NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 535 E 4.2718 8.3033 121.4649 56.2165 31.0901 176.0473 536 E 3.8073 8.7045 126.0380 58.5888 30.0268 177.3376 537 T 3.7986 7.9599 112.4162 64.7186 67.7454 175.6445 538 R 3.8552 7.8479 120.6637 59.2747 30.1475 177.7753 539 E 3.8873 7.6325 118.8705 59.0741 29.5363 178.5552 540 L 3.8707 8.1278 120.6822 57.9994 42.2305 178.6356 541 Q 3.9387 8.2783 119.7271 59.4081 28.9184 178.6048 542 S 4.1068 8.1526 116.0803 61.4200 62.6390 176.5142 543 L 3.8968 7.9368 121.8084 58.2099 41.9918 178.6085 544 A 4.1337 8.1984 119.4860 54.7438 18.3655 178.7252 545 A 4.2477 7.7937 117.0393 52.4727 19.4759 177.7999 546 A 4.1703 6.9682 120.2694 51.7391 19.1418 177.5448 547 V 3.8740 8.0794 120.1543 60.9374 32.6280 176.4438 548 V 4.0810 8.0766 123.0210 60.4237 30.9471 173.7648 549 P 4.4584 0.0000 0.0000 62.1632 31.9665 176.9564 550 S 4.3380 8.4410 114.2580 58.2829 64.9423 175.1609 551 A 3.9643 8.4999 124.0957 55.3272 18.1559 179.7661 552 Q 4.0467 8.0784 117.5052 59.8270 29.0149 178.5352 553 T 3.9473 7.7334 115.3499 66.4756 68.5877 175.9842 554 L 4.3092 7.9095 118.4792 54.6070 42.2713 177.6389 555 K 4.0093 7.8448 117.3769 57.0662 30.1977 177.0200 556 I 3.4755 7.3128 110.2944 62.4310 37.4561 176.7883 557 T 4.2385 7.6916 116.9076 64.5724 69.2570 174.4521 558 D 4.5814 7.8579 122.9914 53.4906 41.4322 177.6602 559 F 4.2704 8.6998 122.8568 60.4727 39.1275 176.2830 560 S 4.5090 8.1386 114.1923 58.2866 62.8973 173.8447 561 F 4.0745 7.7625 123.1119 58.8987 39.5061 174.4457 562 S 4.1642 7.0518 119.5674 56.3954 65.3964 173.1341 563 D 4.6721 7.6064 122.8153 52.7064 40.2876 177.7013 564 F 4.4318 7.0595 118.4623 60.9618 38.9366 176.0536 565 E 4.3500 8.1237 114.8649 56.4899 30.0768 175.9391 566 L 4.8156 7.7452 120.5792 53.7086 43.4560 177.0343 567 S 4.6200 8.7804 117.7567 57.2670 65.8758 175.3202 568 D 4.3535 8.4568 121.4099 57.4755 40.5271 178.6137 569 L 3.9030 7.9426 120.1948 58.5080 42.0074 178.8331 570 E 4.0455 8.1435 118.2643 59.5251 29.3120 179.4765 571 T 3.4196 7.8200 109.7751 64.4118 68.7541 176.6144 572 A 4.0730 8.1049 123.6423 54.9912 18.4143 179.6344 573 L 4.0363 8.0563 117.5393 58.1176 41.6615 179.5401 574 C 4.2527 8.2398 116.8052 63.1342 28.1775 176.3036 575 T 4.1844 8.3725 117.5464 66.6816 67.9974 176.8946 576 I 3.8575 8.0684 121.8869 64.4419 37.1474 178.4110 577 R 3.9319 8.1830 119.5427 59.5177 29.9154 178.5009 578 M 3.3012 7.8616 118.4854 58.2969 31.9977 178.6965 579 F 4.0648 8.3405 117.5798 60.7836 39.0894 177.9365 580 T 3.9584 8.5055 115.6533 67.0124 68.1777 176.6611 581 D 4.5897 8.5199 119.2891 56.6511 40.8852 177.7650 582 L 4.4528 7.7773 117.6094 53.9971 41.8568 176.5012 583 N 4.3871 8.1759 115.3449 54.3689 36.9387 176.3192 584 L 4.3029 8.1098 121.6759 57.8515 41.5991 179.5146 585 V 3.7216 7.9239 118.0001 65.8004 31.6577 177.7587 586 Q 3.8913 7.9777 118.8288 59.3436 29.0291 177.5848 587 N 4.2025 8.2204 116.2388 55.1157 38.3761 175.7926 588 F 4.8559 7.3679 116.8320 56.5492 40.6757 175.6055 589 Q 3.2750 7.8389 117.1408 57.2360 26.3177 174.4557 590 M 4.3506 8.0127 117.4085 54.6771 33.6674 177.8437 591 K 4.2762 8.3969 122.6622 55.8041 34.3515 177.3044 592 H 4.0786 8.9457 123.7759 59.7215 29.7811 177.3241 593 E 3.9458 8.1976 118.5430 59.2864 29.2429 179.1684 594 V 3.8142 7.5918 120.0470 65.2503 31.6922 177.5556 595 L 3.8598 7.8925 120.0793 58.2723 41.8867 178.7241 596 C 4.0480 8.0830 116.6017 62.7989 28.0160 176.0502 597 R 3.8338 8.0474 120.2162 59.0620 29.5800 178.2126 598 W 4.4468 8.3949 129.7658 60.0729 30.6324 177.8593 599 I 3.3794 8.1121 119.7991 64.4660 36.4919 178.5112 600 L 3.6750 7.8530 119.5918 57.5674 41.1200 179.8172 601 S 3.9195 7.7288 114.8171 61.2369 63.0295 176.4371 602 V 3.4108 7.3209 121.1825 65.7718 31.2913 177.7480 603 K 3.3165 7.4703 119.3680 59.3860 31.6016 178.5592 604 K 3.9128 7.7254 118.1691 58.9186 32.1825 177.2899 605 N 4.6875 7.7984 115.7761 52.3832 38.5986 173.8314 606 Y 4.7201 7.1360 117.5881 56.2508 40.5449 175.5476 607 R 4.5195 8.3476 121.2930 54.4020 30.9792 177.5437 608 K 4.1757 8.6966 125.2225 58.6638 32.4678 177.4923 609 N 4.4528 8.0734 114.8872 54.7454 37.6796 175.0661 610 V 3.8750 7.6676 119.8423 61.8392 31.9751 174.9641 611 A 4.1978 9.1885 131.9553 55.3164 18.4447 176.8796 612 Y 4.5103 8.1329 112.3701 59.6782 40.3957 176.8047 613 H 4.3301 8.8674 119.1831 54.9596 26.8872 173.8235 614 N 5.1680 7.4318 120.1961 49.8485 41.0339 175.4539 615 W 3.6465 8.9780 126.0939 61.0081 30.3642 178.0928 616 R 3.5381 7.9487 117.1885 59.2523 29.3688 178.4224 617 H 3.8559 7.7935 117.9275 58.9847 29.8330 177.1990 618 A 3.6507 7.0853 122.0748 54.8931 18.0436 179.2950 619 F 3.5802 7.5740 119.3200 61.3876 39.2534 177.0988 620 N 3.9714 8.0863 116.3165 56.4514 38.2523 177.5447 621 T 3.8967 7.8883 117.2763 66.5288 68.4320 176.6075 622 A 3.9174 7.8357 122.7029 54.9670 18.3867 179.3976 623 Q 3.5118 7.7182 118.3109 59.3861 29.0036 178.1592 624 C 4.1774 8.0965 119.7664 62.5531 31.5117 175.2074 625 M 4.0118 7.8974 119.9075 58.4913 31.8137 177.9209 626 F 3.9796 8.5089 120.9367 61.3060 39.5806 176.9407 627 A 3.5900 8.4263 120.5150 54.9772 18.1634 179.5027 628 A 4.4121 8.5007 119.6906 55.1778 18.4334 179.9957 629 L 4.0022 7.8964 117.7328 57.7881 41.7893 178.6572 630 K 3.9024 8.3578 118.9959 57.4754 31.2008 178.7327 631 A 4.0360 8.1952 125.7403 55.6861 19.1222 178.8665 632 G 3.9366 8.4829 103.2926 45.7545 0.0000 173.6109 633 K 3.9270 8.3978 118.1727 57.3361 30.4448 177.0826 634 I 4.0648 7.6839 121.2810 63.6161 37.0021 177.3156 635 Q 3.9517 7.9537 121.0757 59.6863 28.5504 178.7237 636 N 4.5185 8.1312 114.7487 55.2520 38.7230 176.2672 637 K 4.4330 7.9450 118.4376 55.4924 32.6574 175.7365 638 L 5.0167 7.1906 118.4867 52.4780 45.6915 176.4539 639 T 4.4706 8.6001 111.2238 60.7981 71.5218 175.6859 640 D 4.4906 8.5283 120.6935 57.6136 40.8164 179.0849 641 L 3.9921 8.0391 119.0641 57.7304 41.5887 179.2627 642 E 3.9994 8.1920 118.2919 59.4138 29.4044 179.4294 643 I 3.7117 7.9316 119.9433 64.0981 37.2706 178.2410 644 L 3.8562 8.2507 121.2040 58.0903 41.9141 178.9266 645 A 3.9863 8.0622 120.6805 55.0745 18.3244 179.5565 646 L 3.9071 8.1280 117.7145 57.8294 41.7129 179.5045 647 L 3.8821 7.8194 120.1392 58.2357 41.9780 179.0877 648 I 4.0796 7.7004 119.1157 64.3601 37.0691 178.2449 649 A 4.1061 8.5700 121.7780 55.1664 18.0508 179.2376 650 A 3.9609 8.3431 118.1188 55.7292 18.5407 179.7386 651 L 4.2179 8.0486 115.6499 57.3100 42.1028 178.9425 652 S 4.8265 8.4302 113.6857 58.9598 63.4026 175.5894 653 H 4.4481 8.8401 118.3853 57.8764 28.2389 175.5596 654 D 4.4998 7.8234 119.8710 53.4508 41.7406 175.2638 655 L 2.8884 7.4460 118.9848 56.4608 41.8485 176.8162 656 D 4.3945 8.3204 120.5817 54.9743 40.3489 173.0407 657 H 4.2380 8.0132 116.7864 56.6214 30.0911 175.2243 658 R 4.4825 8.4848 123.5809 55.5510 30.9500 176.4282 659 G 4.2516 8.7662 107.2358 44.9802 0.0000 175.4461 660 V 3.6423 8.8705 116.6689 64.3514 31.7116 177.0391 661 N 4.7117 8.1453 114.1452 52.9188 38.5718 173.6711 662 N 4.8718 8.2192 118.3385 52.5017 40.2100 175.4048 663 S 4.6487 8.4895 119.8921 58.9020 63.7193 175.0171 664 Y 3.8393 8.6713 123.2364 61.2094 38.1321 177.8538 665 I 3.7023 7.9513 120.8529 64.9891 37.2684 178.0101 666 Q 4.1125 7.9226 117.9087 58.8089 28.5632 178.0995 667 R 4.1291 8.0314 117.1096 57.3704 30.4108 177.9366 668 S 4.2085 7.6597 113.1606 58.3106 63.7057 173.2573 669 E 4.4405 7.1608 122.9997 54.4297 31.5012 174.9403 670 H 3.9910 8.8343 120.7073 58.3247 28.0814 176.7638 671 P 3.3434 0.0000 0.0000 63.3852 33.6859 176.4383 672 L 4.5001 8.0103 120.9726 55.4647 40.8056 179.1411 673 A 4.4482 8.6723 124.2817 54.4825 18.6255 180.9686 674 Q 4.1623 8.1595 114.6018 58.6910 28.9181 177.5668 675 L 4.1989 7.2888 114.9099 56.4246 41.7783 176.9265 676 Y 3.8522 7.1591 116.6718 59.8016 37.9543 175.8830 677 C 4.3251 7.1351 129.4492 58.9227 30.7177 173.1856 678 H 4.4910 8.3352 125.0873 55.9908 30.8458 174.2693 679 S 3.8717 8.3147 114.7817 59.3080 60.3585 174.2496 680 I 3.7024 7.9225 121.4272 64.7190 37.8095 176.1012 681 M 3.9789 7.9739 118.6100 58.6064 31.8570 178.4228 682 E 4.1665 8.2398 118.0901 59.8701 29.5409 179.0802 683 H 4.2460 8.3624 116.3355 58.9259 28.6631 177.3559 684 H 4.1743 8.1501 119.8421 59.6490 29.6721 176.9443 685 H 4.1514 8.4542 118.4356 58.9138 28.5643 177.5574 686 F 4.1692 8.5704 122.4274 61.4386 39.2227 176.7713 687 D 4.2242 8.4696 118.7788 57.4647 40.5850 178.9546 688 Q 3.8423 8.1240 118.5101 58.9354 28.7235 178.2174 689 C 3.9969 8.0132 119.8497 62.5274 31.6602 175.4102 690 L 3.8163 7.8002 121.9994 58.3793 41.3653 178.7853 691 M 4.0647 7.8514 117.6114 58.4823 32.2906 178.5415 692 I 3.8824 7.7613 119.9376 64.3794 36.8617 178.5169 693 L 4.3077 8.3878 119.5848 56.9768 41.2134 178.1585 694 N 4.8786 7.5883 113.4358 52.1457 39.8703 175.4108 695 S 4.3151 7.4876 118.2558 57.2435 63.6227 172.0543 696 P 4.4213 0.0000 0.0000 64.2693 31.0589 176.9854 697 G 3.9472 8.9867 108.6253 46.0177 0.0000 173.9059 698 N 5.0958 8.0379 115.7625 53.0738 40.0285 175.0680 699 Q 4.8319 7.9794 119.3569 54.5848 26.6658 176.5475 700 I 3.7927 7.4966 112.2150 62.3252 38.4023 177.6146 701 L 4.5484 7.5753 120.7973 54.4560 41.9274 178.1370 702 S 4.1048 7.9346 115.5210 60.8486 62.9109 175.9783 703 G 3.7567 7.9589 108.9252 47.5284 0.0000 174.0138 704 L 4.5207 7.5684 119.8449 54.2827 42.4528 177.4551 705 S 4.5145 9.0437 116.9121 57.7023 65.4033 175.1290 706 I 3.7666 8.3040 121.6830 64.5647 37.6610 177.7560 707 E 4.0648 8.1606 118.8536 59.3456 29.3493 178.9094 708 E 4.0313 8.1626 118.2741 59.3940 29.4977 178.7357 709 Y 4.0745 8.4958 119.9498 60.8346 38.9425 178.3151 710 K 3.8990 8.2501 119.3101 59.6961 32.1164 179.5805 711 T 3.8413 7.7858 115.5126 66.7962 68.3657 176.9800 712 T 3.7786 7.9908 117.7195 66.6596 68.4277 176.5161 713 L 3.9405 7.9142 121.2440 57.7969 41.6190 179.6405 714 K 3.8079 7.8943 119.2404 59.6166 32.1008 178.9785 715 I 3.8613 7.7681 120.0399 64.3529 36.9242 178.5239 716 I 3.7529 8.1940 121.1820 64.1497 36.8645 178.4001 717 K 3.3764 8.2039 120.7317 59.4720 31.8650 178.9026 718 Q 3.8629 8.0323 118.0565 58.7456 28.3570 178.5912 719 A 3.9413 8.0819 121.2395 55.3474 18.7406 179.5170 720 I 3.9273 8.0103 118.3803 64.5144 37.2354 178.6964 721 L 4.0020 8.2698 119.9653 57.6622 41.1761 179.3557 722 A 4.1113 8.0812 120.3338 54.9271 18.3288 178.9382 723 T 4.3027 7.5539 106.0000 61.8433 69.1367 174.0589 724 D 4.7403 8.0534 123.4492 53.6438 41.1096 176.5640 725 L 4.1487 8.8409 127.9524 57.9606 41.4045 179.3183 726 A 4.0421 8.7088 121.1431 55.2084 18.2926 179.6672 727 L 3.9919 8.2044 117.6345 57.6730 41.5909 179.0317 728 Y 4.0639 7.9018 119.1735 60.9408 38.6747 178.1459 729 I 3.2487 7.7903 119.3509 63.8633 37.1551 178.0492 730 K 4.0403 7.5195 120.1750 58.5965 32.0561 178.1688 731 R 4.3889 7.7906 116.7504 56.3324 30.9084 178.4416 732 R 3.5350 7.8050 117.2453 58.8768 29.1033 178.8288 733 G 3.7086 7.8146 105.8654 47.7589 0.0000 174.9829 734 E 3.9986 7.8058 121.3574 58.8502 29.5361 178.6579 735 F 4.3915 8.0162 120.1990 61.4348 39.5208 177.0007 736 F 4.3303 8.2324 117.8388 60.4996 38.5833 177.2388 737 E 3.9629 8.7650 119.3727 59.4641 29.4401 178.9760 738 L 4.0926 8.4104 119.1514 57.6259 41.7167 179.4848 739 I 3.8303 7.3601 120.1074 63.7306 36.8794 178.3135 740 R 3.8163 7.7092 118.1443 59.5001 29.9391 178.1782 741 K 4.1391 7.7376 113.5755 56.5863 32.1102 176.6985 742 N 4.2034 7.6289 115.3513 55.1319 36.3356 174.6511 743 Q 4.5761 8.3879 113.3440 55.3617 29.9573 176.2699 744 F 4.5893 8.1283 121.4822 58.2563 40.1848 174.0209 745 N 4.5162 8.8827 126.3998 51.9367 40.7113 174.6195 746 L 3.9469 7.9781 125.5534 56.0161 42.1266 178.0081 747 E 4.0041 7.8851 119.5550 58.0998 30.2706 176.7470 748 D 4.7327 7.4960 119.0947 51.4026 41.6189 175.2483 749 P 4.2123 0.0000 0.0000 66.5385 30.9185 177.9395 750 H 4.1019 8.2640 117.0563 59.3826 29.8070 177.2074 751 Q 4.1186 8.1038 118.1895 58.4153 28.3823 178.6008 752 K 4.0114 7.9416 120.8378 59.4682 32.3038 178.4910 753 E 3.9017 8.3394 119.7024 59.1960 29.5514 178.5333 754 L 3.8857 7.8744 120.4857 57.8821 42.1204 178.8029 755 F 3.9017 8.5543 121.0157 61.3056 39.4522 177.0058 756 L 3.7443 8.2214 118.6107 57.7507 41.4840 179.5435 757 A 3.8918 7.7962 120.5099 55.3655 18.3156 179.6529 758 M 3.8522 7.5781 117.2406 58.1568 31.8961 178.7732 759 L 3.6464 7.7852 120.7702 58.2014 42.1736 178.7931 760 M 3.9341 7.8243 118.5680 58.8308 31.9203 178.8930 761 T 3.6993 7.6168 115.0513 66.5059 68.3204 176.4542 762 A 3.6984 7.5503 121.5634 55.4051 18.6343 179.1977 763 C 4.3130 8.1414 115.1635 62.8076 28.0213 175.7762 764 D 4.4346 8.1853 119.0063 56.4217 41.1007 177.2247 765 L 4.7821 7.8562 117.5766 54.4374 42.1847 178.0656 766 S 4.3848 8.2493 116.7371 60.2653 62.3797 176.1669 767 A 4.0372 8.2040 124.2554 54.9494 17.9255 178.6472 768 I 4.0089 8.0350 116.0671 63.0164 38.5760 176.2850 769 T 4.2264 7.9131 108.8606 61.7829 69.5600 174.9787 770 K 4.4796 7.4657 121.6635 55.3390 32.8857 175.4463 771 P 4.3752 0.0000 0.0000 62.4651 32.9782 177.1206 772 W 4.9071 8.9518 131.6647 60.6213 30.7420 176.6639 773 P 3.9668 0.0000 0.0000 65.6922 30.5582 178.4725 774 I 3.9506 7.5830 119.0294 64.3269 37.1734 177.7570 775 Q 4.0342 8.4029 120.7901 59.4800 28.7010 178.2765 776 Q 3.8367 7.7639 119.0536 59.1089 28.6485 179.5724 777 R 4.0520 7.4441 117.4250 59.3742 30.2296 179.1556 778 L 4.1729 8.3406 118.5647 57.6549 41.4531 179.4883 779 A 3.8566 8.5002 121.3701 54.7895 18.1777 179.4285 780 E 3.8885 7.8261 117.3391 59.5812 29.5990 179.4922 781 L 3.9628 7.6586 118.3102 57.8675 41.7504 179.7527 782 V 3.0011 7.3099 117.6954 65.7569 31.2242 177.8852 783 A 3.8535 8.0064 120.7344 55.2887 18.1164 179.7433 784 T 4.0244 8.1737 114.5739 66.9298 68.3678 176.5092 785 E 4.1883 7.9531 119.7159 59.2422 29.6947 178.6689 786 F 4.2739 8.0608 117.0342 60.2422 39.0234 176.8926 787 F 4.8167 7.9763 115.3804 59.3793 39.7435 177.0960 788 D 4.5924 8.1005 116.4818 56.6872 41.2893 177.1383 789 Q 4.3022 8.2796 117.0761 55.5194 29.4914 174.5305 790 G 3.3765 8.9849 109.2407 44.6405 0.0000 173.9550 791 D 5.8342 7.1613 134.9463 55.1147 44.1576 176.9531 792 R 4.4400 7.2782 118.5234 55.6672 29.4741 176.0107 *808 E 4.0583 8.4939 116.6837 55.4883 30.5947 175.5621 809 K 3.8356 8.9371 124.2744 59.5492 32.7738 179.1674 810 K 3.9415 8.1608 117.9750 60.0098 31.7462 178.2251 811 N 4.0819 8.2581 114.4304 56.8183 38.8271 177.0599 812 K 4.0937 8.2517 119.3754 58.7899 31.9570 179.5477 813 I 3.5272 8.2809 121.4347 63.6220 37.0462 176.2951 814 P 4.0576 0.0000 0.0000 66.1609 30.9103 178.4853 815 S 4.1607 7.9864 113.9046 60.9179 62.9210 175.8598 816 M 4.0162 7.8776 121.4849 58.7179 32.0479 178.3388 817 Q 3.8982 8.0446 118.5029 58.6897 28.6144 178.9253 818 V 3.8099 7.8772 119.7016 65.8361 31.6043 178.3795 819 G 3.6354 8.4095 105.7991 47.6646 0.0000 175.3874 820 F 4.3556 8.5669 123.4135 61.1719 39.3593 177.2901 821 I 3.5453 7.9649 119.2537 64.4289 36.7137 178.0923 822 D 4.3112 8.0548 118.0360 57.5570 40.8273 178.5545 823 A 4.1820 8.0524 119.8800 54.3455 18.4378 178.0351 824 I 4.4195 7.6090 116.0350 62.9569 39.7371 177.5385 825 C 4.1551 7.6795 117.1643 62.3987 28.3276 175.4485 826 L 3.9812 8.0610 120.9248 58.4288 41.2892 179.7760 827 Q 3.7565 7.9986 116.8490 58.6723 28.5230 178.6076 828 L 4.2605 7.9442 120.7420 58.7368 41.9257 178.6651 829 Y 4.1925 7.7267 116.3912 60.7257 37.6979 178.4493 830 E 3.9707 8.3262 119.7076 59.2676 29.6036 178.9514 831 A 3.9737 8.3731 121.2137 55.2306 18.4616 179.3846 832 L 4.1823 8.4586 119.1168 58.8056 41.9372 179.3245 833 T 4.1195 7.8704 114.7086 66.9257 68.3979 176.0552 834 H 4.3957 7.7306 117.0075 58.8560 28.8101 177.6503 835 V 4.0031 7.4714 118.5646 64.5333 31.6641 176.0500 836 S 4.4721 8.3109 114.1558 56.5521 64.6649 173.6864 837 E 4.0856 9.1651 128.7587 59.9174 29.3034 179.0509 838 D 4.6706 8.1368 115.6203 56.2546 41.2288 176.3353 839 C 4.3406 8.3020 117.1616 59.4827 28.8189 174.9502 840 F 4.1483 8.2285 124.2581 61.1024 38.7945 175.2028 841 P 4.0585 0.0000 0.0000 65.8698 30.5989 178.3086 842 L 3.5052 7.0630 118.3215 57.3030 41.4582 179.1657 843 L 3.7060 7.3161 119.6657 57.9366 42.0465 178.0910 844 D 4.0088 7.6318 118.3517 57.2900 41.0435 178.4594 845 G 3.9072 7.9184 107.7307 47.3902 0.0000 175.1111 846 C 4.2616 7.7296 120.9029 62.1893 31.5473 175.9799 847 R 3.8681 8.0093 119.7142 59.1575 29.7066 179.0093 848 K 3.8379 8.1433 118.5009 59.7247 31.9677 179.1555 849 N 4.2754 8.1650 116.5953 56.0485 38.3354 177.4845 850 R 4.0152 7.9327 120.2481 59.4006 30.2332 178.1703 851 Q 3.8885 7.9937 119.2673 59.2005 28.9976 178.5696 852 K 3.3263 7.5883 119.0938 59.1423 31.7714 179.4684 853 W 4.5711 8.0833 119.3549 59.8001 28.9592 178.4459 854 Q 4.0262 8.6630 119.8187 59.1422 28.2965 178.0498 855 A 4.0091 7.8102 120.7364 55.2721 18.6429 179.3428 856 L 4.1552 7.8773 116.8529 57.7011 41.4945 179.3698 857 A 4.1117 8.2334 120.4529 55.3222 18.4824 178.9823 858 E 4.2597 8.1079 113.8320 55.8419 29.7154 173.1768 859 Q 3.8526 8.1238 126.3858 55.5289 27.9269 173.5549 860 Q 4.1954 8.6005 120.6123 56.0687 28.9182 176.0387 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 535 E 8.30 4.27 0.00 2.04 1.87 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 2.25 2.38 0.00 536 E 8.70 3.81 0.00 2.09 1.91 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 2.30 2.38 0.00 537 T 7.96 3.80 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 1.19 0.00 0.00 538 R 7.85 3.86 0.00 1.89 1.87 0.00 3.22 0.00 0.00 3.24 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.66 0.00 539 E 7.63 3.89 0.00 2.11 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 2.23 2.25 0.00 540 L 8.13 3.87 0.00 1.74 1.79 0.88 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 541 Q 8.28 3.94 0.00 2.23 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.58 0.00 0.00 0.00 0.00 0.00 2.35 2.40 0.00 542 S 8.15 4.11 0.00 4.02 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 543 L 7.94 3.90 0.00 1.57 1.72 0.91 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 544 A 8.20 4.13 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 0.00 545 A 7.79 4.25 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 0.00 546 A 6.97 4.17 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 0.00 547 V 8.08 3.87 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 0.74 0.00 0.00 0.94 0.00 0.00 548 V 8.08 4.08 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 0.93 0.00 0.00 0.99 0.00 0.00 549 P 0.00 4.46 0.00 2.25 2.07 0.00 3.86 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 1.99 0.00 550 S 8.44 4.34 0.00 4.10 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 0.00 551 A 8.50 3.96 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 0.00 552 Q 8.08 4.05 0.00 2.16 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.84 0.00 0.00 0.00 0.00 0.00 2.46 2.49 0.00 553 T 7.73 3.95 4.42 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 1.24 0.00 0.00 554 L 7.91 4.31 0.00 1.65 1.79 0.99 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 555 K 7.84 4.01 0.00 2.27 2.23 0.00 1.73 0.00 0.00 1.74 0.00 0.00 2.96 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.42 1.61 7.81 556 I 7.31 3.48 1.35 0.00 0.00 0.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.43 0.55 0.00 0.00 557 T 7.69 4.24 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 1.09 0.00 0.00 558 D 7.86 4.58 0.00 2.92 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 0.00 559 F 8.70 4.27 0.00 3.05 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 0.00 560 S 8.14 4.51 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 0.00 561 F 7.76 4.07 0.00 3.05 3.09 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 0.00 562 S 7.05 4.16 0.00 3.47 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 0.00 563 D 7.61 4.67 0.00 2.95 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 0.00 564 F 7.06 4.43 0.00 3.08 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.12 4.35 0.00 2.09 2.08 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 2.24 2.26 0.00 566 L 7.75 4.82 0.00 1.76 1.65 1.17 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 567 S 8.78 4.62 0.00 4.04 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 0.00 568 D 8.46 4.35 0.00 2.66 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 0.00 569 L 7.94 3.90 0.00 1.72 1.66 0.90 0.97 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 0.00 570 E 8.14 4.05 0.00 2.34 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 2.35 2.33 0.00 571 T 7.82 3.42 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 0.96 0.00 0.00 572 A 8.10 4.07 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 0.00 573 L 8.06 4.04 0.00 1.91 1.77 0.94 0.87 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 0.00 574 C 8.24 4.25 0.00 3.56 3.20 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 0.00 0.00 0.00 0.00 575 T 8.37 4.18 4.69 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 1.77 0.00 0.00 576 I 8.07 3.86 2.10 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.93 0.99 0.00 0.00 577 R 8.18 3.93 0.00 1.93 2.03 0.00 3.37 0.00 0.00 3.24 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.53 0.00 578 M 7.86 3.30 0.00 1.93 2.21 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.38 1.62 0.00 579 F 8.34 4.06 0.00 3.37 3.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 580 T 8.51 3.96 4.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 581 D 8.52 4.59 0.00 2.97 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 0.00 582 L 7.78 4.45 0.00 1.78 1.74 1.01 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 583 N 8.18 4.39 0.00 2.94 2.88 0.00 0.00 7.02 6.09 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 0.00 584 L 8.11 4.30 0.00 2.10 2.04 0.74 0.95 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 0.00 585 V 7.92 3.72 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.00 0.00 1.06 0.00 0.00 586 Q 7.98 3.89 0.00 2.16 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.66 0.00 0.00 0.00 0.00 0.00 2.38 2.43 0.00 587 N 8.22 4.20 0.00 2.24 1.92 0.00 0.00 6.94 7.06 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 0.00 588 F 7.37 4.86 0.00 3.19 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 7.84 3.27 0.00 2.19 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.16 6.82 0.00 0.00 0.00 0.00 0.00 2.32 2.34 0.00 590 M 8.01 4.35 0.00 1.99 2.01 0.00 0.00 0.00 0.00 0.00 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.74 2.70 0.00 591 K 8.40 4.28 0.00 1.80 1.73 0.00 1.69 0.00 0.00 1.75 0.00 0.00 2.88 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.53 1.49 7.81 592 H 8.95 4.08 0.00 3.23 3.34 0.00 5.87 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 0.00 593 E 8.20 3.95 0.00 2.19 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 2.36 2.31 0.00 594 V 7.59 3.81 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 1.35 0.00 0.00 0.93 0.00 0.00 595 L 7.89 3.86 0.00 1.66 1.69 0.16 0.59 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 0.00 596 C 8.08 4.05 0.00 3.11 2.89 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 0.00 597 R 8.05 3.83 0.00 2.05 2.18 0.00 3.18 0.00 0.00 3.08 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.61 0.00 598 W 8.39 4.45 0.00 3.56 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 0.00 599 I 8.11 3.38 1.99 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 1.82 0.95 0.86 0.00 0.00 600 L 7.85 3.68 0.00 1.71 1.54 0.83 0.55 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 0.00 601 S 7.73 3.92 0.00 3.70 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 0.00 602 V 7.32 3.41 1.66 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 1.16 0.00 0.00 -0.43 0.00 0.00 603 K 7.47 3.32 0.00 0.79 1.24 0.00 1.17 0.00 0.00 0.72 0.00 0.00 2.49 0.00 0.00 2.60 0.00 0.00 0.00 0.00 0.85 0.21 7.81 604 K 7.73 3.91 0.00 1.71 1.88 0.00 1.86 0.00 0.00 1.61 0.00 0.00 2.98 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.37 1.40 7.81 605 N 7.80 4.69 0.00 2.79 2.59 0.00 0.00 6.71 7.38 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 0.00 606 Y 7.14 4.72 0.00 3.24 3.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 607 R 8.35 4.52 0.00 1.93 2.20 0.00 3.41 0.00 0.00 3.26 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.61 0.00 608 K 8.70 4.18 0.00 1.76 1.87 0.00 1.81 0.00 0.00 1.78 0.00 0.00 3.10 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.46 1.48 7.81 609 N 8.07 4.45 0.00 2.89 2.95 0.00 0.00 6.00 7.68 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 0.00 610 V 7.67 3.88 2.41 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 0.91 0.00 0.00 1.10 0.00 0.00 611 A 9.19 4.20 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 0.00 612 Y 8.13 4.51 0.00 2.73 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 0.00 613 H 8.87 4.33 0.00 3.03 3.13 0.00 5.85 0.00 0.00 0.00 0.00 7.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 614 N 7.43 5.17 0.00 2.94 3.19 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 0.00 615 W 8.98 3.65 0.00 3.32 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 0.00 616 R 7.95 3.54 0.00 1.95 2.02 0.00 3.54 0.00 0.00 3.08 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.71 0.00 617 H 7.79 3.86 0.00 2.41 3.05 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 0.00 618 A 7.09 3.65 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 619 F 7.57 3.58 0.00 1.51 2.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 620 N 8.09 3.97 0.00 2.85 2.78 0.00 0.00 7.09 6.81 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 0.00 621 T 7.89 3.90 4.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.00 0.00 622 A 7.84 3.92 1.28 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 0.00 623 Q 7.72 3.51 0.00 1.14 1.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.74 0.00 0.00 0.00 0.00 0.00 1.53 1.16 0.00 624 C 8.10 4.18 0.00 3.12 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 0.00 625 M 7.90 4.01 0.00 2.31 2.01 0.00 0.00 0.00 0.00 0.00 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.57 0.00 626 F 8.51 3.98 0.00 3.00 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 0.00 627 A 8.43 3.59 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 628 A 8.50 4.41 1.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 7.90 4.00 0.00 1.65 1.58 0.89 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 630 K 8.36 3.90 0.00 1.27 1.33 0.00 1.49 0.00 0.00 1.50 0.00 0.00 2.64 0.00 0.00 2.89 0.00 0.00 0.00 0.00 0.42 0.52 7.81 631 A 8.20 4.04 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 632 G 8.48 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 0.00 0.00 0.00 633 K 8.40 3.93 0.00 1.89 1.90 0.00 2.07 0.00 0.00 1.72 0.00 0.00 2.99 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.39 1.59 7.81 634 I 7.68 4.06 2.06 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.08 1.16 0.00 0.00 635 Q 7.95 3.95 0.00 2.09 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.81 0.00 0.00 0.00 0.00 0.00 2.36 2.42 0.00 636 N 8.13 4.52 0.00 2.74 2.87 0.00 0.00 6.87 7.61 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 0.00 637 K 7.94 4.43 0.00 1.86 1.81 0.00 1.64 0.00 0.00 1.64 0.00 0.00 3.02 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.43 1.49 7.81 638 L 7.19 5.02 0.00 1.62 1.70 1.03 1.47 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 0.00 639 T 8.60 4.47 4.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 640 D 8.53 4.49 0.00 2.86 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 0.00 641 L 8.04 3.99 0.00 1.73 1.71 0.97 0.94 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 0.00 642 E 8.19 4.00 0.00 2.23 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 2.35 2.38 0.00 643 I 7.93 3.71 2.06 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 1.43 0.74 0.92 0.00 0.00 644 L 8.25 3.86 0.00 1.80 1.80 0.87 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 645 A 8.06 3.99 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 0.00 646 L 8.13 3.91 0.00 1.83 1.71 0.91 0.72 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 0.00 647 L 7.82 3.88 0.00 1.67 1.38 0.82 0.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 648 I 7.70 4.08 2.08 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 1.36 0.55 1.20 0.00 0.00 649 A 8.57 4.11 1.44 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 0.00 0.00 0.00 0.00 0.00 0.00 650 A 8.34 3.96 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 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1.80 0.00 659 G 8.77 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 0.00 0.00 0.00 660 V 8.87 3.64 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 1.05 0.00 0.00 1.04 0.00 0.00 661 N 8.15 4.71 0.00 2.73 2.84 0.00 0.00 6.74 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 0.00 662 N 8.22 4.87 0.00 2.78 2.88 0.00 0.00 6.99 7.68 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 0.00 663 S 8.49 4.65 0.00 3.90 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 0.00 664 Y 8.67 3.84 0.00 3.04 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 0.00 665 I 7.95 3.70 1.83 0.00 0.00 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 1.61 0.72 0.68 0.00 0.00 666 Q 7.92 4.11 0.00 2.17 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.97 0.00 0.00 0.00 0.00 0.00 2.42 2.42 0.00 667 R 8.03 4.13 0.00 1.71 1.86 0.00 3.24 0.00 0.00 3.24 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.58 0.00 668 S 7.66 4.21 0.00 3.82 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 E 7.16 4.44 0.00 1.93 1.89 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 2.26 2.23 0.00 670 H 8.83 3.99 0.00 3.12 3.21 0.00 5.79 0.00 0.00 0.00 0.00 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 671 P 0.00 3.34 0.00 2.27 2.20 0.00 3.49 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 1.96 2.04 0.00 672 L 8.01 4.50 0.00 1.92 1.88 1.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 673 A 8.67 4.45 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 0.00 674 Q 8.16 4.16 0.00 2.04 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.98 0.00 0.00 0.00 0.00 0.00 2.35 2.38 0.00 675 L 7.29 4.20 0.00 1.32 1.52 0.84 0.81 0.00 0.00 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0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 684 H 8.15 4.17 0.00 3.27 3.47 0.00 5.79 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 685 H 8.45 4.15 0.00 3.43 3.41 0.00 5.67 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 686 F 8.57 4.17 0.00 3.19 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 0.00 687 D 8.47 4.22 0.00 2.86 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 0.00 688 Q 8.12 3.84 0.00 2.14 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.78 0.00 0.00 0.00 0.00 0.00 2.24 2.29 0.00 689 C 8.01 4.00 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 0.00 690 L 7.80 3.82 0.00 1.00 1.45 0.94 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 691 M 7.85 4.06 0.00 1.99 2.17 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 2.81 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0.00 0.00 -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 0.61 0.09 0.60 0.00 0.00 701 L 7.58 4.55 0.00 1.82 1.84 0.98 0.71 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 0.00 702 S 7.93 4.10 0.00 3.94 4.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 703 G 7.96 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 0.00 0.00 0.00 704 L 7.57 4.52 0.00 1.86 1.69 0.77 0.82 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 0.00 705 S 9.04 4.51 0.00 4.07 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 0.00 706 I 8.30 3.77 1.89 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.27 0.95 0.00 0.00 707 E 8.16 4.06 0.00 2.06 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 2.43 2.37 0.00 708 E 8.16 4.03 0.00 2.36 2.06 0.00 0.00 0.00 0.00 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0.00 0.00 791 D 7.16 5.83 0.00 2.79 2.75 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 0.00 792 R 7.28 4.44 0.00 1.97 1.45 0.00 3.49 0.00 0.00 3.18 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.60 0.00 *808 E 8.49 4.06 0.00 1.95 1.85 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 2.18 2.43 0.00 809 K 8.94 3.84 0.00 1.74 1.74 0.00 1.88 0.00 0.00 1.68 0.00 0.00 3.09 0.00 0.00 3.29 0.00 0.00 0.00 0.00 1.42 1.34 7.81 810 K 8.16 3.94 0.00 1.84 1.92 0.00 1.78 0.00 0.00 1.87 0.00 0.00 2.95 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.58 1.60 7.81 811 N 8.26 4.08 0.00 2.64 2.91 0.00 0.00 6.93 7.61 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 0.00 812 K 8.25 4.09 0.00 1.52 1.67 0.00 1.28 0.00 0.00 0.61 0.00 0.00 2.70 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.27 1.49 7.81 813 I 8.28 3.53 1.93 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 1.56 0.75 0.32 0.00 0.00 814 P 0.00 4.06 0.00 2.44 2.74 0.00 3.76 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 2.24 2.17 0.00 815 S 7.99 4.16 0.00 4.09 4.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 816 M 7.88 4.02 0.00 2.25 2.23 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 2.66 2.50 0.00 817 Q 8.04 3.90 0.00 1.09 1.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.59 0.00 0.00 0.00 0.00 0.00 1.64 1.16 0.00 818 V 7.88 3.81 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 1.19 0.00 0.00 1.13 0.00 0.00 819 G 8.41 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 0.00 0.00 0.00 820 F 8.57 4.36 0.00 3.15 3.26 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 0.00 821 I 7.96 3.55 2.07 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 1.62 0.90 0.94 0.00 0.00 822 D 8.05 4.31 0.00 2.67 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 0.00 823 A 8.05 4.18 1.42 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 0.00 0.00 824 I 7.61 4.42 1.54 0.00 0.00 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 1.15 0.81 0.00 0.00 825 C 7.68 4.16 0.00 3.00 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 0.00 826 L 8.06 3.98 0.00 1.64 1.73 0.96 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 827 Q 8.00 3.76 0.00 1.97 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.91 0.00 0.00 0.00 0.00 0.00 2.11 2.26 0.00 828 L 7.94 4.26 0.00 1.90 1.53 1.07 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 829 Y 7.73 4.19 0.00 3.14 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 0.00 830 E 8.33 3.97 0.00 2.11 1.93 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 2.32 2.62 0.00 831 A 8.37 3.97 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 0.00 832 L 8.46 4.18 0.00 1.97 1.98 1.16 0.90 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 0.00 833 T 7.87 4.12 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 1.34 0.00 0.00 834 H 7.73 4.40 0.00 3.23 3.28 0.00 5.66 0.00 0.00 0.00 0.00 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 835 V 7.47 4.00 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 0.71 0.00 0.00 0.89 0.00 0.00 836 S 8.31 4.47 0.00 3.93 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 0.00 837 E 9.17 4.09 0.00 2.06 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 2.31 0.00 838 D 8.14 4.67 0.00 2.94 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 0.00 839 C 8.30 4.34 0.00 3.19 2.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 840 F 8.23 4.15 0.00 3.23 3.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 841 P 0.00 4.06 0.00 2.10 2.28 0.00 3.71 0.00 0.00 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 2.16 0.00 842 L 7.06 3.51 0.00 1.60 1.15 0.96 0.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.66 0.00 0.00 0.00 0.00 0.00 0.00 843 L 7.32 3.71 0.00 1.72 1.58 0.92 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 844 D 7.63 4.01 0.00 1.58 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 845 G 7.92 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 846 C 7.73 4.26 0.00 2.77 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 0.00 847 R 8.01 3.87 0.00 1.98 1.91 0.00 3.12 0.00 0.00 3.15 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.73 0.00 848 K 8.14 3.84 0.00 1.86 1.77 0.00 1.60 0.00 0.00 1.60 0.00 0.00 2.90 0.00 0.00 3.30 0.00 0.00 0.00 0.00 1.39 1.56 7.81 849 N 8.16 4.28 0.00 3.02 3.16 0.00 0.00 6.69 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 0.00 850 R 7.93 4.02 0.00 1.96 2.08 0.00 3.13 0.00 0.00 3.11 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.71 0.00 851 Q 7.99 3.89 0.00 2.09 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.58 0.00 0.00 0.00 0.00 0.00 2.20 2.32 0.00 852 K 7.59 3.33 0.00 0.79 0.74 0.00 0.61 0.00 0.00 0.93 0.00 0.00 2.53 0.00 0.00 2.27 0.00 0.00 0.00 0.00 0.86 0.21 7.81 853 W 8.08 4.57 0.00 3.47 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 0.00 854 Q 8.66 4.03 0.00 2.38 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.79 0.00 0.00 0.00 0.00 0.00 2.41 2.55 0.00 855 A 7.81 4.01 1.28 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 0.00 856 L 7.88 4.16 0.00 2.19 1.95 1.23 1.37 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 0.00 857 A 8.23 4.11 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 0.00 858 E 8.11 4.26 0.00 1.98 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 2.36 2.67 0.00 859 Q 8.12 3.85 0.00 2.21 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.08 6.91 0.00 0.00 0.00 0.00 0.00 2.29 2.51 0.00 860 Q 8.60 4.20 0.00 2.07 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.65 0.00 0.00 0.00 0.00 0.00 2.32 2.46 0.00 * Residues marked with a * may have inaccurate shift predictions.