NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 515 T 4.2761 8.1749 115.2423 61.2925 68.1418 173.4927 516 L 3.7863 8.6105 128.9714 53.0434 40.7904 175.0349 517 P 4.2330 0.0000 0.0000 62.8882 33.2053 175.3003 518 F 4.0900 7.1006 115.9592 59.1853 36.8320 176.3069 519 T 4.5345 7.3973 107.6006 62.0165 70.4927 173.6485 520 T 5.0873 7.8890 120.6394 62.2256 70.4212 173.8707 521 G 4.2728 8.9338 114.7749 45.4575 0.0000 172.1146 522 L 5.9693 8.7690 123.0077 52.1102 44.9384 175.4383 523 I 5.0706 8.3716 122.9721 59.7862 40.1200 173.8544 524 Y 4.7167 8.4820 126.2229 56.6204 42.6498 173.0502 525 D 4.3073 7.1700 122.2265 52.5780 44.4566 176.3815 526 S 3.8640 8.3454 120.2754 60.8011 63.5119 176.3700 527 V 3.1233 7.7476 121.8540 66.1930 30.8976 177.7133 528 M 4.1096 7.0720 116.7212 57.1330 31.6415 177.5369 529 L 4.0727 7.5583 119.0863 56.9174 41.9323 178.6635 530 K 3.7635 7.4087 115.9140 57.5148 32.1223 177.2426 531 H 4.4430 7.2853 119.2618 55.2640 28.1733 173.6703 532 Q 4.4157 7.7244 122.4582 53.4039 32.9693 174.7812 533 C 4.1855 8.3866 121.5787 59.3578 32.1178 174.8060 534 S 4.2064 8.5655 119.3370 60.8494 63.4306 175.8032 535 C 4.2555 8.2053 115.8417 58.8875 29.5551 174.0906 536 G 4.2803 7.7765 108.6076 46.5749 0.0000 173.4848 537 D 4.6235 7.4696 117.5368 51.7188 42.0184 175.6667 538 N 4.4585 8.6090 125.0897 55.5768 38.8636 177.6648 539 S 4.1429 7.9895 112.7096 60.4345 62.5472 174.6845 540 R 4.4675 7.4046 113.3595 56.0607 29.1406 176.9534 541 H 4.8647 7.6623 116.1448 53.5853 30.0149 171.9295 542 P 4.2558 0.0000 0.0000 65.2597 31.7260 177.9985 543 E 4.0405 6.4501 118.0044 54.5763 27.7742 174.6234 544 H 4.9467 7.5054 117.4614 52.4921 32.0168 175.7476 545 A 4.0123 8.6489 123.0824 55.3165 18.6423 180.2818 546 G 3.7907 8.4469 102.3685 47.8083 0.0000 175.5743 547 R 3.9510 7.6261 120.7315 59.5294 30.2291 178.7397 548 I 4.2317 7.6576 111.8487 63.1936 37.9831 177.9192 549 Q 4.1743 8.1851 121.5904 59.1360 29.0632 177.9473 550 S 4.1897 8.1474 115.3265 61.5527 63.0042 176.4053 551 I 3.7794 7.5444 122.2251 63.8360 36.5215 178.0654 552 W 4.4365 8.3936 129.3002 60.6041 30.3897 178.1760 553 S 3.9469 8.2209 114.1552 61.2791 62.5974 176.0558 554 R 3.7965 8.0344 122.5711 59.3878 29.6788 178.2945 555 L 3.8985 7.8141 118.3746 57.6557 41.4749 179.5063 556 Q 3.6791 7.3154 118.8877 59.2380 28.8410 177.2999 557 E 3.8751 8.3466 118.2896 60.0415 29.6443 179.1991 558 R 4.2251 7.7990 114.3276 56.2958 29.9844 177.0760 559 G 3.8401 7.6893 106.6716 47.0593 0.0000 175.7195 560 L 4.2770 7.9705 122.2934 56.4827 42.0743 178.7915 561 R 3.8366 7.8161 117.9656 59.3352 29.7636 178.8963 562 S 4.3139 7.9381 111.9392 60.8284 62.6875 175.5507 563 Q 4.2052 8.0841 121.1134 56.2423 28.8736 174.6922 564 C 5.1989 7.1650 117.2177 57.4846 31.0059 173.6292 565 E 4.1585 8.8383 123.2198 56.7936 29.9221 175.4895 566 C 5.1920 8.7532 125.3990 59.5168 29.4806 173.3146 567 L 4.9397 9.4631 122.4916 53.2653 44.8238 177.7397 568 R 4.3868 8.3441 118.9351 55.9129 30.9681 177.7449 569 G 3.9856 9.7646 103.4244 46.7551 0.0000 171.2713 570 R 2.5100 6.2466 112.8316 54.5744 31.4584 173.1993 571 K 4.3586 7.6762 117.3058 55.5258 32.7876 177.4653 572 A 4.3567 8.2904 126.3856 51.9972 19.2680 177.5582 573 S 4.3478 9.0952 115.3488 57.5962 64.7099 175.5050 574 L 3.9034 8.5041 120.6336 57.7879 41.0867 179.2809 575 E 3.8973 8.0698 117.9636 59.3605 29.8812 178.1707 576 E 4.2486 8.3166 118.6298 59.5727 29.5703 179.3183 577 L 3.8930 7.7958 118.7475 57.9154 40.2428 179.1366 578 Q 5.0482 8.4528 117.4686 56.6185 28.4989 177.9599 579 S 4.1665 7.9149 115.5540 60.2176 63.5221 174.9167 580 V 4.1203 7.4654 120.4677 63.3317 33.8224 174.7222 581 H 5.2092 8.0665 115.8674 53.3407 31.2763 174.2507 582 S 4.4391 8.4738 116.9366 57.9382 63.7697 175.1263 583 E 3.9782 8.7799 122.0256 59.3561 29.3268 179.2183 584 R 3.9009 7.9419 115.8446 59.5467 29.5285 178.1932 585 H 4.1275 8.3128 119.0730 58.8793 29.8883 177.4163 586 V 3.8597 8.0057 120.0668 66.1866 31.5602 178.0698 587 L 4.0625 7.9947 118.7773 57.4491 41.1881 179.1445 588 L 3.7111 7.6969 119.4119 58.0335 42.1102 177.9979 589 Y 4.6096 7.6595 113.1910 57.9599 38.8339 176.5971 590 G 4.1978 8.7113 108.0133 45.4691 0.0000 173.2464 591 T 4.7813 7.4657 107.7690 59.6707 71.8055 172.9193 592 N 5.0786 8.2328 117.5345 50.5209 41.6527 172.4896 593 P 4.6087 0.0000 0.0000 62.4900 31.6847 175.9846 594 L 4.6629 8.1897 123.2307 52.2793 43.2809 176.5328 595 S 4.2348 9.0512 123.3784 59.1591 63.3011 176.8161 *596 R 4.2685 8.4554 119.6393 57.0226 29.1451 177.4202 597 L 3.9774 7.4747 121.0894 56.7096 41.9667 178.2822 598 K 4.3809 8.4177 124.5977 53.1721 30.9553 174.2094 599 L 4.8903 7.9447 124.4702 51.4808 44.9202 177.4618 600 D 4.6171 8.3410 122.0097 53.2475 41.6273 177.3721 601 N 4.4342 8.7062 118.1284 56.1995 38.6247 177.7691 602 G 3.6926 8.1401 106.9087 47.9106 0.0000 175.7239 603 K 4.0061 8.1961 120.5600 59.0156 31.9688 179.3331 604 L 3.9336 8.0806 119.1434 58.0023 41.3701 179.5914 605 A 4.1026 8.4446 119.6839 54.9137 18.4523 179.6664 606 G 3.6569 7.8476 103.9679 47.9932 0.0000 175.8642 607 L 4.1413 7.6692 119.5784 56.5391 41.6640 179.0363 608 L 4.1399 7.6511 119.6169 57.3377 41.3999 178.8673 609 A 3.8658 7.5494 119.7069 55.9721 18.5870 177.4969 610 Q 4.1951 7.2893 115.0060 55.1169 31.4785 175.3639 *614 V 3.8632 8.1487 118.0796 63.6925 32.9367 174.9169 615 M 4.6804 8.6920 127.4211 54.8787 33.1931 175.2930 616 L 4.7414 8.5526 125.3825 52.3335 44.0107 175.6802 617 P 4.1985 0.0000 0.0000 66.2015 31.2422 177.3375 618 C 4.2917 8.0370 109.2077 58.4433 29.8426 174.4541 619 G 3.9667 8.4443 109.8462 45.6005 0.0000 174.2072 620 G 3.9363 7.6441 106.7437 44.9975 0.0000 172.9106 621 V 4.6890 8.3818 119.9547 62.3543 33.1009 174.9122 622 G 4.5876 9.1129 112.9699 45.0303 0.0000 172.9695 623 V 4.0905 9.0866 114.2840 63.3191 31.5946 175.9326 624 D 4.6734 7.5692 116.9351 52.2993 41.8858 174.9264 625 T 3.9443 8.7655 108.3249 65.3122 68.3927 174.7060 626 D 4.5900 7.6077 117.0501 55.4654 41.5752 176.4245 627 T 4.5167 7.8984 116.5817 61.9487 68.0641 174.0222 628 I 4.5876 8.1498 120.1278 59.9846 39.5361 175.5014 629 W 5.0314 8.8115 132.7019 55.6369 33.2057 174.1219 630 N 4.4040 8.9340 128.2599 53.0093 38.6537 175.9389 631 E 4.0671 8.9134 126.4264 58.8210 30.0178 178.0547 632 L 4.2131 7.8225 117.4342 56.2850 42.7103 177.5447 633 H 4.7600 7.9243 114.0862 56.2478 30.6010 176.5454 634 S 3.7087 7.2939 117.1838 61.1388 62.3630 176.5083 635 S 4.2768 7.1433 115.3513 61.4452 62.1549 175.8623 636 N 4.4054 7.9965 118.4461 56.1460 38.3032 177.0108 637 A 3.9079 7.7993 121.7636 55.2073 18.4459 179.5426 638 A 4.0432 8.0245 119.2245 55.5480 18.4645 180.1157 639 R 3.9990 8.4158 116.6242 59.0350 30.0396 179.1837 640 W 4.1414 8.8537 129.6828 59.6785 30.7886 177.6536 641 A 4.0604 8.5088 120.9244 55.5224 17.8253 179.5903 642 A 4.1209 8.0402 118.8379 55.2450 18.4795 180.1162 643 G 3.4532 7.9040 103.7111 47.6221 0.0000 176.1291 644 S 4.0198 8.0370 117.6817 61.3994 62.8151 176.9075 645 V 3.5957 7.6634 120.4944 66.1785 31.3309 178.0009 646 T 3.9722 7.9162 115.5434 66.9264 68.3657 176.2559 647 D 4.3413 8.2320 120.3979 57.2962 40.8016 178.2213 648 L 3.9727 7.9562 120.6279 58.4556 41.9596 178.9277 649 A 4.0145 8.1889 120.2878 55.2743 18.3167 179.5893 650 F 3.8508 8.3008 116.2232 60.4801 38.9962 177.8875 651 K 3.9927 8.0817 117.6777 59.5414 31.8250 179.4986 652 V 3.8051 7.8503 119.2002 65.5805 31.3191 177.5781 653 A 3.9491 8.0899 119.7534 55.4366 18.2343 179.2645 654 S 4.3453 8.1503 112.4841 59.7678 63.4505 176.0430 655 R 4.1685 7.9133 120.0057 56.7742 27.2927 182.1673 656 E 4.4372 8.1507 116.6208 58.1703 30.1672 176.2770 657 L 4.8790 7.5346 120.4331 53.5398 45.8603 177.5166 658 K 4.3492 12.0000 123.7634 57.7565 32.4771 177.8452 659 N 5.1543 7.6453 116.0153 52.9332 41.2526 172.2043 660 G 4.3507 8.2349 104.8245 46.5548 0.0000 172.2224 661 F 5.5824 9.0048 122.0863 56.3089 42.7551 173.3197 662 A 4.4675 9.0596 129.1917 50.7230 20.1167 176.1388 663 V 4.4158 8.4047 124.7091 61.8446 30.0565 175.2282 664 V 4.5516 7.7582 116.7561 58.9468 35.1593 175.2189 665 R 4.6979 8.0328 117.8083 53.8433 32.2050 172.7389 666 P 4.6560 0.0000 0.0000 61.5597 32.1814 173.7648 667 P 4.6514 0.0000 0.0000 62.6133 32.3398 176.8918 668 G 4.2582 9.2926 105.3692 44.4156 0.0000 174.7645 669 H 4.4119 8.4814 114.2899 57.6654 28.8893 176.3043 670 H 4.4094 7.9348 115.6303 56.4041 29.5392 174.9923 671 A 4.2065 8.0047 124.6315 51.8725 18.5851 176.8411 672 D 5.0927 8.4103 123.8850 52.5667 43.8878 175.8072 673 H 4.2851 9.4087 118.6706 58.2967 29.6242 176.9223 674 S 4.8237 7.6510 111.8276 57.6809 63.3725 173.9712 675 T 4.4900 7.8874 117.4339 63.1184 71.8508 173.1533 676 A 4.6915 8.4361 129.9446 50.9780 20.3798 175.7872 677 M 4.3484 8.4616 117.3830 55.3562 34.1668 174.4781 678 G 3.1670 9.2679 105.3567 46.8313 0.0000 174.8226 679 F 4.2547 8.4557 116.7278 57.2624 37.9069 175.0233 680 C 5.2005 7.5004 117.9041 57.0953 30.8076 174.0719 681 F 4.1012 8.7611 119.6584 58.2379 41.2337 175.7367 682 F 5.1063 7.8045 117.6201 55.3671 42.2690 174.2117 683 N 4.6876 9.0121 123.0439 52.0550 36.8174 175.3011 684 S 4.2069 8.4334 121.5292 61.4371 63.2425 176.1855 685 V 3.5870 7.8876 119.7745 66.0158 31.3680 177.8327 686 A 4.3262 8.3173 120.2646 55.0800 18.1055 179.6402 687 I 3.6487 8.0686 118.2211 64.5253 37.1870 178.1177 688 A 4.0023 7.9502 121.5358 55.6737 18.2860 178.7141 689 C 3.7875 8.3173 116.9492 63.1166 31.5150 175.9512 690 R 4.0358 8.4413 119.1348 59.4929 29.7518 179.0819 691 Q 4.0569 8.4008 117.6511 59.1592 28.6633 178.5670 692 L 3.3317 7.7598 119.9628 58.2650 41.4433 179.9217 693 Q 3.9897 7.6321 115.9460 58.5821 28.7129 178.2482 694 Q 4.1901 7.8942 118.6207 59.1656 28.9786 178.5172 695 Q 4.6214 7.9969 115.7853 56.5638 29.3196 176.7334 696 S 4.3926 7.7971 117.0542 56.7116 65.0515 173.4261 697 K 3.9503 8.4650 124.8269 57.4318 32.3125 177.6055 698 A 3.7018 8.7938 123.8295 52.3369 16.5396 177.9893 699 S 4.4260 7.5496 110.9478 58.6183 63.6652 173.7559 700 K 4.8071 9.0506 121.2856 54.7333 34.8548 175.1565 701 I 4.9383 8.9647 125.5387 59.3904 40.6280 174.0615 702 L 4.8966 8.6558 128.8659 53.5646 44.1291 174.8734 703 I 4.8404 8.9225 127.4728 59.6387 39.7392 174.5237 704 V 4.4566 8.4982 127.8977 61.2382 33.1290 173.9367 705 D 5.1621 9.3040 128.6445 52.4281 42.7131 175.4766 706 W 5.2465 8.2412 122.2355 56.0305 29.0774 176.1913 707 D 4.7695 7.9025 120.0817 54.8894 41.1781 177.1550 708 V 3.9937 9.1760 124.7311 64.1400 31.7432 175.6826 709 H 5.3006 8.6733 118.2268 54.2557 30.0438 174.5167 710 H 4.2566 8.9868 122.9158 56.6295 30.5984 177.0117 711 G 3.8947 8.5721 116.7404 41.9809 0.0000 173.7255 712 N 4.2312 7.9699 123.6641 56.5784 37.4475 177.5243 713 G 3.7929 7.5940 109.3711 47.0031 0.0000 175.6611 714 T 3.6964 7.6323 117.8330 66.3439 68.2646 176.1267 715 Q 3.7156 7.2462 119.7551 59.3658 29.0341 178.2340 716 Q 3.9864 8.0364 118.9517 58.9705 28.4762 178.5073 717 T 3.5826 7.6161 116.2336 66.1381 68.7752 175.6903 718 F 4.8471 7.2926 116.4694 57.2910 38.9745 176.9228 719 Y 4.1818 7.7797 122.7058 60.2931 38.6710 177.6621 720 Q 4.6860 8.0877 115.9071 55.3771 29.4779 174.9324 721 D 4.7446 7.8480 119.8067 51.4199 41.2845 174.6488 722 P 3.3178 0.0000 0.0000 64.0095 31.4375 177.6030 723 S 4.3753 8.5445 114.4529 59.6463 64.2858 173.8649 724 V 4.7410 7.5807 120.7885 60.9453 33.9566 174.1518 725 L 4.6804 8.6803 130.4695 53.5326 43.8869 174.0488 726 Y 5.1519 8.8497 127.9796 55.9417 41.2216 174.1111 727 I 4.6104 8.4333 127.9927 59.4624 40.0952 174.3956 728 S 4.9301 8.4313 122.2226 56.2475 65.0984 172.4511 729 L 5.0780 8.6078 126.8392 53.2917 43.3537 175.5604 730 H 5.2943 8.4836 118.0140 54.1062 32.4588 172.8390 731 R 4.6328 8.9149 121.6792 56.8747 29.6331 174.7031 732 H 4.7892 9.2899 124.1652 57.6995 32.1906 174.0208 733 D 4.3108 9.1544 117.7742 56.1433 38.9177 173.0816 734 D 4.2021 9.2405 110.6855 55.5458 39.8315 173.7720 735 G 3.9281 7.8204 103.7704 45.6083 0.0000 173.6105 736 N 5.1049 7.5846 116.1214 52.2434 39.5358 174.3550 737 F 4.9528 7.9499 118.3266 55.9676 42.8188 173.0351 738 F 3.9744 7.9282 129.0343 58.3869 39.3475 172.8868 739 P 3.3497 0.0000 0.0000 62.1380 31.2821 176.5032 740 G 3.8179 8.4460 108.0475 45.3339 0.0000 173.6191 741 S 4.5245 7.4836 113.5897 57.4091 65.4480 173.0323 742 G 3.2257 8.5369 105.1371 46.1760 0.0000 174.0432 743 A 3.9158 7.8342 121.1648 51.3565 19.4055 179.6178 744 V 3.7858 8.2939 120.3549 64.7207 31.3315 177.3223 745 D 4.4224 7.9439 117.8554 54.7357 39.6967 176.2675 746 E 4.3875 7.9722 119.2250 56.0524 28.1839 176.6996 747 V 4.7576 7.7309 115.9126 59.6727 32.8371 176.1449 748 G 2.9053 8.3889 105.1564 44.2449 0.0000 172.3303 749 A 4.5821 7.7195 120.1681 50.7783 23.5012 177.7431 750 G 3.7208 8.4604 107.8552 46.4105 0.0000 177.0127 751 S 4.1000 9.0056 117.5027 61.3823 63.0008 175.2259 752 G 3.8912 8.1234 107.3906 45.1705 0.0000 172.7841 753 E 3.9176 7.8020 122.1140 57.4347 29.6738 176.8388 754 G 3.1179 8.1088 115.1063 44.8537 0.0000 173.8148 755 F 4.9151 8.2988 117.4326 57.0136 40.8198 174.4055 756 N 5.3385 8.1261 118.6723 51.9831 41.5900 173.3189 757 V 4.2244 9.3050 128.7109 61.3370 33.5998 174.5226 758 N 4.8162 8.6825 127.0339 51.9537 38.9742 175.8414 759 V 3.5286 8.4701 126.6534 61.8812 30.3769 172.9370 760 A 4.1115 7.5745 123.8576 49.6611 19.2491 176.8654 761 W 4.6148 8.7488 122.6710 57.6709 30.1090 175.7948 762 A 5.0650 9.3312 127.0932 51.2121 20.9110 176.6039 763 G 3.9512 8.6905 107.3137 45.0585 0.0000 175.0812 764 G 3.8627 8.4161 105.4325 44.5147 0.0000 172.5277 765 L 4.4015 8.3347 116.5237 55.0617 42.8226 176.0701 766 D 4.7965 7.8210 118.1018 51.6222 42.0586 174.4240 767 P 4.4839 0.0000 0.0000 61.2578 32.3819 173.4995 768 P 4.6279 0.0000 0.0000 62.5815 32.3112 175.2350 769 M 3.8238 8.2791 125.2324 53.9600 33.3585 173.3125 770 G 3.7213 8.9486 116.9173 44.9675 0.0000 174.5549 771 D 4.2478 8.9593 120.1388 57.2541 40.8787 176.9584 772 P 4.2857 0.0000 0.0000 65.2496 31.3457 178.6242 773 E 3.8794 7.8942 117.2331 59.5062 29.3840 178.8272 774 Y 3.9457 7.9555 116.4751 60.9140 37.9245 178.0335 775 L 3.8180 8.2194 120.0894 57.7901 41.6714 179.5240 776 A 3.9638 8.1974 120.4147 55.0158 18.2484 179.4078 777 A 3.9378 8.5626 119.6727 55.3701 18.3801 179.8111 778 F 3.7008 8.8259 116.5662 60.8102 38.8015 178.1221 779 R 3.9111 8.1335 116.3794 59.0216 29.9265 178.4698 780 I 4.1016 7.7144 117.8179 62.4653 38.1077 176.8141 781 V 4.0039 7.5882 116.6502 64.3825 32.8412 177.8181 782 V 3.1245 7.1441 117.0532 66.1393 31.3362 177.8101 783 M 3.9014 7.8496 118.4113 57.8513 31.8960 177.0519 784 P 4.1897 0.0000 0.0000 65.6152 31.5581 178.7744 785 I 3.2932 7.5083 118.4156 64.0270 36.8425 178.3268 786 A 3.9036 7.8107 121.6480 55.2781 17.9590 179.9723 787 R 3.9644 7.9498 115.7226 59.1118 30.1634 178.5900 788 E 4.1957 7.8824 118.2758 59.2153 29.7748 178.2441 789 F 4.7467 8.3396 119.8399 59.3781 40.8344 174.1212 790 S 3.6517 7.9669 113.0531 58.1293 60.3568 168.6794 791 P 4.4116 0.0000 0.0000 62.0177 32.4938 178.1704 792 D 4.4837 8.6357 121.4346 57.2025 41.4993 176.2305 793 L 4.6537 7.6560 118.0555 53.8612 45.9689 173.8854 794 V 4.8288 8.8837 124.3279 61.1800 34.2166 174.0937 795 L 5.0933 8.7617 128.1810 53.2039 44.1429 175.6220 796 V 4.5017 8.6537 123.3521 61.0913 34.1091 174.9767 797 S 4.3342 8.9637 124.9944 58.3349 62.6685 172.5869 798 A 3.8374 8.7174 129.7218 50.1290 17.5266 175.9877 799 G 3.9048 7.8408 107.5352 44.6828 0.0000 170.9778 800 F 4.9957 8.6109 119.8810 57.0461 39.6313 176.8991 801 D 4.1490 8.3328 119.2617 54.3689 39.7773 176.6033 802 A 4.2851 8.1397 122.3386 52.8015 19.1786 177.2527 803 A 5.3025 7.8463 118.7588 50.9952 19.0884 177.3355 804 E 4.3201 8.1136 121.0526 56.9722 30.0509 176.7910 805 G 4.0379 8.8669 113.3470 45.6202 0.0000 172.9813 806 H 4.7686 8.1635 117.1457 52.8548 30.7794 171.6866 807 P 4.5291 0.0000 0.0000 63.1870 31.6073 178.4538 808 A 3.6242 7.4167 120.0569 54.2700 20.1527 177.9027 809 P 4.5712 0.0000 0.0000 64.6826 31.9188 177.2359 810 L 4.6266 9.1646 117.7580 53.8153 41.4586 177.4275 811 G 4.2025 8.1843 114.2508 41.7763 0.0000 173.5247 812 G 3.8913 7.7905 109.3068 45.0005 0.0000 172.4976 813 Y 4.8184 7.5428 117.3916 56.8237 40.0592 175.0083 814 H 4.9884 8.3957 115.6955 55.6220 30.2786 174.6405 815 V 3.6504 8.0524 119.6386 62.7924 32.0438 175.2862 816 S 5.0246 8.6550 121.0507 56.5898 66.4297 175.4303 817 A 4.1111 8.3811 123.8837 55.3345 18.1291 179.9258 818 K 3.8924 8.1474 116.5479 59.8861 32.1563 178.8078 819 C 4.1000 8.1202 118.3973 62.5857 31.3853 175.5654 820 F 3.7540 7.8860 119.4439 60.3213 38.3754 177.8038 821 G 3.7286 8.6839 105.6658 48.1483 0.0000 175.1291 822 Y 4.4449 8.6737 122.5794 60.5596 38.8146 177.7663 823 M 3.3439 8.3423 119.9546 58.4096 31.8803 178.5582 824 T 4.2560 8.1532 116.0587 67.0850 68.5214 176.1458 825 Q 4.0748 8.0988 119.7667 59.4686 29.3687 178.2019 826 Q 4.1249 8.6411 119.2434 59.0049 28.7613 178.7145 827 L 4.2066 8.3709 119.8197 57.9090 41.4673 179.2628 828 M 4.2590 8.0693 118.0032 57.6033 31.6560 177.5926 829 N 4.5992 8.0637 115.3754 53.6622 39.2307 174.7685 830 L 4.5556 7.5064 121.0556 53.9901 43.8913 176.0095 831 A 4.1378 8.5742 120.5308 53.0540 15.8111 179.3585 832 G 3.7538 8.9164 105.2042 47.4933 0.0000 175.6556 833 G 3.9211 8.4639 107.5669 44.0853 0.0000 174.7009 834 A 4.6163 7.8132 122.2151 50.8840 17.9258 175.7488 835 V 4.8629 8.1590 119.7219 61.4536 35.4201 174.0723 836 V 4.8421 8.6716 126.9564 61.2890 34.3523 174.0381 837 L 5.0518 9.2403 128.6956 53.5991 43.8269 175.6556 838 A 4.9129 8.7953 124.3856 49.4622 22.0980 175.3105 839 L 4.3190 8.2711 124.7766 55.8708 42.8134 174.2331 840 E 4.4285 8.7467 122.5362 56.9842 31.6986 179.7303 841 G 4.0653 7.5945 123.5643 45.7486 0.0000 172.1018 842 G 4.3667 9.8471 108.2436 46.7807 0.0000 173.0192 843 H 4.9247 8.8520 116.7992 53.9952 30.4420 173.2878 844 D 4.3689 8.0572 121.2122 53.9524 41.8783 176.1961 845 L 4.0267 8.5193 127.5250 58.0970 41.8546 179.2958 846 T 3.7690 7.9263 112.2059 65.0904 67.3997 175.4601 847 A 3.9912 8.6754 123.4389 55.5409 18.3085 179.7644 848 I 3.6818 8.2783 111.6634 64.1810 37.6678 178.2971 849 C 4.1249 8.4527 118.8509 62.6125 27.9373 175.4692 850 D 4.2903 8.5473 120.5759 57.4677 40.4406 178.9765 851 A 3.6839 7.8117 120.9127 55.1476 18.1787 179.7675 852 S 3.7399 7.8158 114.0059 61.4569 62.7752 176.5881 853 E 3.7645 8.1885 121.6596 59.1777 29.5106 178.4080 854 A 3.9660 7.9678 120.8581 55.7339 18.4072 179.4549 855 C 4.2008 8.0829 114.9450 62.9624 28.1632 176.6216 856 V 3.5520 7.8618 119.7500 65.6604 31.0944 177.6893 857 A 3.9681 8.3209 120.8105 55.3964 18.0078 179.5560 858 A 4.3282 7.8454 119.8372 54.7597 18.2565 179.8084 859 L 4.0342 7.8067 116.6627 58.0727 41.7718 179.5412 860 L 4.2240 7.7669 118.1712 57.0113 41.5979 177.1247 861 G 3.6430 7.4353 105.7174 44.7590 0.0000 173.5430 862 N 4.3413 8.3914 120.4759 53.7151 39.4465 173.6676 863 R 4.7279 8.3408 123.4803 54.2742 32.3891 175.9568 864 V 3.7058 8.3586 122.5726 62.2769 32.5090 175.0795 865 D 4.5729 8.1612 126.1484 51.8895 40.4287 175.0866 866 P 4.2948 0.0000 0.0000 65.1593 31.4943 178.2892 867 L 3.9711 7.8700 117.6912 56.2696 41.9406 178.0665 868 S 4.0544 7.9300 113.5025 59.8606 62.7541 174.0773 869 E 4.2819 7.0668 121.2666 54.1781 31.1350 176.6372 870 E 3.9205 8.7468 123.9734 59.4308 30.1518 179.3007 871 G 3.7513 8.0121 106.4478 47.4097 0.0000 174.2486 872 W 4.6653 7.7693 117.8607 57.0627 29.2519 177.1751 873 K 4.2912 8.1702 118.7625 57.6365 32.1666 177.3159 874 Q 4.1357 7.3693 119.2914 55.5027 29.5157 175.9353 875 K 4.2387 8.3522 123.9731 55.2135 32.9026 175.3492 876 P 4.4847 0.0000 0.0000 62.4264 31.9967 176.5195 877 N 4.5413 8.8061 118.5659 52.7478 39.2667 176.1318 878 L 3.9559 8.2877 122.3111 58.1184 42.2469 178.4820 879 N 4.3076 8.2764 115.9504 56.3697 38.4132 176.8505 880 A 4.3057 8.9860 122.1271 55.3502 18.5021 179.5831 881 I 3.6684 7.9270 118.3499 64.5640 37.2091 178.4701 882 R 3.8774 8.4053 119.6941 59.7605 29.8071 178.5973 883 S 4.1663 8.6453 115.1373 61.7326 62.7874 176.8709 884 L 3.8881 8.3696 121.9576 57.4454 41.2929 178.7713 885 E 3.8797 8.7897 119.5250 59.5565 29.4876 178.8224 886 A 3.9752 8.1206 120.4515 55.1304 18.3170 179.8547 887 V 3.4801 7.4630 116.4670 66.1290 31.5851 178.2187 888 I 3.6650 8.0060 119.9307 64.4052 36.7638 178.0416 889 R 3.8488 7.9604 118.2502 59.6285 30.2351 178.1989 890 V 3.7249 7.7317 117.5739 66.3148 31.6094 177.1034 891 H 4.9342 8.6475 114.3897 56.5056 28.6153 177.2357 892 S 4.1364 8.3077 117.5090 61.4770 62.2905 176.4763 893 K 3.7959 7.3433 120.8146 58.4330 31.8057 176.8120 894 Y 4.3749 6.9564 115.0545 57.2161 40.4314 175.8494 895 W 4.9358 8.2500 119.7963 54.3874 32.2450 176.5924 896 G 3.6319 10.3681 113.9292 48.8429 0.0000 175.5593 897 C 4.3384 8.7593 114.5953 60.3947 29.4387 174.2783 898 M 4.2848 7.7589 118.0850 55.4903 32.0975 176.5359 899 Q 4.2100 8.2168 119.5827 56.6588 27.7919 176.0396 900 R 4.2227 8.4703 118.2275 56.0773 29.2562 176.1845 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 T 8.17 4.28 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 516 L 8.61 3.79 0.00 1.77 1.64 0.95 0.86 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 0.00 517 P 0.00 4.23 0.00 1.27 1.83 0.00 3.85 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 1.94 0.00 518 F 7.10 4.09 0.00 3.47 3.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 519 T 7.40 4.53 4.36 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 1.27 0.00 0.00 520 T 7.89 5.09 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 1.36 0.00 0.00 521 G 8.93 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 0.00 0.00 0.00 0.00 522 L 8.77 5.97 0.00 2.02 2.13 1.04 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 523 I 8.37 5.07 1.89 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 1.31 1.15 0.96 0.00 0.00 524 Y 8.48 4.72 0.00 1.69 1.43 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 0.00 525 D 7.17 4.31 0.00 3.01 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 0.00 0.00 0.00 526 S 8.35 3.86 0.00 3.92 4.06 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 0.00 527 V 7.75 3.12 0.67 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 0.44 0.00 0.00 0.01 0.00 0.00 528 M 7.07 4.11 0.00 2.07 1.89 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 2.40 2.68 0.00 529 L 7.56 4.07 0.00 1.67 1.65 0.89 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 530 K 7.41 3.76 0.00 1.52 1.43 0.00 1.15 0.00 0.00 1.38 0.00 0.00 2.75 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.25 1.24 7.81 531 H 7.29 4.44 0.00 2.84 3.18 0.00 5.92 0.00 0.00 0.00 0.00 6.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 532 Q 7.72 4.42 0.00 1.95 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.75 0.00 0.00 0.00 0.00 0.00 2.20 2.33 0.00 533 C 8.39 4.19 0.00 2.66 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 0.00 534 S 8.57 4.21 0.00 4.04 4.09 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 0.00 0.00 0.00 535 C 8.21 4.26 0.00 3.15 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 0.00 536 G 7.78 4.28 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 0.00 0.00 0.00 537 D 7.47 4.62 0.00 2.76 2.51 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 0.00 538 N 8.61 4.46 0.00 2.69 2.63 0.00 0.00 6.69 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 0.00 539 S 7.99 4.14 0.00 3.78 4.10 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 0.00 540 R 7.40 4.47 0.00 1.85 1.91 0.00 3.02 0.00 0.00 3.17 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.22 0.00 541 H 7.66 4.86 0.00 3.14 3.06 0.00 5.62 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 0.00 542 P 0.00 4.26 0.00 1.91 1.96 0.00 3.69 0.00 0.00 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 1.99 0.00 543 E 6.45 4.04 0.00 1.16 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.29 0.00 544 H 7.51 4.95 0.00 3.47 3.52 0.00 5.72 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 545 A 8.65 4.01 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 0.00 546 G 8.45 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 0.00 547 R 7.63 3.95 0.00 1.91 2.08 0.00 3.29 0.00 0.00 3.32 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.56 0.00 548 I 7.66 4.23 2.10 0.00 0.00 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.93 0.98 0.00 0.00 549 Q 8.19 4.17 0.00 2.28 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.94 0.00 0.00 0.00 0.00 0.00 2.52 2.56 0.00 550 S 8.15 4.19 0.00 4.17 4.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 551 I 7.54 3.78 2.25 0.00 0.00 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.81 1.26 0.00 0.00 552 W 8.39 4.44 0.00 2.90 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 0.00 553 S 8.22 3.95 0.00 4.07 4.10 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 0.00 554 R 8.03 3.80 0.00 1.94 2.22 0.00 3.26 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 1.60 1.69 0.00 555 L 7.81 3.90 0.00 1.58 1.46 1.18 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 556 Q 7.32 3.68 0.00 1.78 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.72 0.00 0.00 0.00 0.00 0.00 2.21 2.32 0.00 557 E 8.35 3.88 0.00 2.01 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 2.53 0.00 558 R 7.80 4.23 0.00 1.74 1.91 0.00 3.36 0.00 0.00 3.19 7.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.87 0.00 559 G 7.69 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 0.00 560 L 7.97 4.28 0.00 1.71 1.68 0.87 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 561 R 7.82 3.84 0.00 1.62 1.79 0.00 2.58 0.00 0.00 2.25 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 1.02 0.00 562 S 7.94 4.31 0.00 4.07 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 0.00 563 Q 8.08 4.21 0.00 2.24 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.79 0.00 0.00 0.00 0.00 0.00 2.32 2.53 0.00 564 C 7.17 5.20 0.00 3.00 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 0.00 565 E 8.84 4.16 0.00 2.23 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 0.00 2.39 2.43 0.00 566 C 8.75 5.19 0.00 3.09 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 0.00 567 L 9.46 4.94 0.00 1.58 1.57 1.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 568 R 8.34 4.39 0.00 1.94 2.28 0.00 3.60 0.00 0.00 2.25 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.68 0.00 569 G 9.76 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 0.00 0.00 0.00 570 R 6.25 2.51 0.00 1.49 1.61 0.00 2.73 0.00 0.00 3.13 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 1.14 0.00 571 K 7.68 4.36 0.00 1.59 1.74 0.00 1.82 0.00 0.00 1.84 0.00 0.00 2.84 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.70 1.68 7.81 572 A 8.29 4.36 1.12 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 0.00 0.00 573 S 9.10 4.35 0.00 3.84 3.92 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 0.00 574 L 8.50 3.90 0.00 1.72 1.73 0.94 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 575 E 8.07 3.90 0.00 1.93 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 2.28 2.40 0.00 576 E 8.32 4.25 0.00 2.23 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 2.33 2.31 0.00 577 L 7.80 3.89 0.00 1.70 1.40 0.25 0.15 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 0.00 578 Q 8.45 5.05 0.00 2.22 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 6.83 0.00 0.00 0.00 0.00 0.00 2.52 2.35 0.00 579 S 7.91 4.17 0.00 4.07 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 0.00 580 V 7.47 4.12 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 0.68 0.00 0.00 0.89 0.00 0.00 581 H 8.07 5.21 0.00 3.42 3.32 0.00 5.67 0.00 0.00 0.00 0.00 6.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 582 S 8.47 4.44 0.00 3.91 3.77 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 0.00 685 V 7.89 3.59 2.13 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 1.16 0.00 0.00 0.92 0.00 0.00 686 A 8.32 4.33 1.45 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 0.00 0.00 687 I 8.07 3.65 2.05 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 1.49 0.71 0.93 0.00 0.00 688 A 7.95 4.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 689 C 8.32 3.79 0.00 3.01 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 0.00 690 R 8.44 4.04 0.00 2.08 2.05 0.00 3.54 0.00 0.00 3.27 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 2.00 0.00 691 Q 8.40 4.06 0.00 2.33 2.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.67 0.00 0.00 0.00 0.00 0.00 2.70 2.71 0.00 692 L 7.76 3.33 0.00 1.85 1.57 0.22 0.87 0.00 0.00 0.00 0.00 0.00 0.00 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0.00 1.20 1.20 7.81 701 I 8.96 4.94 1.74 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.93 0.87 0.00 0.00 702 L 8.66 4.90 0.00 1.90 1.59 0.73 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 703 I 8.92 4.84 2.06 0.00 0.00 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.47 1.08 0.00 0.00 704 V 8.50 4.46 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 1.15 0.00 0.00 0.86 0.00 0.00 705 D 9.30 5.16 0.00 2.83 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 0.00 706 W 8.24 5.25 0.00 3.62 3.64 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 0.00 707 D 7.90 4.77 0.00 2.77 2.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 708 V 9.18 3.99 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 0.72 0.00 0.00 0.49 0.00 0.00 709 H 8.67 5.30 0.00 3.54 3.56 0.00 5.86 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 0.00 710 H 8.99 4.26 0.00 2.74 3.19 0.00 5.91 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 0.00 711 G 8.57 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 0.00 712 N 7.97 4.23 0.00 2.89 3.04 0.00 0.00 5.99 6.92 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 0.00 713 G 7.59 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 0.00 714 T 7.63 3.70 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 715 Q 7.25 3.72 0.00 2.13 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.98 0.00 0.00 0.00 0.00 0.00 2.25 2.68 0.00 716 Q 8.04 3.99 0.00 2.15 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.53 0.00 0.00 0.00 0.00 0.00 2.37 2.49 0.00 717 T 7.62 3.58 3.53 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 0.00 0.00 0.20 0.00 0.00 718 F 7.29 4.85 0.00 3.09 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 0.00 719 Y 7.78 4.18 0.00 3.25 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 0.00 720 Q 8.09 4.69 0.00 2.08 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.76 0.00 0.00 0.00 0.00 0.00 2.33 2.41 0.00 721 D 7.85 4.74 0.00 2.75 2.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 722 P 0.00 3.32 0.00 1.69 1.98 0.00 3.72 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 1.82 1.84 0.00 723 S 8.54 4.38 0.00 3.88 4.10 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 0.00 724 V 7.58 4.74 1.81 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 0.08 0.00 0.00 0.48 0.00 0.00 725 L 8.68 4.68 0.00 0.45 0.29 0.73 -0.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 726 Y 8.85 5.15 0.00 3.05 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 0.00 727 I 8.43 4.61 1.58 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 0.76 0.33 0.60 0.00 0.00 728 S 8.43 4.93 0.00 3.41 3.64 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 0.00 729 L 8.61 5.08 0.00 1.78 1.55 1.17 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 730 H 8.48 5.29 0.00 3.60 3.66 0.00 5.46 0.00 0.00 0.00 0.00 6.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 731 R 8.91 4.63 0.00 1.33 1.37 0.00 2.67 0.00 0.00 2.25 7.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 1.35 0.00 732 H 9.29 4.79 0.00 3.20 3.43 0.00 5.87 0.00 0.00 0.00 0.00 6.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 733 D 9.15 4.31 0.00 2.94 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 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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 0.00 0.00 0.00 842 G 9.85 4.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 843 H 8.85 4.92 0.00 3.35 3.43 0.00 5.73 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 0.00 844 D 8.06 4.37 0.00 2.70 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 0.00 845 L 8.52 4.03 0.00 1.76 1.74 1.00 0.76 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 0.00 846 T 7.93 3.77 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 847 A 8.68 3.99 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 0.00 848 I 8.28 3.68 2.11 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 1.92 1.27 1.12 0.00 0.00 849 C 8.45 4.12 0.00 3.15 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 0.00 850 D 8.55 4.29 0.00 2.76 2.68 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 0.00 851 A 7.81 3.68 0.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 852 S 7.82 3.74 0.00 3.84 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 0.00 853 E 8.19 3.76 0.00 2.09 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.25 2.27 0.00 854 A 7.97 3.97 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 0.00 855 C 8.08 4.20 0.00 2.96 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 0.00 856 V 7.86 3.55 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 1.03 0.00 0.00 0.66 0.00 0.00 857 A 8.32 3.97 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 858 A 7.85 4.33 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 0.00 0.00 0.00 0.00 0.00 859 L 7.81 4.03 0.00 1.88 2.04 1.09 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 860 L 7.77 4.22 0.00 1.85 1.73 0.95 1.00 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 0.00 861 G 7.44 3.64 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 0.00 0.00 0.00 862 N 8.39 4.34 0.00 2.75 2.86 0.00 0.00 7.01 7.80 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 0.00 863 R 8.34 4.73 0.00 1.83 1.86 0.00 3.29 0.00 0.00 3.19 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.62 0.00 864 V 8.36 3.71 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 0.57 0.00 0.00 1.06 0.00 0.00 865 D 8.16 4.57 0.00 2.69 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 0.00 866 P 0.00 4.29 0.00 2.39 2.20 0.00 3.68 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.08 0.00 867 L 7.87 3.97 0.00 1.78 1.72 0.92 0.88 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 0.00 868 S 7.93 4.05 0.00 3.73 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 0.00 869 E 7.07 4.28 0.00 1.16 1.12 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 1.47 1.47 0.00 870 E 8.75 3.92 0.00 1.93 1.95 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 2.32 2.20 0.00 871 G 8.01 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 0.00 0.00 0.00 872 W 7.77 4.67 0.00 3.40 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 0.00 873 K 8.17 4.29 0.00 1.92 1.89 0.00 1.71 0.00 0.00 1.64 0.00 0.00 2.95 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.46 1.40 7.81 874 Q 7.37 4.14 0.00 2.13 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.89 0.00 0.00 0.00 0.00 0.00 2.35 2.36 0.00 875 K 8.35 4.24 0.00 1.78 1.71 0.00 1.80 0.00 0.00 1.75 0.00 0.00 3.02 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.44 1.42 7.81 876 P 0.00 4.48 0.00 2.16 2.20 0.00 3.76 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 1.99 1.96 0.00 877 N 8.81 4.54 0.00 2.95 2.90 0.00 0.00 6.74 6.22 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 0.00 878 L 8.29 3.96 0.00 1.69 1.70 0.93 0.56 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 0.00 879 N 8.28 4.31 0.00 2.92 3.09 0.00 0.00 7.03 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 0.00 880 A 8.99 4.31 1.29 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 0.00 0.00 881 I 7.93 3.67 2.06 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 1.43 0.94 0.93 0.00 0.00 882 R 8.41 3.88 0.00 2.07 2.17 0.00 3.12 0.00 0.00 3.20 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.70 0.00 883 S 8.65 4.17 0.00 4.30 4.06 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 0.00 884 L 8.37 3.89 0.00 1.83 1.68 1.05 0.66 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 0.00 885 E 8.79 3.88 0.00 2.22 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 2.32 2.40 0.00 886 A 8.12 3.98 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 0.00 887 V 7.46 3.48 2.13 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 0.98 0.00 0.00 0.85 0.00 0.00 888 I 8.01 3.67 1.99 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 1.39 0.51 0.91 0.00 0.00 889 R 7.96 3.85 0.00 1.88 2.16 0.00 3.26 0.00 0.00 3.15 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.64 0.00 890 V 7.73 3.72 2.20 0.00 0.00 0.00 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 0.98 0.00 0.00 891 H 8.65 4.93 0.00 3.44 3.57 0.00 5.69 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 892 S 8.31 4.14 0.00 4.00 4.34 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 0.00 893 K 7.34 3.80 0.00 1.42 0.87 0.00 1.47 0.00 0.00 1.24 0.00 0.00 2.90 0.00 0.00 2.94 0.00 0.00 0.00 0.00 0.42 1.06 7.81 894 Y 6.96 4.37 0.00 2.74 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 0.00 0.00 0.00 895 W 8.25 4.94 0.00 3.35 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 0.00 896 G 10.37 3.63 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 0.00 0.00 0.00 897 C 8.76 4.34 0.00 3.07 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 0.00 898 M 7.76 4.28 0.00 2.19 2.55 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 2.67 2.68 0.00 899 Q 8.22 4.21 0.00 2.05 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 5.45 0.00 0.00 0.00 0.00 0.00 2.48 2.56 0.00 900 R 8.47 4.22 0.00 1.96 2.35 0.00 3.06 0.00 0.00 3.26 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.54 0.00 * Residues marked with a * may have inaccurate shift predictions.