NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 537 T 4.2954 8.0327 110.9342 61.1451 70.4273 174.4547 538 R 3.6310 8.4393 121.9427 58.6649 29.9790 174.9871 539 E 3.8453 8.3177 118.8650 59.2200 30.0384 177.8626 540 L 3.8745 7.8699 120.0775 58.3966 42.2579 178.8034 541 Q 4.0302 8.1755 117.9235 59.1866 28.6755 179.3668 542 S 4.0985 8.2797 116.1326 61.4071 62.6772 176.4741 543 L 3.8990 7.8038 121.4401 58.2529 42.0149 178.7805 544 A 4.1709 8.4761 118.8657 54.1386 18.3769 178.3682 545 A 4.4207 7.6334 116.6531 51.6240 20.0555 177.3314 546 A 4.1787 7.0775 119.7583 51.4983 19.2311 177.4362 547 V 3.7825 8.0978 120.1317 62.4927 32.3174 176.2418 548 V 4.1229 8.1321 120.3720 59.2064 31.6531 174.3059 549 P 4.5063 0.0000 0.0000 61.9616 32.1620 177.0803 550 S 4.4019 8.3433 114.3527 58.0065 65.1317 174.8681 551 A 3.9710 8.6109 125.0793 55.5026 17.8427 179.8420 552 Q 3.9256 8.0567 116.3696 59.7373 29.2412 178.3124 553 T 4.0576 7.6340 115.0477 66.8516 68.6457 176.5414 554 L 4.1768 8.5182 120.6132 55.4937 41.5572 178.5044 555 K 4.1542 8.4147 117.6921 57.3134 30.0357 176.7749 556 I 3.6019 7.1489 110.6455 61.8958 37.5423 176.7322 557 T 4.2587 7.8129 117.7413 64.8013 69.0933 174.1523 558 D 4.7513 7.4693 120.7451 51.2054 40.9260 177.6339 559 F 4.2029 8.6292 121.6364 60.3959 39.0196 176.2833 560 S 4.4660 8.1575 112.7051 58.3098 63.5272 173.9831 561 F 4.0866 8.0742 124.0433 58.9445 39.5995 174.3002 562 S 4.3917 6.9053 119.3974 56.3469 65.2706 173.4595 563 D 4.5768 8.6411 125.9680 55.2932 40.2704 178.5138 564 F 3.7153 8.0117 121.5436 60.7568 39.5531 175.5478 565 E 4.2310 7.9833 115.0527 55.8676 30.1059 175.5997 566 L 4.6317 8.2124 121.2016 53.9827 43.1173 177.2254 567 S 4.4858 9.1403 117.7653 57.4767 65.5485 175.2702 568 D 4.3518 8.4744 121.7888 57.4904 40.4975 178.6744 569 L 3.8909 7.9081 120.1031 58.5188 41.9359 178.7589 570 E 3.9994 8.1957 118.4546 59.6113 29.2670 179.5610 571 T 3.4114 7.8615 109.7254 64.4985 68.7928 176.5943 572 A 4.0855 8.1525 123.6748 54.8750 18.2829 179.6637 573 L 3.9965 8.1750 117.5993 58.1048 41.6384 179.3541 574 C 4.1183 8.4350 116.9237 63.3376 28.1293 176.3528 575 T 4.1280 8.4774 117.3396 66.7666 67.9661 176.8184 576 I 3.8976 7.8563 121.7116 64.4273 37.1702 178.3393 577 R 3.9065 8.3304 119.8392 59.6304 29.6033 178.2588 578 M 3.4542 8.1697 118.7147 58.5582 32.0948 178.8055 579 F 4.0980 8.4746 117.6050 60.7515 38.9605 178.0610 580 T 3.9705 8.3875 115.7969 66.8912 68.2509 176.4066 581 D 4.6409 8.6907 118.4636 55.9311 40.9822 177.5509 582 L 4.4770 7.5857 118.5652 53.8862 42.2464 176.3145 583 N 4.4359 8.2612 115.8661 54.4935 36.8359 176.3354 584 L 4.3855 8.0221 121.6628 57.5930 41.6373 179.4089 585 V 3.6717 7.9704 118.2399 65.9753 31.5987 177.8467 586 Q 4.0215 7.9663 116.6122 59.1787 28.8466 177.5463 587 N 4.0862 7.7794 117.0145 55.0831 38.6178 175.7347 588 F 4.8527 7.6335 113.5859 56.2297 40.1846 175.1964 589 Q 3.4041 7.9286 118.2971 57.1710 26.5047 174.3823 590 M 4.2763 8.4792 116.6308 54.7744 33.2267 177.7506 591 K 4.2008 8.5194 123.4487 55.9380 33.5841 176.9185 592 H 4.0168 9.0184 124.3383 59.7875 29.7024 176.6056 593 E 3.8570 8.2156 120.1181 59.2760 29.3638 178.8385 594 V 3.7077 7.6696 117.8106 65.6979 31.6078 177.4773 595 L 3.8277 8.1185 120.4048 58.4092 41.9256 178.4886 596 C 3.9596 8.1421 116.8240 63.0448 28.0284 176.2872 597 R 3.8218 8.1043 119.9617 59.1683 29.6693 178.2974 598 W 4.6540 8.3927 129.7179 60.0941 30.7058 177.9782 599 I 3.3627 8.2033 120.0238 64.2747 36.4762 178.4618 600 L 3.7172 7.7337 119.8255 57.6585 41.2141 179.6861 601 S 4.0298 7.8882 114.7163 61.1280 63.0351 176.7383 602 V 3.3961 7.1073 121.0847 65.6543 31.2637 177.8627 603 K 3.3685 7.2679 119.3226 59.3107 31.5440 178.4803 604 K 3.8541 7.8514 118.9745 59.3665 32.4157 177.6124 605 N 4.5139 7.7565 114.1649 52.9452 38.5141 173.8082 606 Y 4.7680 7.3204 118.7508 56.2439 40.0752 175.3820 607 R 4.5048 8.4391 122.5599 54.7593 31.0641 177.8629 608 K 4.1724 8.7127 123.4317 58.9962 32.3381 178.1511 609 N 4.4306 8.1035 114.9629 54.4853 37.5727 174.9758 610 V 3.8943 7.4442 119.5306 61.6926 31.9957 174.8935 611 A 4.1528 8.8681 131.0521 55.3957 18.3660 176.9015 612 Y 4.5244 8.0909 112.8028 59.7259 40.4531 176.6094 613 H 4.2233 8.0900 117.5118 54.5972 26.9588 173.2689 614 N 5.2103 7.1216 118.7940 50.0070 41.1889 175.0805 615 W 3.8440 9.0099 126.1378 61.2962 30.4083 178.1441 616 R 3.5932 8.0367 117.0224 59.6734 29.4718 178.3281 617 H 3.9680 7.6997 115.9686 59.0283 29.9086 177.1843 618 A 3.7159 7.0733 122.3048 54.9032 18.0341 179.3892 619 F 3.6121 7.6125 119.3830 61.3737 39.3770 177.2104 620 N 4.0191 8.2822 116.4147 56.3599 38.2479 177.6256 621 T 3.9629 7.7551 117.1712 66.4326 68.4169 176.6367 622 A 3.9717 7.6831 122.4738 54.8265 18.3523 179.4769 623 Q 3.5268 7.7195 118.5219 59.2367 28.9430 178.0492 624 C 4.1316 8.0344 119.8151 62.5562 31.6229 175.1117 625 M 3.9598 7.9461 119.8692 58.5319 31.7266 177.9917 626 F 3.9267 8.3627 120.5753 61.1498 39.6274 176.8312 627 A 3.5742 8.3273 120.5463 55.1519 18.2225 179.5109 628 A 4.2988 8.6349 119.5128 55.3028 18.4591 179.9332 629 L 3.9423 7.7561 117.6831 58.2375 41.7575 178.7998 630 K 4.0069 7.9125 118.5262 58.4141 31.8580 178.9925 631 A 4.0107 8.0789 125.5718 54.8114 18.3216 178.7735 632 G 4.3352 7.9417 102.5668 44.5874 0.0000 174.0251 633 K 3.8228 7.5114 117.6095 57.7218 30.4101 176.9095 634 I 4.2292 7.1305 116.3995 62.4891 37.3923 177.2301 635 Q 4.0101 7.9467 121.6674 59.0752 28.7677 177.5266 636 N 4.5824 8.1315 114.9682 54.5158 37.5155 175.8178 637 K 4.4360 7.7549 119.3602 55.6980 32.9316 175.6686 638 L 5.1088 7.2887 118.7535 52.6119 45.4330 176.6621 639 T 4.4571 9.2798 111.6472 60.9618 71.4948 175.6445 640 D 4.4703 8.6458 121.4414 57.7562 40.8409 179.2191 641 L 4.0846 8.0344 118.9868 57.7752 41.6786 179.2073 642 E 4.0112 8.2612 118.5991 59.3754 29.4074 179.5027 643 I 3.7099 8.0875 120.1067 64.1813 37.3123 178.1142 644 L 3.9098 8.5511 121.2935 58.2045 41.8015 178.9605 645 A 3.9929 8.0742 120.5753 55.1036 18.2649 179.6327 646 L 3.9155 8.0936 117.6153 57.6902 41.6769 179.4404 647 L 3.8521 7.9103 120.1900 58.2605 42.0417 179.0367 648 I 4.0672 7.6833 119.1454 64.4135 36.9919 178.2462 649 A 4.1061 8.4808 121.6339 55.2031 18.0526 179.2883 650 A 3.9007 8.1471 118.2496 55.6712 18.5198 179.7206 651 L 4.2550 8.0866 115.8293 57.1600 42.0892 178.8283 652 S 4.8416 8.3430 113.5679 58.7226 63.6270 175.4477 653 H 4.4190 9.0493 118.5191 57.9505 28.1094 175.4176 654 D 4.3484 7.7032 120.0036 53.3447 42.1424 174.9442 655 L 2.9445 7.6787 118.8096 56.3851 41.8051 176.7103 656 D 4.3616 7.8971 121.7700 55.1552 40.2058 173.0831 657 H 4.2888 7.9609 116.4415 56.1380 30.2043 175.0297 658 R 4.3290 8.6268 124.2765 56.1671 30.5299 177.1315 659 G 4.0893 8.7960 106.2582 44.3349 0.0000 173.5785 660 V 4.0644 7.4954 119.1987 61.3958 31.1554 174.9581 661 N 5.0172 8.7287 124.9678 52.0342 41.0219 174.5395 662 N 5.1892 8.3342 116.6805 52.7905 40.3675 173.6847 663 S 4.0828 8.6327 112.2333 60.7999 64.6632 173.7054 664 Y 4.6572 6.9614 114.4788 59.0605 42.6225 174.0984 *676 Y 4.6270 7.5090 117.2943 57.9295 39.0596 175.6794 677 C 4.0954 8.6207 123.3784 60.1843 28.5905 173.5484 678 H 3.1609 5.2900 114.8042 56.5293 26.6699 174.8021 679 S 3.7876 7.9525 110.8685 59.2615 60.3181 174.4846 680 I 3.7407 7.2908 123.2030 64.7377 37.1504 177.8822 681 M 3.9741 7.9544 118.7049 58.6011 32.2047 177.9849 682 E 4.1600 8.1710 117.2558 59.7003 29.6931 178.6417 683 H 4.2383 8.2054 117.2108 58.9534 28.6911 177.1920 684 H 4.5284 7.8320 120.8073 59.0569 29.6540 177.0270 685 H 4.1687 8.0549 118.0897 58.7987 28.5423 177.5683 686 F 4.1587 8.5358 122.4560 61.5147 39.1728 176.7521 687 D 4.3049 8.4571 118.7151 57.5609 40.4994 178.8088 688 Q 3.8355 8.0668 120.0452 58.9962 29.0129 177.7969 689 C 4.0675 7.9885 119.9506 62.2358 31.6855 175.2296 690 L 3.7460 7.7112 122.3222 58.1850 41.6140 178.2752 691 M 3.9193 7.7578 118.1174 59.0811 31.8790 178.3629 692 I 3.7641 7.2958 117.8134 64.3459 37.4534 178.2774 693 L 4.2876 8.3569 119.5900 57.1703 41.1581 178.5353 694 N 4.6567 7.8117 115.0987 52.9531 39.8813 175.8441 695 S 4.1498 7.5903 116.1592 57.4297 63.4148 172.0918 696 P 4.3408 0.0000 0.0000 64.7524 31.0343 176.4737 697 G 3.9941 9.1523 110.7972 45.2806 0.0000 173.3795 698 N 4.9974 8.1040 115.3660 53.1569 39.7492 175.2860 699 Q 5.0514 7.9046 119.0766 55.2988 26.2400 176.6131 700 I 3.7400 7.4261 112.8872 62.4770 38.6963 177.8426 701 L 4.2827 7.6405 120.4681 55.0715 42.2175 176.5615 702 S 4.3416 7.4210 115.1413 58.5359 63.3507 173.3669 703 G 3.7339 8.6673 113.3424 45.6755 0.0000 174.1216 704 L 4.6096 7.4073 119.7990 53.6292 42.8995 177.3196 705 S 4.4982 9.0858 117.6584 58.0927 65.2744 175.4725 706 I 3.8494 8.1995 121.7210 64.4030 36.8027 178.4294 707 E 4.0606 8.1758 118.1862 59.3074 29.5458 179.0276 708 E 3.9804 8.2919 119.6293 59.3169 29.5616 178.4055 709 Y 4.0542 8.1460 119.5826 60.6647 38.8276 178.1077 710 K 3.8702 8.3452 120.3852 59.8288 32.2976 178.7608 711 T 3.7900 8.0020 115.7547 67.0065 68.3660 176.5513 712 T 3.8141 8.3187 117.7597 66.7946 68.5241 176.5172 713 L 3.8979 7.9776 120.9840 57.5568 41.5851 179.4496 714 K 3.8345 7.8979 119.4367 59.7547 32.0746 178.9490 715 I 3.7401 7.8400 119.9485 64.3564 36.9743 178.5347 716 I 3.7577 8.1661 121.2125 64.0709 36.8276 178.4572 717 K 3.5396 8.0999 120.5178 59.5333 31.9778 179.0114 718 Q 3.8869 7.9782 118.1400 58.6226 28.3229 178.5865 719 A 3.9540 8.0093 121.2762 55.3753 18.8355 179.4484 720 I 3.9080 7.8989 118.1893 64.6323 37.2126 178.8140 721 L 4.0389 8.2556 119.7399 57.5487 41.1859 179.2903 722 A 4.1269 7.9223 120.1380 54.6720 18.3297 178.8446 723 T 4.3511 7.5020 106.2299 61.7749 69.1646 174.6139 724 D 4.7387 8.0266 122.9754 53.5941 41.6887 176.0379 725 L 4.0771 8.8600 128.3967 58.2904 41.6332 179.3692 726 A 4.1282 8.3655 119.9206 55.3193 18.5008 179.5438 727 L 3.8847 8.2923 117.6935 57.6083 41.5635 178.9655 728 Y 4.0495 7.9343 119.1945 60.9735 38.6112 178.2173 729 I 3.2899 7.9142 119.5151 64.0689 37.2355 178.1465 730 K 3.9755 7.7689 119.5118 58.4142 31.7615 178.0809 731 R 4.3676 7.4412 117.3085 56.8569 31.6745 178.0334 732 R 3.4655 7.7230 116.5236 58.9355 28.8477 178.7764 733 G 3.8696 7.7885 105.7886 47.9540 0.0000 174.9421 734 E 3.9736 7.7552 121.4870 58.6554 29.7772 178.6208 735 F 4.2666 7.9625 120.2072 61.5026 39.5459 177.0338 736 F 4.4364 8.8937 118.2416 60.3640 38.5731 177.6259 737 E 3.9636 8.4149 118.4102 59.3449 29.2865 179.0949 738 L 4.0128 7.8075 118.8439 58.1776 41.5758 179.6123 739 I 3.5385 7.0644 117.5939 64.3369 37.0050 178.3522 740 R 3.9284 7.8426 119.2757 59.4000 29.9145 178.5650 741 K 4.0519 8.4250 116.1091 56.7906 32.0865 176.4184 742 N 4.3607 7.6999 116.8128 54.9587 37.5340 173.8105 743 Q 4.6472 8.1162 111.6745 55.1375 29.2555 174.9592 744 F 4.4300 8.3429 120.6335 59.0610 40.0397 174.2415 745 N 4.4887 8.7491 125.7631 51.3455 39.7499 174.6466 746 L 3.7055 7.8659 125.7360 56.6123 41.8242 178.1989 747 E 3.9894 7.9624 117.9831 57.1747 30.0757 175.9195 748 D 4.6151 8.0571 119.4473 53.0303 42.2577 174.2699 749 P 4.2248 0.0000 0.0000 66.2846 31.4330 177.9440 750 H 4.1658 8.5306 116.5278 59.4837 29.8917 177.3320 751 Q 4.2205 8.2655 118.8518 58.0727 28.4851 178.4883 752 K 4.0686 8.1991 121.5884 59.4688 32.3691 178.5123 753 E 3.9508 8.1578 118.8553 59.4357 29.4045 178.9392 754 L 3.8769 7.9819 120.2114 58.2229 42.0828 178.8294 755 F 4.0620 8.1661 119.7835 61.4595 39.4348 177.0414 756 L 3.8158 8.1942 118.3663 57.5243 41.3034 179.5745 757 A 3.8644 7.9593 120.6651 55.4800 18.3824 179.5719 758 M 3.8238 7.7436 117.2655 58.1823 31.7775 178.7686 759 L 3.6427 7.8247 120.6989 58.2322 42.1257 178.8552 760 M 3.9132 7.8460 118.5137 58.8432 31.9151 178.7831 761 T 3.7082 7.7721 112.7442 64.8284 67.1503 176.0653 762 A 3.6766 7.5865 122.2196 55.3134 18.7221 179.1558 763 C 4.3090 8.2864 115.4833 62.8799 27.9377 175.7781 764 D 4.3910 8.2906 119.3129 56.5070 40.9689 177.3015 765 L 4.7565 7.7169 117.1965 54.3626 42.0880 178.0276 766 S 4.1243 8.0961 116.7003 61.8068 62.3841 176.5559 767 A 4.0476 8.1902 123.8503 55.0487 17.7310 178.7655 768 I 4.0121 8.4058 116.5795 63.0680 38.1267 176.9936 769 T 4.2423 7.7979 109.1357 61.6457 69.6269 174.7774 770 K 4.4312 6.9590 120.6081 55.2679 32.8850 175.4034 771 P 4.3854 0.0000 0.0000 62.5597 33.0854 177.1847 772 W 4.5704 8.7733 130.7946 60.6305 30.5668 176.4352 773 P 3.8188 0.0000 0.0000 65.5687 30.6563 178.7722 774 I 3.5278 7.3919 117.8577 64.2570 37.1167 177.9352 775 Q 3.8769 8.0626 120.6855 59.3239 28.9424 178.2856 776 Q 3.5616 7.5698 120.8278 58.7562 28.8083 178.1979 777 R 3.6437 7.2867 119.8266 59.5070 30.1306 178.6767 778 I 3.7708 7.8702 119.6298 64.0911 36.9632 178.1600 779 A 3.8242 8.2444 122.1110 55.3198 18.2148 179.5610 780 E 3.8766 8.0953 116.4308 59.0316 29.4279 179.5768 781 L 3.9482 7.2800 118.2221 57.4137 41.6936 179.4053 782 V 2.9209 7.5010 117.9800 65.5980 31.3577 177.7470 783 A 3.4867 7.7411 120.5151 55.4388 18.0807 179.4744 784 T 3.8370 7.6700 114.0250 66.9859 68.5281 176.3399 785 E 3.8762 7.9481 120.8904 59.1386 29.5261 178.9179 786 F 4.4449 7.7579 117.7785 60.7186 38.9337 177.6201 787 F 5.3044 8.2232 119.1265 60.4100 38.6538 177.3238 788 D 4.4590 8.5729 118.7683 57.6620 40.6745 178.8560 789 Q 4.1104 8.4103 120.0729 58.9579 29.1586 178.4372 790 G 3.6596 8.5407 107.2465 47.9342 0.0000 175.4555 791 D 4.3823 8.5075 122.0846 56.9479 40.8065 178.8899 792 R 3.8825 8.2545 119.3575 59.5399 30.0443 178.1955 793 E 3.9229 8.7932 119.2943 59.0774 29.2888 178.5421 794 R 4.5024 7.5936 119.0708 57.9193 30.2614 177.9701 795 K 4.0668 7.8878 119.0296 59.9200 32.3504 178.3006 796 E 4.0157 8.3431 118.3556 57.6441 30.0194 176.8474 797 L 4.5882 7.3863 119.0454 53.5044 44.0283 177.1810 798 N 4.9757 8.4525 119.9380 52.7603 37.3959 175.2617 799 I 4.4063 7.1991 118.2728 59.4978 39.6907 175.8163 800 E 4.3791 8.5692 124.6342 54.4031 30.1936 174.7158 801 P 4.3609 0.0000 0.0000 62.6951 32.2630 176.4963 802 T 4.2058 8.2180 111.6126 61.1063 69.3767 174.9851 803 D 4.5422 8.7959 122.3597 57.6271 41.0558 179.1752 804 L 3.8320 7.3396 119.9432 57.5026 42.2657 177.3271 805 M 4.7214 8.4430 116.0203 54.8160 32.9298 174.4808 806 N 4.9224 7.6488 118.0480 52.0659 39.9715 174.4577 807 R 2.5100 8.6312 126.2045 59.0247 30.2308 176.3610 808 E 4.0501 7.6262 115.9359 56.4489 30.2916 176.5233 809 K 4.4041 8.7502 115.4223 56.5457 29.9661 177.4461 810 K 4.3643 7.4497 118.7621 58.7546 32.6947 177.8837 811 N 4.6998 8.1715 115.9707 53.7809 37.5049 175.8117 812 K 4.5380 7.7115 117.7674 56.5214 32.5851 177.9634 813 I 3.5879 7.6414 115.4194 63.4029 37.3772 176.4113 814 P 4.0693 0.0000 0.0000 65.3591 31.3027 178.2474 815 S 4.1067 8.1206 111.3372 61.9586 62.2726 175.9841 816 M 4.1731 8.1283 120.8396 57.9851 31.7095 178.7940 817 Q 3.8971 8.2396 118.9596 58.6268 28.5567 178.7537 818 V 3.7876 8.0398 119.6652 65.8459 31.5100 178.3423 819 G 3.6380 8.0326 105.5666 47.7655 0.0000 175.3859 820 F 4.3050 8.7343 123.6691 61.0336 39.4311 177.2429 821 I 3.4895 7.9772 119.3251 64.3933 36.7255 178.1078 822 D 4.3046 8.1550 118.2188 57.5799 40.8404 178.6648 823 A 4.2097 8.1474 119.6869 54.1311 18.4187 178.0699 824 I 4.4537 7.5661 115.9868 62.8953 39.8054 177.4618 825 C 4.1264 7.5389 117.3510 62.1407 28.2321 175.2264 826 L 3.9913 7.8931 121.7443 58.7727 41.5826 179.2172 827 Q 3.7366 8.0702 116.9635 58.7425 28.5256 178.6441 828 L 4.2663 7.8731 120.6026 58.7268 42.1037 178.6115 829 Y 4.1741 7.6107 115.3559 60.6485 38.1250 178.1416 830 E 4.0989 8.5240 118.8392 59.4461 29.8283 179.0015 831 A 4.0170 8.1614 122.3532 54.6927 18.4619 179.3110 832 L 4.1927 8.3863 118.8973 58.7346 40.8109 179.3518 833 T 4.1610 7.8529 115.2516 66.8820 68.0968 176.1429 834 H 4.4638 7.9190 117.2526 58.0646 28.7248 177.7966 835 V 3.9041 7.6104 119.9257 64.2922 31.8640 176.2316 836 S 4.5564 7.3635 113.3846 56.5216 65.3376 174.1305 837 E 4.2255 8.9238 128.4583 58.7541 29.8216 177.4353 838 D 4.7279 8.2036 117.0172 56.0179 41.2819 176.6625 839 C 4.5158 7.9593 116.8322 59.4323 28.7338 175.0509 840 F 4.0416 8.1791 124.2487 61.1730 38.7416 175.1735 841 P 3.8137 0.0000 0.0000 65.5365 30.9823 178.4665 842 L 3.4714 7.0123 117.2141 57.4163 41.5344 179.0537 843 L 3.7273 7.4071 119.5129 58.1944 42.1437 178.0899 844 D 4.0107 7.7388 118.4481 57.4133 40.8533 178.7544 845 G 3.8234 7.9746 107.6031 47.1730 0.0000 175.2923 846 C 4.3578 7.6238 122.3230 61.8057 31.5741 175.8881 847 R 3.8831 7.8178 119.6357 59.3605 29.7908 179.2173 848 K 3.9353 7.8284 117.6237 59.5286 31.8573 179.1646 849 N 4.4494 7.9261 117.0564 56.1157 38.4431 177.4666 850 R 4.0942 7.9946 120.1226 59.3566 30.0277 178.7172 851 Q 3.9273 8.0319 118.0550 58.6926 28.8041 178.6329 852 K 3.3456 7.4780 118.8950 59.2006 31.8594 179.5442 853 W 4.5381 8.1962 119.3403 59.7992 28.9219 178.7120 854 Q 4.0443 8.5131 118.1448 58.8071 28.0712 178.4662 855 A 3.9662 8.1799 122.0273 55.2739 18.3283 179.6509 856 L 3.9605 7.8795 116.9122 57.8521 41.5010 179.6316 857 A 4.0551 8.1013 119.5805 55.2355 18.4475 179.3071 858 E 4.0598 7.9761 115.5863 59.7699 29.7363 179.3035 859 Q 4.0844 8.1618 118.0428 58.7463 29.0879 176.3239 860 Q 4.2942 8.0704 124.8019 56.4629 29.2518 175.4859 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 537 T 8.03 4.30 4.20 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 1.17 0.00 0.00 538 R 8.44 3.63 0.00 1.96 1.94 0.00 3.17 0.00 0.00 3.28 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.73 0.00 539 E 8.32 3.85 0.00 2.02 1.88 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 2.30 2.31 0.00 540 L 7.87 3.87 0.00 1.69 1.82 0.90 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 541 Q 8.18 4.03 0.00 2.29 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.59 0.00 0.00 0.00 0.00 0.00 2.37 2.67 0.00 542 S 8.28 4.10 0.00 3.97 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 0.00 543 L 7.80 3.90 0.00 1.78 1.80 0.87 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 544 A 8.48 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 0.00 545 A 7.63 4.42 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 7.08 4.18 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.10 3.78 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 0.84 0.00 0.00 0.94 0.00 0.00 548 V 8.13 4.12 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 0.84 0.00 0.00 0.96 0.00 0.00 549 P 0.00 4.51 0.00 2.07 2.02 0.00 3.70 0.00 0.00 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.09 0.00 550 S 8.34 4.40 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 0.00 551 A 8.61 3.97 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 0.00 552 Q 8.06 3.93 0.00 2.09 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.98 0.00 0.00 0.00 0.00 0.00 2.38 2.50 0.00 553 T 7.63 4.06 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 8.52 4.18 0.00 1.76 1.76 0.92 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 555 K 8.41 4.15 0.00 2.20 2.06 0.00 1.72 0.00 0.00 1.80 0.00 0.00 2.98 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.43 1.78 7.81 556 I 7.15 3.60 1.34 0.00 0.00 0.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.33 0.31 0.00 0.00 557 T 7.81 4.26 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 1.11 0.00 0.00 558 D 7.47 4.75 0.00 3.03 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 0.00 559 F 8.63 4.20 0.00 3.05 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 0.00 560 S 8.16 4.47 0.00 4.03 4.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 561 F 8.07 4.09 0.00 3.20 3.22 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 0.00 562 S 6.91 4.39 0.00 3.66 3.44 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 0.00 563 D 8.64 4.58 0.00 3.22 3.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 564 F 8.01 3.72 0.00 2.91 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 0.00 565 E 7.98 4.23 0.00 2.05 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 2.17 2.27 0.00 566 L 8.21 4.63 0.00 1.65 1.64 1.30 0.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 567 S 9.14 4.49 0.00 3.95 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 568 D 8.47 4.35 0.00 2.68 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 0.00 569 L 7.91 3.89 0.00 1.67 1.65 0.90 0.97 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 0.00 570 E 8.20 4.00 0.00 2.31 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 7.86 3.41 2.88 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 0.88 0.00 0.00 572 A 8.15 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 0.00 573 L 8.17 4.00 0.00 1.91 1.76 0.99 0.80 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 0.00 574 C 8.44 4.12 0.00 3.48 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 0.00 575 T 8.48 4.13 4.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 576 I 7.86 3.90 2.12 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 1.46 1.01 1.00 0.00 0.00 577 R 8.33 3.91 0.00 1.89 2.04 0.00 3.39 0.00 0.00 3.26 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.54 0.00 578 M 8.17 3.45 0.00 1.91 2.23 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 1.73 0.00 579 F 8.47 4.10 0.00 3.33 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 0.00 580 T 8.39 3.97 4.51 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 1.27 0.00 0.00 581 D 8.69 4.64 0.00 2.88 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 0.00 582 L 7.59 4.48 0.00 1.76 1.75 0.97 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 583 N 8.26 4.44 0.00 2.97 3.10 0.00 0.00 7.00 6.51 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 0.00 584 L 8.02 4.39 0.00 2.19 2.08 0.87 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 585 V 7.97 3.67 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.00 0.00 1.10 0.00 0.00 586 Q 7.97 4.02 0.00 2.31 2.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 6.62 0.00 0.00 0.00 0.00 0.00 2.39 2.40 0.00 587 N 7.78 4.09 0.00 2.58 2.05 0.00 0.00 6.89 7.13 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 0.00 588 F 7.63 4.85 0.00 3.21 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 0.00 589 Q 7.93 3.40 0.00 2.22 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.46 6.84 0.00 0.00 0.00 0.00 0.00 2.32 2.32 0.00 590 M 8.48 4.28 0.00 1.89 2.01 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 2.73 2.66 0.00 591 K 8.52 4.20 0.00 1.84 1.73 0.00 1.59 0.00 0.00 1.75 0.00 0.00 3.04 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.53 1.56 7.81 592 H 9.02 4.02 0.00 3.18 3.34 0.00 5.68 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 0.00 593 E 8.22 3.86 0.00 2.09 1.94 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 2.37 2.36 0.00 594 V 7.67 3.71 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 1.05 0.00 0.00 0.92 0.00 0.00 595 L 8.12 3.83 0.00 1.79 1.67 0.83 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 596 C 8.14 3.96 0.00 3.09 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 0.00 597 R 8.10 3.82 0.00 1.98 2.08 0.00 3.21 0.00 0.00 3.08 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.61 0.00 598 W 8.39 4.65 0.00 3.57 3.32 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 0.00 599 I 8.20 3.36 2.02 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.13 0.82 0.00 0.00 600 L 7.73 3.72 0.00 1.71 1.53 0.83 0.79 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 0.00 601 S 7.89 4.03 0.00 3.72 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 0.00 602 V 7.11 3.40 1.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 -0.12 0.00 0.00 603 K 7.27 3.37 0.00 0.79 1.21 0.00 1.00 0.00 0.00 0.61 0.00 0.00 2.55 0.00 0.00 2.45 0.00 0.00 0.00 0.00 0.88 0.24 7.81 604 K 7.85 3.85 0.00 1.76 1.85 0.00 1.75 0.00 0.00 1.62 0.00 0.00 2.90 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.36 1.39 7.81 605 N 7.76 4.51 0.00 2.80 2.50 0.00 0.00 6.85 7.16 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 0.00 606 Y 7.32 4.77 0.00 3.26 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 0.00 607 R 8.44 4.50 0.00 1.93 1.90 0.00 3.16 0.00 0.00 3.36 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.67 0.00 608 K 8.71 4.17 0.00 1.77 1.90 0.00 1.76 0.00 0.00 1.78 0.00 0.00 3.13 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.51 1.47 7.81 609 N 8.10 4.43 0.00 2.83 2.97 0.00 0.00 5.96 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 7.44 3.89 2.29 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 0.86 0.00 0.00 1.03 0.00 0.00 611 A 8.87 4.15 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 0.00 612 Y 8.09 4.52 0.00 2.58 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 0.00 613 H 8.09 4.22 0.00 2.94 3.07 0.00 5.84 0.00 0.00 0.00 0.00 6.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 614 N 7.12 5.21 0.00 2.94 3.13 0.00 0.00 5.71 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 9.01 3.84 0.00 3.36 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 0.00 616 R 8.04 3.59 0.00 1.95 1.96 0.00 3.51 0.00 0.00 3.05 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.68 0.00 617 H 7.70 3.97 0.00 2.73 3.03 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 7.07 3.72 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 619 F 7.61 3.61 0.00 1.51 2.53 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 0.00 620 N 8.28 4.02 0.00 2.78 2.82 0.00 0.00 7.08 6.74 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 0.00 621 T 7.76 3.96 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 1.08 0.00 0.00 622 A 7.68 3.97 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 3.53 0.00 1.28 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.12 6.76 0.00 0.00 0.00 0.00 0.00 1.57 1.33 0.00 624 C 8.03 4.13 0.00 3.16 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 7.95 3.96 0.00 2.30 2.00 0.00 0.00 0.00 0.00 0.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.56 0.00 626 F 8.36 3.93 0.00 3.05 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 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0.00 0.00 0.00 0.00 0.00 729 I 7.91 3.29 2.01 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.97 0.86 0.00 0.00 730 K 7.77 3.98 0.00 1.75 1.85 0.00 1.52 0.00 0.00 1.51 0.00 0.00 2.99 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.21 1.38 7.81 731 R 7.44 4.37 0.00 1.74 1.79 0.00 3.28 0.00 0.00 3.14 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.55 0.00 732 R 7.72 3.47 0.00 0.67 1.20 0.00 2.56 0.00 0.00 2.25 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 1.11 0.00 733 G 7.79 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 734 E 7.76 3.97 0.00 2.08 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 0.00 2.42 2.38 0.00 735 F 7.96 4.27 0.00 3.01 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 0.00 736 F 8.89 4.44 0.00 3.14 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 0.00 737 E 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0.00 0.00 1.15 0.00 0.00 762 A 7.59 3.68 1.21 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 0.00 0.00 763 C 8.29 4.31 0.00 3.05 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 0.00 764 D 8.29 4.39 0.00 2.74 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 0.00 765 L 7.72 4.76 0.00 1.98 1.91 1.08 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 0.00 0.00 0.00 0.00 0.00 0.00 766 S 8.10 4.12 0.00 4.14 4.35 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 0.00 767 A 8.19 4.05 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 0.00 768 I 8.41 4.01 2.18 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.39 1.09 0.00 0.00 769 T 7.80 4.24 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 0.33 0.00 0.00 770 K 6.96 4.43 0.00 1.90 1.78 0.00 1.66 0.00 0.00 1.88 0.00 0.00 3.19 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.49 1.49 7.81 771 P 0.00 4.39 0.00 2.15 2.01 0.00 3.64 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.18 0.00 772 W 8.77 4.57 0.00 3.29 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 0.00 773 P 0.00 3.82 0.00 2.08 1.97 0.00 3.59 0.00 0.00 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.21 0.00 774 I 7.39 3.53 1.93 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 1.42 0.56 0.85 0.00 0.00 775 Q 8.06 3.88 0.00 2.28 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.81 0.00 0.00 0.00 0.00 0.00 2.69 2.35 0.00 776 Q 7.57 3.56 0.00 0.93 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.59 0.00 0.00 0.00 0.00 0.00 1.99 2.01 0.00 777 R 7.29 3.64 0.00 1.68 1.75 0.00 3.00 0.00 0.00 2.25 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 1.26 0.00 778 I 7.87 3.77 1.82 0.00 0.00 0.89 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8.80 4.54 0.00 2.75 2.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 804 L 7.34 3.83 0.00 1.27 1.49 -0.11 0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 805 M 8.44 4.72 0.00 2.20 2.04 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.57 0.00 806 N 7.65 4.92 0.00 2.70 2.89 0.00 0.00 7.03 7.53 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 0.00 807 R 8.63 2.51 0.00 1.58 1.73 0.00 3.23 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 1.40 1.23 0.00 808 E 7.63 4.05 0.00 1.98 1.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.22 0.00 809 K 8.75 4.40 0.00 2.25 1.85 0.00 1.78 0.00 0.00 1.91 0.00 0.00 3.00 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.42 1.41 7.81 810 K 7.45 4.36 0.00 2.25 2.03 0.00 1.34 0.00 0.00 1.69 0.00 0.00 2.99 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.34 1.39 7.81 811 N 8.17 4.70 0.00 2.93 3.12 0.00 0.00 6.17 6.98 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 0.00 812 K 7.71 4.54 0.00 2.14 1.86 0.00 1.58 0.00 0.00 1.71 0.00 0.00 3.09 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.38 1.47 7.81 813 I 7.64 3.59 1.59 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.70 1.06 0.00 0.00 814 P 0.00 4.07 0.00 2.34 2.70 0.00 3.75 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.60 0.00 815 S 8.12 4.11 0.00 3.91 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 0.00 816 M 8.13 4.17 0.00 2.04 1.97 0.00 0.00 0.00 0.00 0.00 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.75 2.56 0.00 817 Q 8.24 3.90 0.00 1.17 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.10 6.81 0.00 0.00 0.00 0.00 0.00 1.60 1.16 0.00 818 V 8.04 3.79 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 1.17 0.00 0.00 819 G 8.03 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 8.73 4.31 0.00 3.08 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 0.00 821 I 7.98 3.49 2.09 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 1.63 1.02 0.95 0.00 0.00 822 D 8.16 4.30 0.00 2.83 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 8.15 4.21 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 824 I 7.57 4.45 1.53 0.00 0.00 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.83 0.77 0.00 0.00 825 C 7.54 4.13 0.00 3.02 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 0.00 826 L 7.89 3.99 0.00 1.94 1.68 0.94 0.81 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 0.00 827 Q 8.07 3.74 0.00 2.06 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.23 6.69 0.00 0.00 0.00 0.00 0.00 2.21 2.33 0.00 828 L 7.87 4.27 0.00 1.84 1.46 0.38 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 829 Y 7.61 4.17 0.00 3.00 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 8.52 4.10 0.00 2.22 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 0.00 2.18 2.46 0.00 831 A 8.16 4.02 1.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 832 L 8.39 4.19 0.00 1.98 1.99 1.21 0.88 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 0.00 833 T 7.85 4.16 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 1.31 0.00 0.00 834 H 7.92 4.46 0.00 3.28 3.31 0.00 5.65 0.00 0.00 0.00 0.00 6.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 835 V 7.61 3.90 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 0.65 0.00 0.00 0.93 0.00 0.00 836 S 7.36 4.56 0.00 4.06 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 0.00 837 E 8.92 4.23 0.00 2.10 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 2.34 2.38 0.00 838 D 8.20 4.73 0.00 2.97 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 0.00 839 C 7.96 4.52 0.00 3.17 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 0.00 840 F 8.18 4.04 0.00 3.27 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 0.00 841 P 0.00 3.81 0.00 1.66 2.09 0.00 3.45 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 2.25 2.31 0.00 842 L 7.01 3.47 0.00 1.61 1.26 0.96 0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.52 0.00 0.00 0.00 0.00 0.00 0.00 843 L 7.41 3.73 0.00 1.83 1.48 0.95 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 844 D 7.74 4.01 0.00 1.58 2.30 0.00 0.00 0.00 0.00 0.00 0.00 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 7.97 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 846 C 7.62 4.36 0.00 2.81 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 0.00 847 R 7.82 3.88 0.00 2.01 1.93 0.00 3.10 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 1.63 1.62 0.00 848 K 7.83 3.94 0.00 1.79 1.81 0.00 1.78 0.00 0.00 1.60 0.00 0.00 2.93 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.42 1.61 7.81 849 N 7.93 4.45 0.00 3.03 3.14 0.00 0.00 6.55 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 850 R 7.99 4.09 0.00 1.99 2.13 0.00 3.18 0.00 0.00 3.25 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.76 0.00 851 Q 8.03 3.93 0.00 2.20 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.58 0.00 0.00 0.00 0.00 0.00 2.34 2.54 0.00 852 K 7.48 3.35 0.00 0.90 0.74 0.00 1.08 0.00 0.00 1.10 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.26 0.68 7.81 853 W 8.20 4.54 0.00 3.40 3.36 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 0.00 854 Q 8.51 4.04 0.00 2.36 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.78 0.00 0.00 0.00 0.00 0.00 2.44 2.55 0.00 855 A 8.18 3.97 1.25 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 0.00 856 L 7.88 3.96 0.00 2.20 1.95 1.19 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 857 A 8.10 4.06 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 0.00 858 E 7.98 4.06 0.00 1.98 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.36 2.65 0.00 859 Q 8.16 4.08 0.00 2.04 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.96 0.00 0.00 0.00 0.00 0.00 2.40 2.38 0.00 860 Q 8.07 4.29 0.00 2.31 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.74 6.32 0.00 0.00 0.00 0.00 0.00 2.42 2.78 0.00 * Residues marked with a * may have inaccurate shift predictions.