 605 N 4.3404 8.6067 116.9217 56.7611 38.1896 177.6322 606 T 3.8682 7.4431 115.9205 66.5215 68.8373 176.5309 607 L 3.8092 7.7022 120.6129 57.5144 41.5517 179.5555 608 V 3.4909 7.7568 118.1831 66.2674 31.2820 177.8581 609 D 4.5490 8.0327 116.7610 56.7818 40.6854 177.9558 610 Q 4.2470 7.5535 116.9964 57.2295 29.2281 177.2176 611 F 4.9925 8.3146 119.5613 58.1376 39.3235 176.1671 612 K 4.1675 7.8346 117.3466 58.4844 32.0751 177.0363 613 G 4.0112 9.5589 112.3104 45.6127 0.0000 173.2989 614 N 4.9899 8.5818 115.5571 52.4314 40.5090 175.8349 615 M 3.9173 8.3893 120.0395 58.5379 32.1562 178.4144 616 K 3.8098 7.9454 118.6449 59.5595 32.2073 178.2441 617 Q 3.9027 7.9065 117.6156 59.3192 29.4807 177.7611 618 L 4.2952 7.8042 121.1851 57.4585 41.4088 179.8076 619 S 4.1073 8.2133 114.2362 60.8950 62.7911 175.9149 620 L 4.3449 7.3900 119.6530 54.9912 42.1689 177.1338 621 Q 4.1488 7.2173 118.7830 55.2550 29.5176 176.7724 622 M 4.0822 8.2815 122.2308 57.8124 32.4486 177.5052 623 Y 4.5495 7.2717 115.2530 60.0903 38.9843 177.6722 624 A 4.2695 8.2128 122.6109 54.5614 18.3232 179.2065 625 C 3.9620 7.8789 112.6629 61.4884 29.5633 176.4493 626 R 3.8427 7.9122 120.7087 58.8642 29.4828 179.1668 627 V 3.6459 7.5138 117.7880 65.9444 31.6627 177.9519 628 I 3.4607 7.7809 119.7560 64.4821 36.6963 178.4267 629 Q 3.9246 7.9580 117.8478 58.8183 28.9094 178.5409 630 K 4.1445 8.0782 120.4611 59.2679 32.1733 178.7922 631 A 3.1862 7.8652 121.3308 54.8182 17.9380 179.4737 632 L 3.8469 7.5029 116.3638 58.1066 41.7379 179.3425 633 E 3.9127 7.6265 116.1205 58.7213 29.3914 177.4501 634 Y 4.4810 7.8843 114.5533 57.8470 39.9524 175.9493 635 I 4.3267 7.5237 112.9173 59.3375 39.5132 174.7673 636 D 4.6760 8.3982 120.3455 52.5143 40.2272 177.4450 637 S 4.1258 8.8037 116.0240 62.2554 62.5595 176.6774 638 N 4.3809 8.1576 119.2139 56.0985 38.3900 177.2947 639 Q 4.0933 8.8093 120.0027 58.6076 28.6587 178.6789 640 R 3.9028 7.9430 119.2897 59.4810 30.1216 178.9273 641 I 3.7100 7.5483 118.3140 63.8810 37.7514 177.3596 642 E 3.9294 7.9592 119.4793 59.3697 29.8576 178.6833 643 L 4.1514 8.0145 118.7774 57.9335 41.7330 179.7167 644 V 3.6531 8.1167 118.3923 65.8404 31.5212 177.7896 645 L 3.7622 8.3307 119.0927 57.4296 41.2013 178.6942 646 E 4.1914 7.8657 116.3717 57.5090 29.7835 177.6856 647 L 4.5470 7.8068 119.4331 54.2718 41.9250 178.1408 648 S 3.6818 7.5230 114.7798 60.4277 62.8433 174.8779 649 D 4.8883 7.9083 118.2810 54.1682 41.3404 176.2375 650 S 4.6629 8.2286 113.9340 57.6058 64.6925 176.0272 651 V 3.5523 8.0608 121.3729 66.3025 31.0149 177.6626 652 L 3.9001 7.9142 117.8685 58.0869 41.2945 179.2250 653 Q 3.9515 7.9947 117.2518 59.5158 29.1124 177.8995 654 M 4.1673 8.4655 119.9639 58.5372 31.8043 178.8902 655 I 3.7269 7.8197 118.8758 63.8314 37.3081 177.9768 656 K 4.3005 7.6528 117.5515 56.7308 32.8687 176.7163 657 D 4.5389 7.3137 120.4625 53.4113 41.7961 176.7309 658 Q 3.5903 8.7981 126.6112 58.7580 28.8666 177.6177 659 N 4.6971 8.6395 117.0667 54.7157 39.8203 177.3890 660 G 3.6608 8.0908 106.5401 47.1767 0.0000 175.3082 661 N 4.3114 7.7676 119.0197 56.1333 37.1492 177.0933 662 H 4.1303 7.7235 117.3199 58.3179 28.7481 177.9264 663 V 3.4902 7.4971 119.8246 65.8130 31.4000 177.7377 664 I 3.6033 7.6198 119.5784 64.6408 37.0204 178.2796 665 Q 3.8253 7.9188 118.4522 58.8086 28.5422 178.8564 666 K 3.7507 8.1725 120.4987 59.4498 32.1919 178.4935 667 A 3.9001 8.2990 121.2860 55.3872 18.0679 179.7108 668 I 3.4761 7.5369 117.1496 64.4113 37.1382 178.2591 669 E 2.9818 7.6729 118.8946 58.1547 29.3488 178.3254 670 T 4.3306 7.5185 107.5995 60.6977 70.1972 174.6072 671 I 4.5040 6.9419 122.2641 58.3459 40.1654 173.5634 672 P 4.3217 0.0000 0.0000 62.4793 31.8380 177.0840 673 I 3.4043 8.6922 123.5555 64.2327 37.4571 177.3155 674 E 4.1397 8.2549 117.1820 59.2366 29.1840 178.3915 675 K 4.3422 8.4864 117.0260 56.3763 33.5574 176.6689 676 L 4.2154 7.9558 120.1871 53.0337 42.4461 176.6114 677 P 4.2341 0.0000 0.0000 65.2649 31.5025 177.8714 678 F 4.7408 7.4629 112.6239 58.4203 38.2734 176.9743 679 I 3.8334 6.9929 121.3759 64.1796 37.0010 177.6973 680 L 3.9693 7.6139 120.5969 58.2478 42.0542 179.2957 681 S 4.4344 8.0217 113.5430 61.2024 62.5503 176.0599 682 S 4.4406 7.7669 116.6829 59.7596 63.0927 175.3251 683 L 4.4649 8.2383 121.9563 54.7441 42.0019 176.7889 684 T 4.1687 7.5230 109.2165 63.2828 68.8857 173.7391 685 G 3.9809 9.9691 114.7444 45.5614 0.0000 174.1975 686 H 4.8286 8.7179 115.2793 55.5897 29.6438 176.2950 687 I 3.7368 7.7081 123.0551 64.4160 36.7068 177.5637 688 Y 3.9718 7.9329 118.8363 60.8834 39.1147 176.6485 689 H 4.0075 8.3985 118.7142 59.6598 29.8166 176.8392 690 L 3.9304 8.2227 120.5696 57.7675 41.2986 179.3774 691 S 4.3099 7.9093 114.2878 60.0677 62.6073 175.3143 692 T 4.5769 7.1511 110.6871 60.8309 69.6345 173.8280 693 H 4.4106 6.9637 121.9239 55.1637 31.1779 175.5715 694 S 2.7900 7.1881 118.3800 60.7839 62.4115 175.4420 695 Y 4.5900 6.9425 118.1856 59.9217 38.3716 177.8796 696 G 4.2734 8.4551 107.8300 47.3512 0.0000 175.1501 697 C 4.1812 7.7754 116.5851 60.7939 29.8335 176.3538 698 R 3.7640 7.7623 120.2485 59.0492 29.7935 178.7946 699 V 3.4979 7.5197 117.5831 66.0678 31.4682 177.9048 700 I 3.6406 7.7649 119.4163 64.7231 37.0165 178.3219 701 Q 3.6200 8.1863 118.8236 58.9893 28.3468 179.4216 702 R 4.0117 7.8930 118.9846 59.0753 30.1302 178.9503 703 L 3.9942 8.4363 119.1774 57.7026 41.3699 179.5948 704 L 4.0383 7.8559 117.9788 57.8143 41.7045 178.8404 705 E 4.5298 7.8258 119.0906 58.4313 29.7524 178.0259 706 F 4.5955 8.4132 114.7211 56.5712 39.9806 176.5203 707 G 3.8859 7.5973 108.2535 44.6151 0.0000 174.4181 708 S 4.3558 8.5282 116.0136 57.8306 65.1550 175.2906 709 S 4.0923 8.6854 116.4249 61.8167 61.8113 176.3928 710 E 4.0019 8.0904 120.7116 59.2968 29.4216 178.5763 711 D 4.3743 8.0303 118.8903 57.7060 40.8962 178.9951 712 Q 4.0616 8.2818 118.3994 58.8044 28.6615 178.6459 713 E 3.9060 8.0443 120.0868 59.4544 29.5565 178.7760 714 S 4.1526 8.1353 111.9913 61.3684 62.0915 175.8892 715 I 4.0324 7.6681 122.3296 64.1345 37.2168 178.2311 716 L 4.1947 8.2164 119.5627 57.4144 41.1968 179.2191 717 N 4.4427 8.0841 116.2390 55.9989 38.5715 176.4077 718 E 4.3963 7.8757 116.6398 57.3822 30.0544 177.5801 719 L 4.9790 7.6892 118.5471 55.0031 43.4488 177.6878 720 K 4.2631 7.9538 115.7823 58.2013 32.5221 177.0409 721 D 4.5303 7.6639 118.2051 54.4096 41.4756 176.4092 722 F 5.2898 8.3080 117.1190 56.6101 41.0842 176.5151 723 I 3.7906 8.2026 124.7529 64.3073 36.5148 176.0753 724 P 4.2125 0.0000 0.0000 65.8792 31.4191 177.9606 725 Y 4.3591 7.5189 114.7877 61.0759 37.8392 178.0917 726 L 4.0909 8.3663 119.9508 58.1071 41.5598 179.7119 727 I 3.5712 7.9412 118.7325 63.5853 37.0348 177.4288 728 Q 4.1842 7.4305 115.4990 54.7308 29.8564 175.4819 729 D 4.3800 7.2137 121.2783 53.4786 41.8870 177.0061 730 Q 2.5200 7.6828 122.7654 57.6097 28.6934 176.8927 731 Y 4.9397 7.3709 117.0630 59.5807 40.0734 177.5757 732 G 4.0099 8.1045 106.1992 47.9168 0.0000 175.1927 733 N 4.3813 7.8075 118.7497 55.7978 37.1147 177.0122 734 Y 4.1248 8.0490 119.5758 60.8814 37.9756 178.0797 735 V 3.7365 7.8333 118.8442 65.9667 31.5760 178.0474 736 I 3.7472 7.8232 119.6122 64.5796 37.0363 178.4048 737 Q 4.0278 8.0862 118.9037 59.1219 28.6215 178.3761 738 Y 4.0477 8.3354 120.7002 60.5849 38.7117 178.0832 739 V 3.4865 7.9257 119.2517 65.9573 31.4179 177.9894 740 L 4.0440 8.0379 118.2736 57.2808 41.5345 178.4923 741 Q 3.8179 7.3042 114.2183 55.3090 29.1087 176.0546 742 Q 3.9606 6.7835 120.0416 56.1763 29.6035 175.0815 743 D 4.9388 8.0488 118.9441 52.8013 43.1686 177.4230 744 Q 4.1738 8.4854 117.1237 56.8717 28.3492 177.4448 745 F 4.0381 8.0937 122.1173 60.6527 39.9516 175.9767 746 T 4.2886 7.5403 110.5320 60.9265 70.1556 173.3581 747 N 4.7337 8.4739 119.0353 52.0451 38.5672 175.8134 748 K 3.9562 8.4349 116.7776 59.5778 33.0867 178.8791 749 E 3.9927 8.3094 120.0411 59.0426 29.5893 178.1196 750 M 4.0156 8.5336 118.9862 58.4202 32.1841 178.5609 751 V 3.5829 7.4040 118.1520 66.3652 31.6197 177.7449 752 D 4.3538 7.7573 117.9494 57.6068 40.8306 179.0028 753 I 4.4386 7.9023 121.6364 63.7616 37.0731 178.4241 754 K 3.9846 8.8196 121.0159 59.2837 31.8698 178.7903 755 Q 3.9121 7.9522 119.8079 59.3128 29.1419 178.0046 756 E 4.1230 8.0972 120.7244 58.5798 29.2962 179.6552 757 I 3.7598 7.6798 119.8094 64.2875 37.2262 178.1472 758 I 3.7152 7.6297 120.5431 64.6369 36.5738 178.2360 759 E 3.9238 8.8684 119.6118 59.9175 29.0713 179.7389 760 T 3.9898 7.8099 114.6044 66.5793 68.9235 176.7547 761 V 3.9954 8.4218 120.5377 65.6903 31.3084 177.8428 762 A 3.9910 8.5450 120.4063 55.4061 18.4278 179.2226 763 N 4.5063 8.0312 112.3779 55.2649 38.7326 175.6505 764 N 4.7464 7.6082 116.6245 51.9472 40.8371 176.2296 765 V 3.6065 8.1471 120.3046 66.4994 31.0509 178.0832 766 V 3.5561 7.5006 115.5640 65.9490 31.7509 177.1340 767 E 4.0968 7.9408 118.6044 59.4374 29.5824 178.1256 768 Y 4.4574 7.8251 116.8007 61.4766 37.6446 178.7907 769 S 4.5121 8.2584 115.7569 60.9630 62.6513 175.9000 770 K 5.5794 7.5632 119.7097 54.9052 32.6663 175.3594 771 H 4.6503 8.1583 121.5003 54.2065 31.2118 175.1153 772 K 2.0000 8.0275 127.9182 59.1251 31.6319 178.2328 773 F 4.4298 7.6092 116.4734 60.1337 39.4132 177.8580 774 A 3.9773 7.7318 119.6905 54.4584 18.0969 179.5153 775 S 4.1620 8.0940 113.3951 61.7610 63.0527 176.5438 776 N 4.3525 7.8470 119.7041 55.9992 38.2052 177.5528 777 V 3.6228 7.5043 119.3979 65.7507 31.6642 178.1402 778 V 3.6648 7.8115 118.1374 65.8240 31.3605 177.9173 779 E 3.9660 8.0569 118.1607 59.4393 29.2830 179.5308 780 K 4.0704 8.0320 118.1484 59.2628 32.0434 179.4425 781 S 4.2041 8.2296 115.9028 61.8576 62.6742 176.8933 782 I 3.8480 7.5347 113.5876 63.1588 37.5385 177.5838 783 L 3.9145 7.6140 121.9702 57.4518 42.0976 177.3572 784 Y 4.8541 8.1173 113.3030 56.8190 39.1544 176.4381 785 G 3.7927 7.6342 109.8171 44.7828 0.0000 174.2665 786 S 4.3893 9.3056 117.6530 57.2998 65.0693 175.5573 787 K 3.8206 8.6064 121.1376 60.4352 31.7993 178.4394 788 N 4.2461 8.0513 117.9163 56.3179 38.9443 176.4355 789 Q 4.0097 7.7761 119.5956 59.0637 28.7918 179.2587 790 K 3.9770 8.2950 120.5195 59.6605 32.1994 178.7546 791 D 4.3628 8.0755 119.0104 57.0654 40.4655 178.2496 792 L 3.9133 8.0766 120.6821 58.3464 42.3098 178.8835 793 I 3.9738 7.4458 119.5426 64.2169 37.1973 178.4344 794 I 3.8431 7.9769 120.7658 63.9897 37.1268 177.8740 795 S 4.3592 8.1981 113.3283 59.5900 62.7554 174.9606 796 K 4.2749 7.7268 119.8844 57.4551 32.4450 177.3951 797 I 4.3353 7.4724 117.6948 61.3263 39.2533 176.2231 798 L 4.0452 7.8810 120.7435 53.6789 41.5822 175.1061 799 P 4.3281 0.0000 0.0000 62.7157 31.7437 177.4703 800 R 3.6320 8.4455 121.1323 59.3317 30.3268 175.6156 801 D 4.6211 7.5777 115.0212 51.0554 41.9936 176.0115 802 K 3.9909 8.6404 117.6914 59.1053 31.6859 178.8669 803 N 4.3519 8.2005 117.0092 56.6571 39.0531 176.1513 804 H 4.0114 9.1959 116.8293 59.0385 29.0888 176.9869 805 A 4.1797 8.0216 122.1127 55.4871 18.0216 179.8224 806 L 4.2436 7.4081 114.9117 56.2921 42.8383 177.1216 807 N 4.8893 7.9033 116.5584 51.4054 38.6934 173.3006 808 L 4.4908 7.8537 121.2467 53.3318 43.7458 176.2317 809 E 4.5947 8.2272 119.5641 55.1291 31.0643 177.0618 810 D 4.6609 8.6465 119.5150 55.7094 40.7300 176.6368 811 D 4.9040 7.7279 117.2297 52.3217 40.7578 176.8936 812 S 4.2613 8.1005 116.8979 57.8177 64.8521 172.7357 813 P 4.1342 0.0000 0.0000 66.3334 31.1887 178.2069 814 M 3.9346 8.1203 116.4850 59.0041 31.8105 179.0504 815 I 3.6424 7.2688 119.0327 64.2375 37.0498 178.5204 816 L 3.9686 7.7581 118.9823 57.8072 41.6570 179.3457 817 M 4.1593 7.9764 118.6395 58.4720 31.8930 178.6010 818 I 3.5131 7.7783 118.7355 64.1353 37.2757 177.7580 819 K 4.1163 7.3928 116.6115 56.0457 33.0144 176.2201 820 D 4.7271 7.3777 120.3342 52.4660 42.5429 176.9787 821 Q 3.7703 8.4375 124.1636 59.1419 28.5489 178.3721 822 F 4.9322 7.6944 118.0304 59.4955 39.8048 177.9042 823 A 4.2894 8.5901 121.4618 54.4039 18.1367 179.0270 824 N 4.1788 7.9698 115.4119 56.4573 37.0248 177.1266 825 Y 4.1223 7.6993 118.6264 60.9227 37.9975 178.3766 826 V 3.8162 7.9428 118.6899 65.7236 31.6009 178.1743 827 I 3.6870 7.6800 119.8145 64.3789 36.8983 177.9206 828 Q 3.9891 8.1107 119.0343 59.1345 28.6147 179.2453 829 K 3.8962 8.4778 120.5689 59.7085 32.0492 178.6153 830 L 3.9543 7.9073 119.0183 57.6852 41.2970 179.3308 831 V 3.6032 7.6495 117.2191 66.3861 31.4124 177.6570 832 N 4.5096 7.6431 114.3098 56.2670 38.5798 177.1406 833 V 4.0297 7.3657 110.1121 60.5988 32.1652 176.3283 834 S 4.3780 7.2044 116.5989 57.8443 63.7138 174.5451 835 E 4.3365 8.6321 124.9821 55.3853 31.5396 177.4847 836 G 3.9414 8.6812 109.9167 48.3719 0.0000 175.4109 837 E 4.1458 8.1799 120.8760 58.3059 29.8136 178.7457 838 G 3.5908 7.9096 105.2767 47.4676 0.0000 175.2829 839 K 3.8068 8.4048 123.1537 59.1883 31.4887 178.0806 840 K 3.7992 7.8192 119.3390 59.9347 32.0384 178.7803 841 L 4.0879 7.4271 118.0846 57.6200 41.5990 179.6823 842 I 3.7250 7.8123 120.0865 64.1451 36.9489 178.5640 843 V 3.5615 7.7288 119.0095 66.2160 31.3854 178.0575 844 I 3.6819 7.4528 118.3596 64.3336 36.9092 178.2328 845 A 4.2597 7.7504 122.5175 54.6689 18.0870 179.8041 846 I 3.6697 7.6808 117.8647 64.6254 36.7904 178.6975 847 R 3.9449 8.3361 119.0303 59.3715 29.7774 178.8606 848 A 4.1659 8.2548 120.4774 55.5153 18.0327 179.0784 849 Y 4.0114 8.0163 117.8903 60.7261 38.7920 178.3607 850 L 3.9263 7.8229 120.3021 57.7308 41.7186 178.6774 851 D 4.2760 7.7431 118.2820 57.1999 40.6499 178.4408 852 K 3.7192 7.6943 119.7338 59.9307 31.9680 178.6009 853 L 3.8050 6.9368 117.3188 57.8058 41.9575 178.0823 854 N 4.3520 7.7507 116.4947 56.3414 38.9770 176.5969 855 K 4.0280 7.7885 119.8970 58.3408 32.9110 177.0547 856 S 4.3878 7.1731 113.1087 57.6891 63.9621 173.1685 857 N 4.6593 8.4561 121.1624 51.7474 40.0089 174.7634 *860 G 3.7286 8.2083 109.6319 44.8171 0.0000 172.0855 861 N 4.0465 8.4048 116.4333 53.9231 38.8915 174.3253 862 R 4.2387 8.3097 119.4664 58.1498 31.8671 177.7646 863 H 4.5439 8.0871 110.5285 56.5700 26.6845 175.6757 864 L 4.1097 7.2160 118.9429 54.9642 43.2970 178.1344 865 A 4.0769 8.5383 123.8652 55.0319 18.4516 180.4267 866 S 3.9395 7.8885 112.8170 61.4500 63.2372 176.7722 867 V 3.6235 7.6502 121.4399 65.5897 31.5441 177.3726 868 E 3.9973 8.3004 119.1915 59.0910 29.4761 178.8817 869 K 3.9488 8.2020 119.6348 59.5568 32.1849 178.9085 870 L 3.9972 7.8830 119.0341 57.8581 41.4929 178.7988 871 A 4.0393 8.6557 120.7807 55.3827 18.0352 179.4283 872 A 4.0863 7.8590 117.7242 55.2860 18.8319 179.7462 873 L 4.0931 7.5730 114.6868 56.8272 41.6433 179.5138 874 V 3.8263 7.2559 118.2289 65.5383 31.8096 175.4007 875 E 4.1409 7.9030 121.1327 56.7323 29.2841 176.6998 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 515 S 8.19 4.48 0.00 4.06 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 0.00 516 P 0.00 4.32 0.00 2.23 2.11 0.00 3.90 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.09 0.00 517 L 8.70 4.04 0.00 1.79 1.97 0.74 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 518 L 7.87 3.67 0.00 1.73 1.50 0.72 0.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 519 E 7.97 3.95 0.00 2.17 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.44 0.00 520 Q 8.28 4.12 0.00 2.07 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.09 6.93 0.00 0.00 0.00 0.00 0.00 2.34 2.34 0.00 521 L 7.46 4.07 0.00 1.79 1.73 0.39 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 522 R 7.64 3.85 0.00 2.00 2.04 0.00 2.76 0.00 0.00 3.10 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.60 0.00 523 N 7.60 4.69 0.00 2.84 2.84 0.00 0.00 6.81 7.49 0.00 0.00 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 S 7.99 4.40 0.00 3.83 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 525 S 7.65 4.17 0.00 3.89 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *532 S 8.24 4.31 0.00 3.88 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 0.00 533 N 7.93 4.63 0.00 2.70 2.79 0.00 0.00 7.16 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 0.00 534 M 8.20 4.58 0.00 2.01 1.82 0.00 0.00 0.00 0.00 0.00 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.48 0.00 535 S 9.31 4.95 0.00 3.91 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 0.00 536 L 8.52 4.03 0.00 1.72 1.79 0.83 0.50 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 0.00 537 K 7.46 4.16 0.00 1.82 1.95 0.00 1.59 0.00 0.00 1.71 0.00 0.00 2.99 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.45 1.41 7.81 538 D 8.21 4.55 0.00 2.81 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 0.00 539 I 7.39 4.27 1.11 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 1.31 0.77 0.32 0.00 0.00 540 F 8.51 4.42 0.00 3.01 3.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 541 G 8.31 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 542 H 8.67 5.03 0.00 3.23 3.51 0.00 5.64 0.00 0.00 0.00 0.00 6.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 543 S 8.74 4.09 0.00 3.92 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 0.00 544 L 7.96 3.98 0.00 1.73 1.68 0.96 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 545 E 8.23 4.12 0.00 2.13 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.40 2.42 0.00 546 F 8.39 3.86 0.00 3.47 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 0.00 547 C 8.60 4.39 0.00 3.18 3.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 548 K 7.94 4.39 0.00 1.82 1.91 0.00 1.70 0.00 0.00 1.66 0.00 0.00 3.02 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.61 1.67 7.81 549 D 7.01 4.93 0.00 2.77 2.48 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 0.00 550 Q 8.01 2.77 0.00 0.93 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.70 0.00 0.00 0.00 0.00 0.00 1.93 1.83 0.00 551 H 7.72 4.23 0.00 3.21 3.19 0.00 5.72 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 0.00 552 G 8.29 3.80 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 0.00 0.00 0.00 553 S 8.37 4.24 0.00 4.25 4.07 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 0.00 554 R 7.99 3.86 0.00 1.91 1.94 0.00 3.12 0.00 0.00 3.02 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.67 0.00 555 F 8.41 4.16 0.00 3.18 3.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 556 I 8.14 3.47 1.99 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.94 0.93 0.00 0.00 557 Q 8.14 3.93 0.00 2.14 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.09 6.96 0.00 0.00 0.00 0.00 0.00 2.49 2.55 0.00 558 R 7.73 3.89 0.00 1.98 1.92 0.00 3.06 0.00 0.00 3.14 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.59 0.00 559 E 7.78 3.72 0.00 1.58 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 1.47 1.65 0.00 560 L 7.61 3.80 0.00 1.48 1.38 0.35 0.30 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 0.00 561 A 6.96 2.58 0.71 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 0.00 0.00 562 T 6.97 4.38 4.13 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 1.06 0.00 0.00 563 S 7.68 4.36 0.00 3.80 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 0.00 564 P 0.00 4.41 0.00 2.25 2.16 0.00 3.84 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 2.05 2.01 0.00 565 A 8.65 3.99 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 0.00 566 S 8.02 4.10 0.00 3.88 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 0.00 567 E 8.11 4.10 0.00 2.00 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 2.41 2.39 0.00 568 K 7.98 4.14 0.00 1.99 2.03 0.00 1.65 0.00 0.00 1.73 0.00 0.00 3.11 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.39 1.58 7.81 569 E 8.63 4.04 0.00 2.20 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 2.34 2.49 0.00 570 V 7.76 3.74 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 1.31 0.00 0.00 1.05 0.00 0.00 571 I 7.79 3.88 2.33 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 1.73 1.33 1.12 0.00 0.00 572 F 8.57 3.57 0.00 2.58 3.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 573 N 8.60 4.41 0.00 2.76 2.91 0.00 0.00 7.06 7.64 0.00 0.00 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 E 7.48 4.08 0.00 2.14 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 2.09 1.92 0.00 575 I 7.19 4.19 1.78 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 1.65 0.19 0.89 0.00 0.00 576 R 7.23 3.26 0.00 1.41 1.09 0.00 2.56 0.00 0.00 3.06 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 1.43 0.00 577 D 7.86 4.43 0.00 2.57 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 0.00 578 D 7.57 4.91 0.00 2.70 2.60 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 0.00 579 A 7.77 3.95 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 0.00 580 I 7.78 3.75 1.92 0.00 0.00 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.92 0.95 0.00 0.00 581 E 8.18 4.10 0.00 2.04 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 2.39 2.42 0.00 582 L 8.11 4.05 0.00 1.92 1.77 0.96 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 0.00 583 S 8.62 4.20 0.00 4.10 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 584 N 7.83 4.64 0.00 2.92 2.91 0.00 0.00 6.94 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 585 D 7.65 4.63 0.00 2.85 2.61 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 0.00 0.00 0.00 586 V 7.87 2.00 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 -0.57 0.00 0.00 0.17 0.00 0.00 587 F 8.90 5.28 0.00 3.19 3.05 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 0.00 0.00 0.00 588 G 8.34 3.68 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 0.00 589 N 7.90 4.55 0.00 2.93 3.21 0.00 0.00 6.81 8.59 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 0.00 590 Y 7.41 4.20 0.00 3.09 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 0.00 591 V 7.66 3.78 2.40 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 1.07 0.00 0.00 1.09 0.00 0.00 592 I 7.93 4.13 2.19 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.29 1.20 0.00 0.00 593 Q 8.27 4.33 0.00 2.46 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.80 0.00 0.00 0.00 0.00 0.00 2.50 2.76 0.00 594 K 8.37 4.14 0.00 1.87 1.88 0.00 1.94 0.00 0.00 2.02 0.00 0.00 3.07 0.00 0.00 3.33 0.00 0.00 0.00 0.00 1.75 1.67 7.81 595 F 8.06 4.29 0.00 3.31 2.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 596 F 7.95 4.25 0.00 3.15 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 0.00 597 E 7.75 2.79 0.00 1.38 1.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.63 0.00 598 F 8.17 4.69 0.00 2.94 2.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 599 G 7.98 4.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 600 S 8.43 4.48 0.00 4.03 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 601 K 8.55 3.74 0.00 1.83 1.86 0.00 1.75 0.00 0.00 1.82 0.00 0.00 2.94 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.52 1.58 7.81 602 I 7.79 3.65 1.76 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 1.59 1.45 0.85 0.00 0.00 603 Q 7.44 3.27 0.00 1.76 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.80 0.00 0.00 0.00 0.00 0.00 1.16 1.74 0.00 604 K 8.24 3.67 0.00 1.89 2.01 0.00 1.90 0.00 0.00 2.04 0.00 0.00 3.15 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.37 1.59 7.81 605 N 8.61 4.34 0.00 2.79 2.87 0.00 0.00 7.10 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 606 T 7.44 3.87 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 1.29 0.00 0.00 607 L 7.70 3.81 0.00 1.50 1.18 0.31 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 608 V 7.76 3.49 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 1.19 0.00 0.00 609 D 8.03 4.55 0.00 2.79 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 0.00 610 Q 7.55 4.25 0.00 2.02 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.90 0.00 0.00 0.00 0.00 0.00 2.34 2.45 0.00 611 F 8.31 4.99 0.00 3.19 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 0.00 612 K 7.83 4.17 0.00 1.78 1.82 0.00 1.79 0.00 0.00 1.79 0.00 0.00 3.23 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.50 1.69 7.81 613 G 9.56 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 0.00 614 N 8.58 4.99 0.00 2.87 2.79 0.00 0.00 6.90 7.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 615 M 8.39 3.92 0.00 2.02 2.33 0.00 0.00 0.00 0.00 0.00 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.82 2.73 0.00 616 K 7.95 3.81 0.00 1.78 1.77 0.00 1.69 0.00 0.00 1.71 0.00 0.00 2.89 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.47 1.46 7.81 617 Q 7.91 3.90 0.00 2.06 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.83 0.00 0.00 0.00 0.00 0.00 2.31 2.42 0.00 618 L 7.80 4.30 0.00 1.66 1.46 0.59 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 619 S 8.21 4.11 0.00 3.89 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 0.00 620 L 7.39 4.34 0.00 1.59 1.65 0.88 0.74 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 0.00 621 Q 7.22 4.15 0.00 2.21 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.87 6.80 0.00 0.00 0.00 0.00 0.00 2.31 2.45 0.00 622 M 8.28 4.08 0.00 1.21 1.73 0.00 0.00 0.00 0.00 0.00 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.25 1.74 0.00 623 Y 7.27 4.55 0.00 3.09 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 0.00 624 A 8.21 4.27 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 0.00 625 C 7.88 3.96 0.00 3.07 3.33 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 0.00 626 R 7.91 3.84 0.00 1.90 1.96 0.00 3.24 0.00 0.00 3.01 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.76 0.00 627 V 7.51 3.65 2.21 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 1.43 0.00 0.00 1.04 0.00 0.00 628 I 7.78 3.46 1.87 0.00 0.00 0.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.41 0.78 0.00 0.00 629 Q 7.96 3.92 0.00 2.17 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.12 6.98 0.00 0.00 0.00 0.00 0.00 2.33 2.39 0.00 630 K 8.08 4.14 0.00 2.06 1.98 0.00 1.87 0.00 0.00 1.91 0.00 0.00 3.33 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.55 1.69 7.81 631 A 7.87 3.19 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 632 L 7.50 3.85 0.00 1.56 1.68 0.85 0.97 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 0.00 633 E 7.63 3.91 0.00 2.20 1.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 2.26 0.00 634 Y 7.88 4.48 0.00 3.01 3.14 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 0.00 0.00 0.00 0.00 635 I 7.52 4.33 2.14 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 1.69 0.57 1.12 0.00 0.00 636 D 8.40 4.68 0.00 2.91 2.86 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 0.00 637 S 8.80 4.13 0.00 4.07 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 0.00 638 N 8.16 4.38 0.00 2.89 2.92 0.00 0.00 7.16 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 0.00 639 Q 8.81 4.09 0.00 2.34 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.79 0.00 0.00 0.00 0.00 0.00 2.42 2.50 0.00 640 R 7.94 3.90 0.00 2.10 1.97 0.00 3.11 0.00 0.00 3.05 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.64 0.00 641 I 7.55 3.71 1.91 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.54 0.99 0.00 0.00 642 E 7.96 3.93 0.00 2.24 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 0.00 2.34 2.37 0.00 643 L 8.01 4.15 0.00 1.94 1.72 1.06 0.72 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 0.00 644 V 8.12 3.65 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 1.26 0.00 0.00 1.01 0.00 0.00 645 L 8.33 3.76 0.00 1.92 1.60 0.98 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 646 E 7.87 4.19 0.00 2.07 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.32 0.00 647 L 7.81 4.55 0.00 1.77 1.66 0.90 0.60 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 0.00 648 S 7.52 3.68 0.00 3.31 3.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 649 D 7.91 4.89 0.00 2.61 2.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 650 S 8.23 4.66 0.00 3.80 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 0.00 651 V 8.06 3.55 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 1.16 0.00 0.00 1.14 0.00 0.00 652 L 7.91 3.90 0.00 1.66 1.64 0.62 0.57 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 0.00 653 Q 7.99 3.95 0.00 2.01 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 7.06 0.00 0.00 0.00 0.00 0.00 2.31 2.43 0.00 654 M 8.47 4.17 0.00 1.97 2.20 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 2.60 2.88 0.00 655 I 7.82 3.73 1.84 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 1.48 0.71 0.91 0.00 0.00 656 K 7.65 4.30 0.00 1.68 1.86 0.00 1.66 0.00 0.00 1.58 0.00 0.00 2.94 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.30 1.53 7.81 657 D 7.31 4.54 0.00 2.79 2.63 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 0.00 0.00 0.00 0.00 658 Q 8.80 3.59 0.00 2.12 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.64 0.00 0.00 0.00 0.00 0.00 2.27 2.49 0.00 659 N 8.64 4.70 0.00 2.82 2.75 0.00 0.00 6.77 7.60 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 0.00 660 G 8.09 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 661 N 7.77 4.31 0.00 2.87 3.06 0.00 0.00 6.83 7.60 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 0.00 662 H 7.72 4.13 0.00 3.24 3.48 0.00 5.62 0.00 0.00 0.00 0.00 6.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 663 V 7.50 3.49 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 0.96 0.00 0.00 0.90 0.00 0.00 664 I 7.62 3.60 1.96 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 1.72 0.66 0.84 0.00 0.00 665 Q 7.92 3.83 0.00 2.16 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.23 6.79 0.00 0.00 0.00 0.00 0.00 2.26 2.37 0.00 666 K 8.17 3.75 0.00 1.87 1.90 0.00 1.44 0.00 0.00 1.55 0.00 0.00 2.99 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.47 1.42 7.81 667 A 8.30 3.90 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 0.00 668 I 7.54 3.48 1.73 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.55 0.59 0.00 0.00 669 E 7.67 2.98 0.00 1.86 1.80 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 2.05 1.96 0.00 670 T 7.52 4.33 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 1.17 0.00 0.00 671 I 6.94 4.50 1.91 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 1.28 0.63 0.90 0.00 0.00 672 P 0.00 4.32 0.00 2.18 2.00 0.00 3.61 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 2.12 2.09 0.00 673 I 8.69 3.40 1.89 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 1.82 0.99 0.93 0.00 0.00 674 E 8.25 4.14 0.00 2.16 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 0.00 2.29 2.42 0.00 675 K 8.49 4.34 0.00 1.81 1.92 0.00 1.65 0.00 0.00 1.72 0.00 0.00 3.06 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.47 1.48 7.81 676 L 7.96 4.22 0.00 1.48 1.03 0.81 0.92 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 0.00 677 P 0.00 4.23 0.00 2.20 2.10 0.00 3.71 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 2.27 0.00 678 F 7.46 4.74 0.00 3.18 3.19 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 0.00 679 I 6.99 3.83 1.73 0.00 0.00 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.45 0.82 0.00 0.00 680 L 7.61 3.97 0.00 1.71 1.64 0.92 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 681 S 8.02 4.43 0.00 4.15 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 0.00 682 S 7.77 4.44 0.00 4.11 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 0.00 683 L 8.24 4.46 0.00 1.85 1.73 0.96 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 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4.14 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 0.00 0.00 0.00 0.90 0.00 0.00 693 H 6.96 4.41 0.00 2.91 3.14 0.00 5.68 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 694 S 7.19 2.79 0.00 2.84 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 0.00 695 Y 6.94 4.59 0.00 3.12 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 0.00 696 G 8.46 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 0.00 0.00 0.00 0.00 697 C 7.78 4.18 0.00 3.12 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 0.00 698 R 7.76 3.76 0.00 1.92 2.06 0.00 3.19 0.00 0.00 3.13 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.54 0.00 699 V 7.52 3.50 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 0.80 0.00 0.00 0.86 0.00 0.00 700 I 7.76 3.64 1.97 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 1.75 0.66 0.92 0.00 0.00 701 Q 8.19 3.62 0.00 2.10 1.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.83 0.00 0.00 0.00 0.00 0.00 2.19 2.50 0.00 702 R 7.89 4.01 0.00 1.90 1.88 0.00 3.20 0.00 0.00 3.40 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.70 0.00 703 L 8.44 3.99 0.00 1.75 1.71 0.89 0.53 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 0.00 704 L 7.86 4.04 0.00 1.76 1.98 1.07 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 705 E 7.83 4.53 0.00 2.02 2.21 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 1.87 2.16 0.00 706 F 8.41 4.60 0.00 3.07 3.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 707 G 7.60 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 0.00 708 S 8.53 4.36 0.00 4.20 4.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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0.00 3.41 3.14 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 0.00 0.00 0.00 0.00 726 L 8.37 4.09 0.00 1.94 1.80 1.18 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 727 I 7.94 3.57 1.51 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 1.40 0.63 0.20 0.00 0.00 728 Q 7.43 4.18 0.00 2.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.05 6.90 0.00 0.00 0.00 0.00 0.00 1.96 2.16 0.00 729 D 7.21 4.38 0.00 2.78 2.40 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 0.00 730 Q 7.68 2.52 0.00 1.19 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.12 6.59 0.00 0.00 0.00 0.00 0.00 1.61 1.16 0.00 731 Y 7.37 4.94 0.00 2.93 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 0.00 732 G 8.10 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 0.00 733 N 7.81 4.38 0.00 2.77 3.10 0.00 0.00 6.93 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0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 775 S 8.09 4.16 0.00 4.17 4.41 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 0.00 776 N 7.85 4.35 0.00 2.78 2.83 0.00 0.00 6.58 7.34 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 0.00 777 V 7.50 3.62 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 0.98 0.00 0.00 0.82 0.00 0.00 778 V 7.81 3.66 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 1.03 0.00 0.00 1.09 0.00 0.00 779 E 8.06 3.97 0.00 2.20 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 2.37 2.62 0.00 780 K 8.03 4.07 0.00 1.88 2.05 0.00 2.00 0.00 0.00 1.84 0.00 0.00 3.17 0.00 0.00 3.18 0.00 0.00 0.00 0.00 1.69 1.83 7.81 781 S 8.23 4.20 0.00 4.11 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 782 I 7.53 3.85 1.86 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 1.70 0.49 0.92 0.00 0.00 783 L 7.61 3.91 0.00 1.49 1.53 0.61 0.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 784 Y 8.12 4.85 0.00 3.07 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 0.00 785 G 7.63 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 786 S 9.31 4.39 0.00 4.02 4.05 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 0.00 0.00 0.00 787 K 8.61 3.82 0.00 2.05 2.14 0.00 1.40 0.00 0.00 1.75 0.00 0.00 2.99 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.51 1.59 7.81 788 N 8.05 4.25 0.00 2.78 2.85 0.00 0.00 7.11 7.12 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 0.00 789 Q 7.78 4.01 0.00 2.18 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.23 6.59 0.00 0.00 0.00 0.00 0.00 2.50 2.39 0.00 790 K 8.29 3.98 0.00 1.88 2.02 0.00 1.62 0.00 0.00 1.63 0.00 0.00 3.16 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.43 1.47 7.81 791 D 8.08 4.36 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 0.00 792 L 8.08 3.91 0.00 1.69 1.94 0.92 0.96 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 0.00 793 I 7.45 3.97 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 1.54 0.97 0.93 0.00 0.00 794 I 7.98 3.84 1.87 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 1.35 0.82 0.90 0.00 0.00 795 S 8.20 4.36 0.00 3.95 4.07 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 0.00 796 K 7.73 4.27 0.00 1.88 1.88 0.00 1.64 0.00 0.00 1.68 0.00 0.00 2.95 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.63 1.66 7.81 797 I 7.47 4.34 1.86 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 1.28 0.58 0.89 0.00 0.00 798 L 7.88 4.05 0.00 1.70 1.61 0.91 1.01 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 0.00 799 P 0.00 4.33 0.00 2.23 2.20 0.00 3.70 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 2.07 2.00 0.00 800 R 8.45 3.63 0.00 1.50 1.96 0.00 3.03 0.00 0.00 3.19 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.46 0.00 801 D 7.58 4.62 0.00 2.85 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 0.00 802 K 8.64 3.99 0.00 1.79 1.92 0.00 1.68 0.00 0.00 1.75 0.00 0.00 2.92 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.54 1.46 7.81 803 N 8.20 4.35 0.00 2.87 2.76 0.00 0.00 7.21 7.89 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 0.00 804 H 9.20 4.01 0.00 3.22 3.40 0.00 5.92 0.00 0.00 0.00 0.00 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 805 A 8.02 4.18 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 0.00 806 L 7.41 4.24 0.00 1.78 1.75 0.92 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 807 N 7.90 4.89 0.00 2.61 2.65 0.00 0.00 7.22 7.18 0.00 0.00 0.00 0.00 0.00 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0.00 2.83 3.02 0.00 0.00 6.89 6.88 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 0.00 825 Y 7.70 4.12 0.00 3.27 3.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 826 V 7.94 3.82 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 1.11 0.00 0.00 1.02 0.00 0.00 827 I 7.68 3.69 1.99 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.65 0.87 0.00 0.00 828 Q 8.11 3.99 0.00 2.29 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.23 6.76 0.00 0.00 0.00 0.00 0.00 2.36 2.63 0.00 829 K 8.48 3.90 0.00 2.04 2.00 0.00 1.52 0.00 0.00 1.79 0.00 0.00 2.98 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.43 1.52 7.81 830 L 7.91 3.95 0.00 1.95 1.70 0.92 0.69 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 0.00 831 V 7.65 3.60 2.32 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 0.83 0.00 0.00 0.98 0.00 0.00 832 N 7.64 4.51 0.00 2.85 2.85 0.00 0.00 7.12 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0.00 0.00 0.00 849 Y 8.02 4.01 0.00 3.10 3.15 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 0.00 850 L 7.82 3.93 0.00 1.81 1.67 0.95 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 851 D 7.74 4.28 0.00 2.81 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 0.00 852 K 7.69 3.72 0.00 1.71 1.66 0.00 1.60 0.00 0.00 1.55 0.00 0.00 2.89 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.32 1.41 7.81 853 L 6.94 3.80 0.00 1.17 1.39 0.81 0.88 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 0.00 854 N 7.75 4.35 0.00 3.04 2.81 0.00 0.00 7.19 6.17 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 0.00 855 K 7.79 4.03 0.00 1.76 1.76 0.00 1.82 0.00 0.00 1.73 0.00 0.00 3.05 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.42 1.41 7.81 856 S 7.17 4.39 0.00 3.93 3.81 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 0.00 857 N 8.46 4.66 0.00 2.71 2.75 0.00 0.00 6.95 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 *860 G 8.21 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 0.00 861 N 8.40 4.05 0.00 2.73 2.64 0.00 0.00 6.84 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 0.00 862 R 8.31 4.24 0.00 1.78 1.90 0.00 3.27 0.00 0.00 3.34 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.64 0.00 863 H 8.09 4.54 0.00 3.28 3.37 0.00 5.91 0.00 0.00 0.00 0.00 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 864 L 7.22 4.11 0.00 1.67 1.57 0.91 0.67 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 0.00 865 A 8.54 4.08 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 0.00 866 S 7.89 3.94 0.00 3.93 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 0.00 867 V 7.65 3.62 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 0.93 0.00 0.00 1.03 0.00 0.00 868 E 8.30 4.00 0.00 2.23 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 2.38 0.00 869 K 8.20 3.95 0.00 2.10 1.74 0.00 1.60 0.00 0.00 1.67 0.00 0.00 3.08 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.52 1.60 7.81 870 L 7.88 4.00 0.00 1.89 1.70 0.87 0.83 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 0.00 871 A 8.66 4.04 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 872 A 7.86 4.09 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 0.00 873 L 7.57 4.09 0.00 1.72 1.75 0.94 0.97 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 0.00 874 V 7.26 3.83 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 0.84 0.00 0.00 1.00 0.00 0.00 875 E 7.90 4.14 0.00 2.16 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 2.35 2.47 0.00 * Residues marked with a * may have inaccurate shift predictions.