NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 579 D 4.4989 8.3649 120.1922 54.7647 42.1745 174.9406 580 D 4.3951 9.0791 129.4916 55.9165 40.2256 173.2475 581 E 4.0626 8.1037 118.0481 59.1590 30.9791 178.5184 582 Y 4.3026 8.2537 119.3360 60.8976 39.0435 177.0676 583 T 3.5885 7.8784 116.2924 66.7133 68.3946 175.8485 584 K 3.8866 7.6201 120.3363 59.5328 32.1892 178.8469 585 L 3.9508 7.4503 118.0369 57.5884 41.2872 179.5795 586 L 3.8367 7.6955 118.1836 58.1343 41.7101 178.3259 587 H 4.0395 8.0007 116.8769 59.3978 29.6188 176.3142 588 D 4.5525 7.5762 118.9732 55.5750 41.3986 178.0704 589 G 4.0370 7.5375 103.3620 44.7133 0.0000 172.9799 590 I 3.8995 7.9644 119.8647 61.0223 37.5926 176.3876 591 Q 4.2749 8.4301 124.6605 54.4591 29.7937 174.0614 592 P 4.3648 0.0000 0.0000 62.2234 32.6805 177.1779 593 V 2.9527 8.5321 121.7109 66.1911 31.3213 177.5622 594 A 4.1728 7.8493 118.1221 53.2626 18.3534 177.5012 595 A 4.4022 7.9704 118.7236 53.2239 19.8487 179.2937 596 I 3.8743 7.5921 116.7222 63.8120 37.4988 176.1024 597 D 4.5865 7.4829 115.9114 53.3085 43.6322 176.3754 598 S 4.2579 8.9504 121.7541 60.7471 63.1228 174.4744 599 N 4.8629 7.8560 117.0421 52.8862 39.0729 175.5935 600 F 2.6919 7.9683 120.2265 60.8200 39.3332 175.6465 601 A 4.7015 7.9847 120.2755 51.6676 19.3798 175.7690 602 S 4.6090 7.9937 113.2965 57.1065 63.9476 175.4539 603 F 4.5985 8.4449 124.8080 60.4203 38.8396 176.6030 604 T 4.1997 7.9682 109.1744 63.1227 69.1898 174.1687 605 Y 4.2216 7.9569 124.6716 57.4096 39.5049 175.0250 606 T 4.1959 7.3654 117.3351 58.7996 68.8247 172.8158 607 P 4.1400 0.0000 0.0000 65.9477 31.1582 178.8737 608 R 3.9849 7.8320 116.4661 58.1827 30.0003 177.0893 609 S 4.4629 7.6385 111.3064 58.0128 63.6116 174.1554 610 L 4.2594 7.7899 124.4174 53.9998 42.7048 174.7555 611 P 4.3772 0.0000 0.0000 62.4404 32.2697 177.0973 612 E 3.9495 8.8414 122.1442 59.5463 29.3025 178.8449 613 D 4.5070 8.0970 117.1719 56.1984 41.1915 176.9736 614 D 4.7986 7.8296 118.6729 54.4791 41.2613 178.1706 615 T 3.6659 7.6915 112.0135 64.3577 68.8746 177.0176 616 S 4.2370 8.0710 117.9278 61.8480 62.9800 176.4239 617 M 4.2178 8.1183 118.5947 58.0569 31.0284 178.1310 618 A 4.0817 7.9706 121.9649 54.8754 18.5920 179.6023 619 I 4.1077 8.2383 118.6500 64.7532 37.2931 178.5907 620 L 4.1231 8.0968 119.6874 58.0424 41.3902 179.7879 621 S 4.1087 8.3424 115.1863 61.7121 62.7031 176.7246 622 M 3.6927 8.0843 121.3425 58.3699 31.7103 178.8377 623 L 3.9661 7.8930 119.0626 57.5654 41.6653 179.5505 624 Q 3.8491 8.1323 119.6333 59.2835 28.9191 177.6603 625 D 4.4564 8.1463 117.7305 57.1014 41.3056 177.1096 626 M 3.8060 7.7523 116.7402 54.7389 32.3064 176.4682 627 N 4.3084 8.1169 116.7058 54.0753 37.1361 176.2285 628 F 4.3528 7.4454 120.0258 60.3440 38.7592 177.8633 629 I 3.8065 7.6620 119.4506 64.4447 37.1749 178.0128 630 N 4.4010 8.0101 117.4444 56.0735 37.1470 176.8699 631 N 4.1961 7.9605 117.8709 55.6697 38.5159 175.3535 632 Y 4.5812 8.0694 113.8391 56.7010 38.5207 175.6808 633 K 3.7691 7.7694 118.5850 57.3734 30.2966 175.5726 634 I 4.1096 7.8709 118.4566 60.6313 38.2783 176.8945 635 D 4.4619 8.7470 124.7631 54.7432 42.1934 176.8207 636 C 4.2551 8.7511 124.8202 62.2775 28.4136 173.9961 637 P 4.4403 0.0000 0.0000 66.2068 30.9205 178.6458 638 T 4.0590 8.0857 113.8084 66.5465 68.2780 176.4386 639 L 3.9985 8.1342 122.0558 57.9608 42.0169 178.7744 640 A 4.1006 8.4456 120.9970 55.5188 18.4270 179.7994 641 R 3.6974 8.1511 116.4266 59.2616 30.0397 179.1881 642 F 3.9826 8.4288 120.4800 61.4818 39.4882 176.8593 643 C 4.1755 8.6519 118.5006 62.3424 31.3408 175.5062 644 L 3.8316 8.2175 121.1871 57.7429 40.9173 179.1271 645 M 3.8638 7.6069 117.4487 58.5357 32.4672 178.4431 646 V 3.5485 7.4047 112.7053 64.1219 31.5540 178.4578 647 K 3.1748 7.2496 118.9200 58.9794 31.6002 178.6294 648 K 4.0654 7.7215 118.6673 58.3490 32.2061 178.1126 649 G 3.7380 7.6619 104.0082 44.8654 0.0000 173.5031 650 Y 4.1218 7.1872 119.3128 57.4565 38.6617 175.9062 651 R 4.3687 8.3774 122.7200 55.9260 31.9183 175.6382 652 D 5.0263 8.2063 115.1996 53.0096 40.9296 172.7432 653 P 4.6951 0.0000 0.0000 61.4034 33.0436 175.7690 654 P 4.2274 0.0000 0.0000 65.1555 31.3914 176.2083 655 Y 4.5687 7.7631 115.2749 59.5839 40.8814 176.2335 656 H 4.1789 8.4913 117.1909 54.6893 27.5024 172.8105 657 N 5.2768 7.0954 118.6421 50.0632 41.0158 175.6934 658 W 3.4564 8.7012 126.0707 60.9209 30.5835 177.4435 659 M 3.6311 8.0538 118.0513 58.7021 31.3346 177.9328 660 H 3.8304 8.4220 117.8930 59.2607 29.9207 177.1183 661 A 3.6058 7.2008 122.2789 54.8411 18.0081 179.2441 662 F 3.4639 7.5292 120.4337 61.2591 39.3477 177.5859 663 S 3.7248 7.8940 113.7650 60.9829 62.7781 176.7212 664 V 3.5111 7.4863 121.9965 65.8194 31.2766 178.0105 665 S 3.8269 7.8750 115.1421 61.9383 62.6674 176.1773 666 H 4.1125 7.9908 120.9447 59.3373 29.4382 176.9868 667 F 4.1338 8.4824 122.4549 61.2104 39.2004 176.5219 668 C 4.1535 8.3716 118.5453 62.7582 31.3494 174.8758 669 Y 4.2639 8.3016 120.9642 60.9768 38.2994 178.2117 670 L 3.6514 7.8313 119.7031 57.5910 41.5544 179.5915 671 L 3.8420 7.7418 119.1105 57.5665 41.0437 178.6287 672 Y 3.9073 8.0044 119.5340 60.8227 38.5003 178.6466 673 K 3.7178 7.9332 118.0755 59.0882 32.2065 178.5060 674 N 4.4986 7.9488 115.0007 54.0318 39.1492 176.4409 675 L 4.3289 7.6621 117.8436 52.8626 43.8489 175.8316 676 E 3.6490 7.5457 117.7667 56.1946 26.3973 175.1896 677 L 4.1146 7.1036 119.9150 57.2910 42.4993 179.6431 678 T 4.3081 7.6273 107.4068 63.5050 68.8726 174.6811 679 N 4.6475 7.8736 118.8145 54.1526 39.1063 175.0907 680 Y 4.7762 8.6686 115.4441 58.2361 40.2363 175.5434 681 L 5.1325 7.8201 116.5244 52.2559 45.5144 176.2985 682 E 4.4289 8.8728 119.4340 56.0546 31.3614 178.2183 683 D 4.6495 8.6909 120.8936 57.8166 41.0101 178.9289 684 I 3.9751 7.9177 119.9715 63.5981 37.9980 177.6027 685 E 4.0659 8.3117 118.9711 59.4636 29.3899 179.2215 686 I 3.9107 8.0582 119.8217 64.4084 37.2021 178.0320 687 F 4.0354 8.5515 121.6192 61.4695 39.0111 177.0097 688 A 3.8508 8.2277 120.1749 54.9534 18.0847 179.3824 689 L 3.9474 8.1027 118.8851 58.3065 42.3081 179.0750 690 F 4.1923 8.5573 120.6576 61.5130 39.1796 177.2812 691 I 3.9366 8.0068 118.4967 64.3746 36.7705 178.2520 692 S 4.3733 8.4623 116.4712 61.7431 62.6247 176.3104 693 C 4.0998 8.1705 119.4643 63.3471 27.6676 176.2441 694 M 4.2013 7.6368 118.2971 57.8916 32.0268 177.6609 695 C 4.7967 8.1042 115.0646 60.0356 28.9699 175.1408 696 H 4.4756 8.0581 114.5018 57.4028 28.7425 175.8141 697 D 4.9010 8.0023 120.3007 53.9720 41.2737 178.0394 698 L 3.1315 7.7180 122.0847 56.9065 41.5641 177.5630 699 D 4.8248 7.8991 116.9733 53.6811 41.6641 175.0992 700 H 4.3549 8.0628 117.6618 55.9001 30.3212 174.6816 701 R 4.1832 9.1176 126.3117 56.2988 31.1543 177.8047 702 G 3.7653 7.9671 103.4674 45.9128 0.0000 173.5838 703 T 3.9840 7.6003 116.0646 63.1436 67.5434 174.5002 704 N 4.6904 8.3700 125.6165 51.9136 37.3461 174.7423 705 N 4.8609 8.1125 121.2102 52.2928 40.0439 174.4047 706 S 4.2025 7.4751 110.3386 55.9905 65.7976 173.9023 707 F 5.1413 8.1160 121.4318 57.4165 39.1797 177.9107 708 Q 4.0125 7.7114 119.2403 59.1272 28.8749 178.4536 709 V 3.7596 7.7582 118.4702 65.7278 31.5941 177.3796 710 A 4.1802 8.1985 120.4149 55.5415 17.9234 179.4564 711 S 4.2089 8.0876 111.0365 60.8340 62.7992 175.3889 712 K 4.3021 7.9676 120.9704 57.6475 33.7780 177.3953 713 S 4.4493 7.6366 110.1362 56.1104 65.5761 175.3313 714 V 3.4969 8.3728 129.2027 66.1537 31.5123 177.6112 715 L 3.3744 7.8081 119.2907 57.8207 41.7889 178.4704 716 A 4.0568 8.0328 120.4449 55.2273 18.1467 179.2756 717 A 3.9087 7.6132 117.6305 55.3545 18.3626 179.4568 718 L 4.0429 6.8666 116.2680 57.7802 41.5871 178.7504 719 Y 4.2203 7.6515 116.7731 59.9528 37.8517 176.6043 720 S 4.2576 7.7034 113.5282 58.5613 62.7429 173.9886 721 S 4.6334 8.5580 121.6502 58.2111 63.7401 172.8783 722 E 4.7104 9.8260 120.3701 54.3678 32.0652 176.1286 723 G 4.5866 8.1981 118.6375 46.6363 0.0000 174.0813 724 S 4.5179 8.1109 114.7517 58.8222 64.0356 175.2688 725 V 4.0918 7.9745 119.1446 63.1642 32.7628 175.5959 726 M 4.4984 7.4991 120.9093 52.2881 33.6526 175.1191 727 E 4.2636 8.6358 124.2679 56.2066 30.3851 175.9706 728 R 4.6854 8.3003 123.6369 54.8901 33.9393 174.5936 729 H 5.0812 8.8739 114.8229 55.7570 29.8636 176.9848 730 H 4.1312 8.4376 117.8872 59.0825 28.6591 176.5509 731 F 4.2645 8.4233 121.4244 61.5944 39.3372 176.7444 732 A 3.6783 8.1604 119.6516 55.1050 18.0361 179.2193 733 Q 3.8093 7.9944 117.7300 58.9597 29.0587 177.9549 734 A 3.9187 7.8893 122.1383 55.1459 18.5212 179.5416 735 I 3.6526 7.4856 110.6469 63.2737 37.5322 178.1923 736 A 3.9540 7.5233 122.5424 54.9199 18.3722 179.4608 737 I 3.7315 7.5826 119.7207 64.1027 37.0293 178.2724 738 L 4.0365 7.7524 118.5158 57.9367 41.5363 178.6074 739 N 4.7841 7.7903 112.9213 52.3880 39.2225 175.1576 740 T 4.0838 7.7779 119.8951 62.8357 69.2397 173.6879 741 H 3.8016 8.8030 125.2521 58.3538 29.9757 174.9034 742 G 3.7975 8.9488 113.7806 45.9620 0.0000 173.1175 743 C 4.7769 7.7332 113.1827 58.9706 29.9572 174.8844 744 N 4.6073 7.7614 120.6655 52.3891 36.7873 175.0265 745 I 3.8629 7.3637 114.7129 61.8980 38.5755 177.4572 746 F 4.2064 7.3416 118.7563 57.1204 38.9971 176.8912 747 D 4.3183 7.8490 123.0117 57.3306 40.8978 177.0031 748 H 4.7633 8.2172 112.8676 55.5621 29.5764 175.2980 749 F 4.4657 8.3291 118.9623 57.3699 39.4723 176.0028 750 S 4.4227 8.6071 118.8945 58.0020 64.9110 175.1792 751 R 3.9426 8.6958 122.6798 60.0322 29.6570 178.7184 752 K 4.0546 8.0931 117.2773 59.7489 32.1586 178.9865 753 D 4.4455 7.9793 117.7738 57.0986 40.6457 177.9627 754 Y 4.0770 8.6762 120.7386 61.0401 38.7420 178.1525 755 Q 4.0478 8.4115 118.6959 59.1354 28.7987 179.2351 756 R 3.8638 8.1597 119.4278 59.5959 30.1715 178.1673 757 M 3.8600 8.4635 118.2486 58.5518 32.0833 178.1295 758 L 4.1186 7.8489 119.1199 58.0847 41.8588 179.2170 759 D 4.2445 8.3844 119.0968 57.4036 40.6223 179.0268 760 L 4.0159 8.2362 119.7898 57.8192 41.6431 179.4014 761 M 4.1263 8.0212 119.9947 57.8355 31.9883 178.6590 762 R 3.1551 7.6120 118.8791 59.3641 30.0789 178.3430 763 D 4.2789 7.6968 118.0769 57.4147 40.6237 178.8884 764 I 3.8068 7.8223 119.6204 64.0952 37.3971 178.2882 765 I 3.8836 8.3235 121.1005 64.4042 36.6239 178.0562 766 L 3.9527 7.8727 119.6011 58.1441 41.3583 179.4840 767 A 3.9255 7.6415 117.7161 54.2366 18.3118 179.2681 768 T 4.0476 7.6901 114.2778 65.1554 68.7738 174.6128 769 D 4.6627 7.3804 119.4279 53.8164 41.6101 177.1770 770 L 4.0833 8.9230 127.0233 57.5731 41.6686 179.3972 771 A 4.0158 8.6539 121.4001 55.1844 18.2865 179.1630 772 H 4.1321 8.4743 117.2421 59.6372 29.8915 176.9937 773 H 4.2656 8.2092 119.6495 59.3839 29.5637 177.1298 774 L 3.9859 8.0634 119.9818 57.6482 41.4663 179.2781 775 R 4.0977 7.7843 117.3866 58.6864 30.3726 178.1584 776 I 4.1857 7.6127 110.4093 60.6961 37.9930 176.9943 777 F 4.0831 7.7714 123.9003 61.9882 39.0375 177.2336 778 K 4.1086 7.9817 118.4396 59.0468 31.8762 178.9237 779 D 4.3155 8.0296 118.6739 57.2302 40.7560 178.7402 780 L 3.8994 7.8547 119.4903 57.7300 41.7425 179.2325 781 Q 3.7543 7.8431 118.3492 58.9771 28.6112 179.3080 782 K 3.9728 8.1344 120.5007 59.6340 32.2552 178.3435 783 M 3.8887 8.1566 118.3500 58.7610 31.8756 178.1279 784 A 3.9811 7.8229 119.7088 54.6949 18.5410 179.0696 785 E 3.9802 7.8691 117.7484 59.4466 29.8968 179.0821 786 V 3.8239 7.7793 117.8053 61.7720 32.0040 177.0988 787 G 3.8579 7.8884 107.2449 45.5047 0.0000 172.6250 788 Y 3.9019 8.4600 124.1678 58.2902 39.2235 175.4352 789 D 4.5504 7.7155 125.4171 51.7189 42.0643 175.9022 790 R 4.0118 8.2686 123.5107 58.7447 29.4714 177.8660 791 N 4.3903 8.3649 114.7377 54.3495 38.9104 174.7209 792 N 4.6772 8.3213 118.4862 51.7146 40.0656 174.8879 793 K 3.9472 8.6219 128.7011 59.7109 32.1998 178.8547 794 Q 4.0055 8.0362 119.6957 59.6241 28.9888 177.9014 795 H 4.3006 8.4592 116.6671 59.3509 28.5770 177.2730 796 H 4.3176 8.2007 117.2892 58.9397 28.6355 177.5470 797 R 3.9673 8.1665 120.4353 59.8015 29.8886 178.5323 798 L 4.0934 8.5338 118.9445 57.5108 41.6378 179.0937 799 L 4.0080 8.5467 120.8121 58.3060 41.9907 178.9332 800 L 4.1128 8.3184 119.0453 58.0804 41.4547 179.4300 801 C 4.1515 8.0154 116.0302 62.7487 28.1038 175.7370 802 L 3.9834 8.0254 121.8054 58.4018 41.5884 179.0717 803 L 4.1052 8.5925 119.0999 57.8735 41.5327 179.2716 804 M 4.0312 8.2386 118.3508 59.0169 32.2321 178.2740 805 T 3.8699 8.2127 113.4811 65.1466 67.2298 176.2170 806 S 3.9047 8.1597 116.9189 61.7362 63.1508 176.2320 807 C 4.3319 8.4984 119.5775 62.8462 27.7102 175.4146 808 D 4.3988 7.9576 118.4910 56.8756 40.9884 177.4854 809 L 4.6012 7.5289 116.8518 54.5744 42.0144 178.1242 810 S 3.9993 7.6951 117.0300 59.5425 62.6889 175.6859 811 D 4.3799 8.0613 122.9308 57.6201 40.3282 177.9079 812 Q 4.2240 8.2281 117.2162 57.4028 28.8581 177.2177 813 T 4.1700 7.2943 109.6919 62.8278 69.7980 174.7319 814 K 4.4946 7.5985 122.2570 55.1719 34.6922 176.4147 815 G 3.8371 8.4101 107.8582 45.8843 0.0000 174.0978 816 W 4.4633 9.0642 129.5626 60.8516 30.3758 178.1363 817 K 3.4059 8.1871 117.3539 59.9902 31.3926 179.1714 818 T 3.8719 7.7007 115.9215 66.5837 68.3620 177.1125 819 T 3.9337 7.7052 111.3611 64.6375 68.8209 176.3171 820 R 3.8364 7.2999 121.4766 59.0123 29.9850 178.2532 821 K 3.8461 7.9582 119.3878 59.7912 32.2009 178.7928 822 I 3.7727 7.9400 119.7018 64.1462 37.0595 178.2374 823 A 4.0385 8.2669 123.2412 54.4761 18.2414 179.1333 824 E 3.8497 8.3100 117.7530 59.6359 29.7338 179.0954 825 L 4.1142 8.1923 119.0338 57.8591 41.5771 179.4465 826 I 3.6442 7.8287 118.6620 63.9194 37.9636 177.2274 827 Y 4.2245 7.9758 120.3242 60.8416 38.4742 178.2046 828 K 4.1089 8.3429 119.0921 59.2317 32.6615 178.2750 829 E 4.1008 8.4074 119.8231 59.2487 29.4860 178.0947 830 F 4.1798 8.5835 120.1890 61.3450 39.3503 176.4160 831 F 4.2566 7.4718 113.1583 56.7147 39.9209 177.3120 832 S 4.4842 7.5425 115.9831 57.2027 60.1848 175.3412 *837 E 3.8942 7.5528 117.6571 56.2703 30.3004 175.6074 838 K 3.6035 8.8476 124.7509 56.3278 32.1770 176.0414 839 A 4.1685 8.4166 128.8563 52.5879 18.8294 176.6700 840 M 4.1014 8.3137 117.9460 57.5016 32.9460 177.2441 *845 M 4.4848 7.7899 117.4393 55.8683 34.4620 176.8630 846 E 3.9050 8.2374 118.0186 59.9491 29.3196 178.7965 847 M 4.0992 7.9842 117.2591 58.7554 32.2329 177.8330 848 M 4.0852 7.9068 118.5623 57.9000 32.2437 178.2621 849 D 4.3103 7.9653 118.7526 57.5454 40.9037 178.5874 850 R 3.9681 7.7578 117.6597 59.4775 30.0544 177.9153 851 E 4.2640 7.9209 117.8933 59.3407 29.9524 178.6145 852 K 3.7449 8.6493 118.6482 59.5958 31.8460 178.8958 853 A 4.0871 8.1221 120.0221 54.9199 18.5245 178.4952 854 Y 4.1580 8.4885 114.6608 59.3539 38.1386 177.5877 855 I 3.6189 7.5778 121.7070 64.5226 37.2703 175.6303 856 P 4.2017 0.0000 0.0000 66.4821 31.1779 178.2480 857 E 4.1566 8.0908 115.4702 59.4718 29.6692 179.1093 858 L 3.9927 7.9957 120.1199 57.6399 41.5837 179.1807 859 Q 3.8953 8.2294 120.0120 58.8759 28.8249 178.1556 860 I 3.6632 8.0589 121.3189 64.6088 37.3578 178.1913 861 S 4.1380 8.1870 113.8334 61.4466 62.0281 176.1886 862 F 4.3449 8.2733 123.2927 61.6577 39.1126 177.1655 863 M 3.6480 8.3351 118.6611 58.0883 31.4967 178.4035 864 E 3.8429 8.5786 119.0439 58.8132 29.9112 177.6293 865 H 4.8700 7.7852 112.8172 55.6654 30.2637 174.2860 866 I 4.2041 7.2327 118.2095 62.5493 39.9832 177.4563 867 A 3.7713 7.4485 121.4572 55.3160 18.2274 178.9016 868 M 4.0340 7.9764 116.7503 58.7973 32.1945 176.4283 869 P 4.3981 0.0000 0.0000 65.8422 31.5978 178.5276 870 I 3.6907 7.4970 118.2438 64.7578 36.8598 177.9234 871 Y 4.3683 7.7670 115.7855 59.5854 37.6923 178.0381 872 K 3.6333 8.3205 121.6298 59.2338 32.3449 178.4028 873 L 4.0388 8.0378 119.4642 58.0031 41.5098 179.5080 874 L 4.0704 7.8036 118.3002 58.0935 41.4119 179.4831 875 Q 3.9727 7.8132 117.5715 59.2852 29.0042 177.6201 876 D 4.4280 8.0893 119.5737 57.1917 40.9125 178.1957 877 L 4.3156 7.4794 117.9120 54.9288 42.3245 176.5347 878 F 4.7991 8.5975 118.3629 54.4086 40.5581 173.4771 879 P 4.2860 0.0000 0.0000 65.7985 30.9840 178.4031 880 K 4.1726 8.1935 114.3688 58.4046 32.3130 177.9612 881 A 4.1744 8.3855 120.7654 52.4600 18.5917 178.7496 882 A 3.9729 8.1893 120.6899 55.7249 18.5625 179.7094 883 E 3.7744 8.0009 117.1246 59.5025 29.9710 179.2315 884 L 3.8190 7.7370 119.0057 57.6482 41.7165 178.8399 885 Y 4.0348 7.9096 119.0069 60.8236 38.9182 177.4841 886 E 3.9590 8.4178 119.5446 59.4095 29.5207 179.5138 887 R 3.8305 7.7371 118.4975 59.4752 30.1084 179.0177 888 V 3.5577 7.5911 112.0475 64.0215 31.4393 178.2444 889 A 3.7714 8.1313 121.2695 55.2520 18.1701 179.7856 890 S 4.1893 7.9729 112.1796 60.9319 63.1585 176.5449 891 N 4.4118 8.2339 120.5820 56.4890 38.3996 176.9347 892 R 4.0833 8.3487 120.3849 59.7152 29.7318 178.0315 893 E 3.8796 7.9591 118.1001 59.5882 29.7711 178.0207 894 H 3.8343 7.8115 116.9405 58.6697 29.8296 176.8186 895 W 4.6329 8.2942 120.5681 60.0171 29.0760 176.7495 896 T 4.2440 7.8491 112.5994 62.2338 68.2551 173.6774 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 579 D 8.36 4.50 0.00 2.62 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 0.00 580 D 9.08 4.40 0.00 2.97 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 0.00 581 E 8.10 4.06 0.00 2.04 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 2.39 2.30 0.00 582 Y 8.25 4.30 0.00 2.98 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 0.00 583 T 7.88 3.59 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 1.18 0.00 0.00 584 K 7.62 3.89 0.00 1.98 1.99 0.00 1.49 0.00 0.00 1.62 0.00 0.00 3.08 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.43 1.52 7.81 585 L 7.45 3.95 0.00 1.99 1.74 1.03 0.64 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 0.00 586 L 7.70 3.84 0.00 1.53 1.56 0.54 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 587 H 8.00 4.04 0.00 3.25 3.29 0.00 5.74 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 0.00 588 D 7.58 4.55 0.00 3.01 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 0.00 589 G 7.54 4.04 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 0.00 0.00 0.00 0.00 0.00 0.00 590 I 7.96 3.90 1.87 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 1.44 0.60 0.94 0.00 0.00 591 Q 8.43 4.27 0.00 2.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.95 0.00 0.00 0.00 0.00 0.00 2.34 2.27 0.00 592 P 0.00 4.36 0.00 2.24 2.13 0.00 3.43 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 2.04 2.03 0.00 593 V 8.53 2.95 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 0.96 0.00 0.00 0.71 0.00 0.00 594 A 7.85 4.17 1.27 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 0.00 595 A 7.97 4.40 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 0.00 596 I 7.59 3.87 1.70 0.00 0.00 0.47 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 0.42 1.15 0.00 0.00 597 D 7.48 4.59 0.00 2.79 2.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 598 S 8.95 4.26 0.00 3.93 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 0.00 599 N 7.86 4.86 0.00 2.91 2.88 0.00 0.00 6.63 7.59 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 0.00 600 F 7.97 2.69 0.00 2.97 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 0.00 601 A 7.98 4.70 1.31 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 0.00 0.00 602 S 7.99 4.61 0.00 3.85 4.04 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 0.00 0.00 0.00 603 F 8.44 4.60 0.00 3.32 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 0.00 604 T 7.97 4.20 4.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 605 Y 7.96 4.22 0.00 3.24 3.04 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 0.00 0.00 0.00 606 T 7.37 4.20 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 1.13 0.00 0.00 607 P 0.00 4.14 0.00 2.13 2.01 0.00 3.63 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.92 0.00 608 R 7.83 3.98 0.00 1.77 2.02 0.00 3.21 0.00 0.00 3.28 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.59 0.00 609 S 7.64 4.46 0.00 3.95 3.90 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 0.00 610 L 7.79 4.26 0.00 1.88 1.61 1.20 1.32 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 0.00 611 P 0.00 4.38 0.00 2.22 1.96 0.00 3.70 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 2.14 2.10 0.00 612 E 8.84 3.95 0.00 2.05 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 2.49 2.54 0.00 613 D 8.10 4.51 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 0.00 614 D 7.83 4.80 0.00 2.90 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 0.00 615 T 7.69 3.67 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.29 0.00 0.00 616 S 8.07 4.24 0.00 3.91 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 617 M 8.12 4.22 0.00 2.32 2.35 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 2.93 2.68 0.00 618 A 7.97 4.08 1.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 619 I 8.24 4.11 2.38 0.00 0.00 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 2.36 1.42 1.40 0.00 0.00 620 L 8.10 4.12 0.00 1.94 1.79 1.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 621 S 8.34 4.11 0.00 3.67 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 622 M 8.08 3.69 0.00 1.92 2.31 0.00 0.00 0.00 0.00 0.00 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.65 1.43 0.00 623 L 7.89 3.97 0.00 1.92 1.81 1.21 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 0.00 624 Q 8.13 3.85 0.00 2.13 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.13 6.79 0.00 0.00 0.00 0.00 0.00 2.32 2.32 0.00 625 D 8.15 4.46 0.00 2.70 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 0.00 626 M 7.75 3.81 0.00 0.84 1.77 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.75 1.57 0.00 627 N 8.12 4.31 0.00 2.62 2.74 0.00 0.00 6.96 7.76 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 0.00 628 F 7.45 4.35 0.00 3.08 2.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 629 I 7.66 3.81 1.90 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 1.79 0.98 0.98 0.00 0.00 630 N 8.01 4.40 0.00 2.93 3.06 0.00 0.00 6.17 6.96 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 0.00 631 N 7.96 4.20 0.00 2.58 2.59 0.00 0.00 6.99 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 632 Y 8.07 4.58 0.00 3.37 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 0.00 633 K 7.77 3.77 0.00 1.94 1.87 0.00 1.72 0.00 0.00 1.71 0.00 0.00 3.03 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.42 1.41 7.81 634 I 7.87 4.11 2.01 0.00 0.00 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.92 1.01 0.00 0.00 635 D 8.75 4.46 0.00 2.84 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 0.00 636 C 8.75 4.26 0.00 3.05 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 0.00 637 P 0.00 4.44 0.00 2.38 2.30 0.00 3.98 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 2.18 2.25 0.00 638 T 8.09 4.06 4.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 639 L 8.13 4.00 0.00 1.97 1.94 1.04 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 640 A 8.45 4.10 1.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 641 R 8.15 3.70 0.00 2.03 1.85 0.00 3.21 0.00 0.00 2.78 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 1.12 0.00 642 F 8.43 3.98 0.00 3.33 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 0.00 643 C 8.65 4.18 0.00 3.34 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 0.00 644 L 8.22 3.83 0.00 1.75 1.58 0.97 0.88 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 0.00 645 M 7.61 3.86 0.00 1.76 2.08 0.00 0.00 0.00 0.00 0.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.45 2.47 0.00 646 V 7.40 3.55 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 0.16 0.00 0.00 0.95 0.00 0.00 647 K 7.25 3.17 0.00 0.79 1.16 0.00 1.16 0.00 0.00 1.22 0.00 0.00 2.87 0.00 0.00 2.81 0.00 0.00 0.00 0.00 0.86 0.21 7.81 648 K 7.72 4.07 0.00 1.69 1.93 0.00 1.67 0.00 0.00 1.64 0.00 0.00 3.07 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.36 1.42 7.81 649 G 7.66 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 650 Y 7.19 4.12 0.00 3.23 3.04 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 0.00 0.00 0.00 651 R 8.38 4.37 0.00 1.88 1.95 0.00 3.14 0.00 0.00 3.17 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.62 0.00 652 D 8.21 5.03 0.00 2.62 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 0.00 653 P 0.00 4.70 0.00 2.56 2.26 0.00 3.96 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 2.10 0.00 654 P 0.00 4.23 0.00 2.38 2.26 0.00 3.72 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 2.24 2.15 0.00 655 Y 7.76 4.57 0.00 2.69 3.11 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 0.00 656 H 8.49 4.18 0.00 3.15 3.17 0.00 5.65 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 657 N 7.10 5.28 0.00 2.94 3.12 0.00 0.00 5.73 8.88 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 0.00 658 W 8.70 3.46 0.00 3.30 3.10 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 0.00 0.00 0.00 659 M 8.05 3.63 0.00 2.01 2.18 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.59 0.00 660 H 8.42 3.83 0.00 2.82 3.30 0.00 5.79 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 0.00 661 A 7.20 3.61 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 662 F 7.53 3.46 0.00 1.98 2.65 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 0.00 0.00 0.00 0.00 663 S 7.89 3.72 0.00 3.99 4.02 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 0.00 664 V 7.49 3.51 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 0.96 0.00 0.00 0.68 0.00 0.00 665 S 7.87 3.83 0.00 3.77 3.34 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 0.00 666 H 7.99 4.11 0.00 2.60 3.20 0.00 5.59 0.00 0.00 0.00 0.00 6.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 667 F 8.48 4.13 0.00 3.36 3.28 0.00 0.00 0.00 0.00 0.00 0.00 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 C 8.37 4.15 0.00 3.19 3.39 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 0.00 669 Y 8.30 4.26 0.00 3.34 3.27 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 0.00 670 L 7.83 3.65 0.00 1.53 1.26 1.10 0.47 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0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 679 N 7.87 4.65 0.00 2.58 2.69 0.00 0.00 6.76 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 0.00 680 Y 8.67 4.78 0.00 2.92 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 0.00 681 L 7.82 5.13 0.00 1.78 1.75 1.05 1.20 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 0.00 682 E 8.87 4.43 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 2.42 2.70 0.00 683 D 8.69 4.65 0.00 2.81 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 0.00 684 I 7.92 3.98 2.00 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 1.68 1.79 0.99 0.00 0.00 685 E 8.31 4.07 0.00 2.35 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.50 0.00 686 I 8.06 3.91 2.47 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.99 1.40 0.00 0.00 687 F 8.55 4.04 0.00 2.60 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 0.00 688 A 8.23 3.85 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 0.00 689 L 8.10 3.95 0.00 2.00 2.06 1.00 0.89 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 0.00 690 F 8.56 4.19 0.00 3.35 3.27 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 0.00 691 I 8.01 3.94 1.85 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.49 1.07 0.00 0.00 692 S 8.46 4.37 0.00 4.13 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 0.00 693 C 8.17 4.10 0.00 2.99 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 0.00 694 M 7.64 4.20 0.00 2.34 2.46 0.00 0.00 0.00 0.00 0.00 2.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.51 2.68 0.00 695 C 8.10 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0.00 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 0.00 704 N 8.37 4.69 0.00 2.72 2.76 0.00 0.00 6.95 8.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 705 N 8.11 4.86 0.00 2.55 2.62 0.00 0.00 6.87 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 706 S 7.48 4.20 0.00 3.60 3.51 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 0.00 0.00 0.00 707 F 8.12 5.14 0.00 3.14 2.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 708 Q 7.71 4.01 0.00 1.98 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.11 6.98 0.00 0.00 0.00 0.00 0.00 2.42 2.37 0.00 709 V 7.76 3.76 2.11 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 1.13 0.00 0.00 0.98 0.00 0.00 710 A 8.20 4.18 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 0.00 0.00 0.00 0.00 0.00 711 S 8.09 4.21 0.00 4.05 4.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 840 M 8.31 4.10 0.00 1.98 2.09 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.62 0.00 *845 M 7.79 4.48 0.00 2.14 2.11 0.00 0.00 0.00 0.00 0.00 -0.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.53 0.00 846 E 8.24 3.91 0.00 2.08 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 2.39 2.45 0.00 847 M 7.98 4.10 0.00 2.13 2.03 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.66 2.69 0.00 848 M 7.91 4.09 0.00 2.09 2.24 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.41 0.00 849 D 7.97 4.31 0.00 2.84 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 0.00 850 R 7.76 3.97 0.00 1.88 2.07 0.00 3.36 0.00 0.00 3.26 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.74 0.00 851 E 7.92 4.26 0.00 2.46 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.41 2.61 0.00 852 K 8.65 3.74 0.00 1.95 1.73 0.00 1.66 0.00 0.00 1.45 0.00 0.00 2.81 0.00 0.00 3.14 0.00 0.00 0.00 0.00 0.30 1.17 7.81 853 A 8.12 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 0.00 854 Y 8.49 4.16 0.00 3.27 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 0.00 855 I 7.58 3.62 2.07 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.42 0.76 0.00 0.00 856 P 0.00 4.20 0.00 2.23 2.32 0.00 3.77 0.00 0.00 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 2.48 0.00 857 E 8.09 4.16 0.00 2.21 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.46 0.00 858 L 8.00 3.99 0.00 1.92 1.67 0.88 0.76 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 0.00 859 Q 8.23 3.90 0.00 1.51 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.81 0.00 0.00 0.00 0.00 0.00 1.16 1.91 0.00 860 I 8.06 3.66 1.89 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 1.53 0.67 0.96 0.00 0.00 861 S 8.19 4.14 0.00 3.95 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 862 F 8.27 4.34 0.00 3.15 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 0.00 863 M 8.34 3.65 0.00 2.01 2.06 0.00 0.00 0.00 0.00 0.00 2.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.78 2.43 0.00 864 E 8.58 3.84 0.00 1.96 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 2.24 2.30 0.00 865 H 7.79 4.87 0.00 3.23 3.26 0.00 5.67 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 866 I 7.23 4.20 1.87 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 1.36 1.20 0.90 0.00 0.00 867 A 7.45 3.77 0.81 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 0.00 0.00 868 M 7.98 4.03 0.00 2.09 2.25 0.00 0.00 0.00 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.56 2.81 0.00 869 P 0.00 4.40 0.00 2.29 2.39 0.00 3.69 0.00 0.00 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 2.28 0.00 870 I 7.50 3.69 1.72 0.00 0.00 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 1.37 1.12 0.34 0.00 0.00 871 Y 7.77 4.37 0.00 3.32 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 0.00 872 K 8.32 3.63 0.00 1.76 1.92 0.00 1.60 0.00 0.00 1.76 0.00 0.00 2.86 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.02 1.27 7.81 873 L 8.04 4.04 0.00 1.91 1.68 0.83 0.61 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 0.00 874 L 7.80 4.07 0.00 2.01 1.88 1.11 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 875 Q 7.81 3.97 0.00 2.12 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.95 0.00 0.00 0.00 0.00 0.00 2.29 2.39 0.00 876 D 8.09 4.43 0.00 2.80 2.64 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 0.00 0.00 0.00 0.00 877 L 7.48 4.32 0.00 1.00 0.85 0.81 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 878 F 8.60 4.80 0.00 3.02 2.82 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 0.00 879 P 0.00 4.29 0.00 2.21 2.17 0.00 3.73 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 2.24 0.00 880 K 8.19 4.17 0.00 1.80 1.96 0.00 1.80 0.00 0.00 1.93 0.00 0.00 3.28 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.50 1.57 7.81 881 A 8.39 4.17 1.48 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 0.00 0.00 882 A 8.19 3.97 1.49 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 0.00 883 E 8.00 3.77 0.00 2.04 1.78 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 2.39 2.49 0.00 884 L 7.74 3.82 0.00 1.79 1.41 0.81 0.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 885 Y 7.91 4.03 0.00 3.36 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 0.00 886 E 8.42 3.96 0.00 2.07 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 2.43 2.58 0.00 887 R 7.74 3.83 0.00 2.00 1.80 0.00 3.42 0.00 0.00 3.17 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.64 0.00 888 V 7.59 3.56 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 0.37 0.00 0.00 0.83 0.00 0.00 889 A 8.13 3.77 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 890 S 7.97 4.19 0.00 4.05 4.21 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 0.00 891 N 8.23 4.41 0.00 3.04 3.24 0.00 0.00 6.45 6.97 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 0.00 892 R 8.35 4.08 0.00 1.94 2.25 0.00 3.18 0.00 0.00 3.09 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.75 0.00 893 E 7.96 3.88 0.00 2.10 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 2.28 2.30 0.00 894 H 7.81 3.83 0.00 2.75 2.13 0.00 6.02 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 0.00 895 W 8.29 4.63 0.00 3.53 3.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 896 T 7.85 4.24 4.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.