NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 535 E 4.1830 8.4449 120.2166 56.0926 30.9611 175.3512 536 E 4.3563 8.3088 122.9226 53.6958 31.7494 175.3976 537 T 3.7857 8.6401 119.7758 64.7484 67.8513 175.6556 538 R 3.8337 7.8388 120.5663 59.3796 30.2672 177.8811 539 E 3.8968 7.9564 118.6972 58.9932 29.6989 178.3757 540 L 3.8502 8.1763 120.7150 58.1328 42.3570 178.4311 541 Q 3.9296 8.2837 119.9263 59.5828 28.7024 178.6572 542 S 4.1191 7.7785 112.5186 61.0845 62.1520 175.5830 543 L 4.0860 7.9382 123.0288 58.0665 41.6977 178.8003 544 A 4.0852 8.4361 119.6597 54.6393 18.3813 178.7142 545 A 4.2443 7.7456 116.8087 52.4396 19.4227 177.7456 546 A 4.1586 6.9098 119.2410 51.7015 19.1977 177.1707 547 V 3.9003 8.0476 120.2897 61.8510 32.5001 176.0116 548 V 3.9670 8.2453 127.3087 60.9894 31.3227 173.9170 549 P 4.4714 0.0000 0.0000 62.0961 32.0629 176.7277 550 S 4.2975 8.5359 114.4056 58.7058 64.7044 175.3118 551 A 3.9866 8.4937 123.8831 55.1321 17.9192 179.8224 552 Q 3.9203 7.9894 116.8654 59.9017 29.3646 178.3114 553 T 4.0521 7.9504 115.3578 66.3991 68.3154 176.1104 554 L 4.2796 8.1503 119.6900 54.7878 41.9080 178.3281 555 K 4.3528 7.9355 117.5089 56.9518 30.1387 177.2070 556 I 3.4749 7.2454 111.9784 62.4060 37.4168 176.6764 557 T 4.2496 7.7427 110.2915 62.1430 69.7459 174.1665 558 D 4.6671 7.8222 123.9886 53.3063 41.7692 177.6962 559 F 4.3301 8.6827 122.5697 60.3566 39.1236 176.2564 560 S 4.5241 8.1047 114.3107 58.1424 63.0137 173.8619 561 F 4.0554 7.7441 122.8422 58.8791 39.5104 174.4183 562 S 4.1722 7.0938 119.5341 56.4208 65.3945 173.1406 563 D 4.6557 7.6119 122.8601 52.7246 40.2127 177.7357 564 F 4.4285 7.0276 118.5629 61.0597 38.9403 176.3622 565 E 4.2335 8.0945 115.4790 57.3099 30.0822 176.4696 566 L 4.6778 7.7459 120.8577 53.9342 43.0724 177.2108 567 S 4.6005 8.9470 118.1748 57.4066 65.7363 175.2799 568 D 4.3802 8.4962 121.6351 57.5360 40.5104 178.7646 569 L 3.9220 7.9018 120.2024 58.3580 42.0302 178.8134 570 E 4.0437 8.0710 118.6504 59.4510 29.3894 179.3796 571 T 3.4577 7.8178 109.6035 64.1916 68.7276 176.7610 572 A 4.0780 7.8857 123.9322 55.0418 18.4449 179.5804 573 L 4.0140 8.1027 117.5725 58.1742 41.7110 179.5007 574 C 4.2123 8.3981 116.7442 63.1456 28.2070 176.3293 575 T 4.1316 8.2936 117.2860 66.8166 68.1213 176.6682 576 I 3.8695 8.0251 121.6972 64.5633 37.0727 178.4396 577 R 3.9341 8.1938 119.4170 59.5509 29.3050 178.4548 578 M 3.2533 7.8803 118.5002 58.2827 31.9599 178.7565 579 F 4.1425 8.3053 117.3846 60.7113 39.0648 177.9887 580 T 3.9723 8.2857 115.3676 66.8915 68.2250 176.3176 581 D 4.7125 8.3826 118.0965 55.7762 40.9906 177.4835 582 L 4.5411 7.4942 117.7055 53.7859 42.1284 176.2871 583 N 4.4197 8.1869 115.4851 54.3791 37.1433 176.2945 584 L 4.3077 8.1660 121.6033 57.8552 41.6189 179.4841 585 V 3.6895 7.9253 117.8291 66.0211 31.4234 177.7027 586 Q 3.8813 7.9993 118.6542 59.4655 28.9596 177.7651 587 N 4.2016 8.0860 115.8721 54.9633 38.3998 175.8869 588 F 4.8853 7.3771 116.6734 56.2484 40.2050 175.2562 589 Q 3.3103 7.7418 118.1708 57.1149 26.6355 174.6463 590 M 4.2713 7.9341 116.4380 54.9774 33.2610 177.6773 591 K 4.2779 8.4426 123.0126 55.7385 34.2151 177.0457 592 H 4.0255 8.9383 123.9354 59.8233 29.6954 176.9293 593 E 3.8851 8.2002 120.1524 59.2214 29.3598 178.8451 594 V 3.8729 7.6066 119.2190 65.3458 31.6460 177.6311 595 L 3.8777 7.9740 120.1303 58.2369 41.8817 178.7178 596 C 4.0641 8.1172 116.7433 62.8419 28.0812 176.1151 597 R 3.8521 8.1894 120.4150 58.9817 29.6107 178.3297 598 W 4.6727 8.4418 129.8826 60.0713 30.6769 177.9422 599 I 3.3321 8.0957 119.8459 64.4033 36.4868 178.4681 600 L 3.6730 7.7223 119.6654 57.7439 41.1423 179.8176 601 S 3.9233 7.6985 114.3821 61.2385 63.0129 176.6544 602 V 3.3870 7.2378 120.9840 65.7114 31.2352 177.8968 603 K 3.2437 7.3261 119.4283 59.2423 31.5766 178.6089 604 K 3.9332 7.7796 118.6380 58.8329 32.2925 176.9029 605 N 4.6337 7.7308 115.2438 53.2566 38.7103 174.0563 606 Y 4.5719 7.5123 115.9967 56.4928 39.9644 175.3203 607 R 4.5584 8.3637 121.2722 54.5798 31.0720 177.9567 608 K 4.1378 8.7524 123.6089 59.1375 32.2463 177.7848 609 N 4.5124 8.1368 113.8600 53.5064 37.6377 174.7554 610 V 4.7530 7.8339 119.5303 60.9009 31.9915 174.9156 611 A 4.2085 9.7316 132.3712 55.2418 18.4594 176.8574 612 Y 4.5706 8.2532 112.4392 59.7200 40.6535 176.6091 613 H 4.2748 8.7116 118.1233 54.6326 27.0180 173.4102 614 N 5.2524 7.2390 119.3896 49.8416 41.1604 175.3589 615 W 3.5602 8.9193 125.9525 61.0749 30.3317 178.2411 616 R 3.5310 7.9332 117.1366 59.2755 29.4645 178.4412 617 H 3.8754 7.8405 118.0227 58.9383 29.8126 177.2303 618 A 3.7225 7.2174 122.4097 54.8736 18.1388 179.2855 619 F 3.5829 7.6676 119.4162 61.4284 39.3171 177.1856 620 N 3.9884 8.0208 116.1622 56.3386 38.2465 177.6339 621 T 3.7848 7.6763 117.1005 66.4612 68.4141 176.6558 622 A 3.9421 7.8441 122.7616 55.0375 18.2820 179.4762 623 Q 3.5299 7.6837 118.1631 59.2411 28.9258 178.0388 624 C 4.1031 8.0469 119.8218 62.5232 31.5053 175.1868 625 M 4.0081 7.9728 119.8994 58.4862 31.7860 177.9108 626 F 3.9819 8.3567 120.8081 61.3205 39.5642 176.9587 627 A 3.5677 8.2550 120.4250 54.9295 18.1826 179.4884 628 A 4.3412 8.4208 119.7332 55.3428 18.4866 179.9367 629 L 4.0209 8.1271 117.7874 58.3635 41.7681 178.7401 630 K 4.0244 8.1946 118.9425 58.3082 31.7172 178.9503 631 A 4.0714 7.4091 124.1216 55.1411 18.9196 179.1969 632 G 3.9494 8.4607 102.0836 44.6934 0.0000 173.8052 633 K 3.9348 7.5933 118.7140 57.6154 30.4171 177.0699 634 I 4.1369 7.6053 120.2002 63.0112 37.0744 177.1880 635 Q 3.9752 8.0554 121.3162 59.5668 28.5891 178.3298 636 N 4.4589 8.1204 114.9225 55.3303 38.7437 176.4508 637 K 4.3209 7.9974 118.4663 56.0243 32.7374 176.0279 638 L 4.9396 7.1031 118.5703 52.8000 44.8500 176.2864 639 T 4.4967 8.9304 111.2190 60.7976 71.4970 175.6113 640 D 4.5049 8.5866 121.2759 57.6289 40.7806 179.1582 641 L 3.9730 8.0199 118.9627 57.8973 41.6578 179.2045 642 E 4.0017 8.1410 118.1041 59.4867 29.3616 179.5789 643 I 3.7365 7.9904 119.9345 64.0511 37.1524 178.1889 644 L 3.8840 8.3081 121.3503 58.1002 41.8449 178.9200 645 A 3.9663 8.2786 121.0357 55.1037 18.2517 179.5791 646 L 3.9030 8.1351 117.7094 57.8105 41.7817 179.5453 647 L 3.8809 7.8468 120.1510 58.2534 42.0518 179.0326 648 I 4.0704 7.7768 119.5375 64.4658 36.9569 178.3193 649 A 4.1496 8.5400 121.7702 55.1184 18.0024 179.5061 650 A 3.9599 8.2272 118.6807 55.4571 18.5478 179.6328 651 L 4.2580 8.0521 116.2650 57.3359 42.1203 178.9135 652 S 4.7904 8.5309 113.8792 59.1030 63.4338 175.7394 653 H 4.2975 8.6337 117.4611 58.0490 28.3402 175.8144 654 D 4.6121 7.8860 118.2586 53.4718 41.2609 175.5222 655 L 2.8214 7.3488 119.2705 56.4051 41.8331 176.6839 656 D 4.4015 8.1076 120.7315 55.0901 40.2635 173.0269 657 H 4.2129 7.9945 116.7894 56.2893 30.1414 175.1781 658 R 4.5376 8.8650 123.7189 55.8006 30.3754 176.8629 659 G 4.1624 8.4864 104.8561 45.6647 0.0000 175.5367 660 V 3.7133 8.2587 114.4394 63.6992 31.7559 176.7416 661 N 4.8785 9.5999 118.0971 52.8161 38.8268 174.7999 662 N 4.8903 7.5239 114.0002 52.0679 39.1822 174.6955 663 S 4.7818 8.1418 112.2308 57.9477 63.6090 175.9680 664 Y 3.8885 8.1589 122.8792 62.1148 39.0959 177.1662 665 I 3.9771 7.9905 119.3024 63.8228 38.5029 177.6256 666 Q 3.9443 8.2221 120.3111 58.3857 28.8745 176.6685 667 R 4.4094 7.6733 115.4818 55.7532 30.1774 175.5325 668 S 4.5877 7.5432 112.1586 56.9524 65.0901 173.5785 669 E 4.1984 8.4526 118.0547 57.8115 30.0243 176.7617 670 H 5.0214 7.9477 115.7776 53.6128 29.1714 172.5193 671 P 4.5834 0.0000 0.0000 64.4104 31.7601 177.5869 672 L 4.3528 7.6657 117.8395 54.2719 43.1934 177.6717 673 A 4.0163 8.1478 122.4187 55.6446 18.1993 179.4654 674 Q 4.0743 8.0314 116.9088 59.2894 28.7133 178.4707 675 L 4.0287 7.6302 119.4658 57.1467 41.6580 178.5668 676 Y 4.7145 7.0977 115.6310 59.4914 39.4409 175.7985 677 C 4.7263 8.5906 125.0741 56.9513 31.8048 173.3187 678 H 4.4944 9.0268 125.1166 57.9604 29.9142 175.5672 679 S 5.5199 7.9036 112.3799 57.8491 63.8146 175.9176 680 I 3.6791 7.6614 123.6276 65.5847 37.4970 177.1142 681 M 3.8555 7.8594 119.0106 58.1800 31.8541 178.3893 682 E 3.9185 8.0468 118.3594 59.6263 29.6187 178.9173 683 H 4.2079 8.3567 116.5003 59.0542 28.7426 177.3294 684 H 4.3743 8.0864 119.9688 59.5285 29.6405 177.0490 685 H 4.1490 8.2154 118.3468 58.8023 28.4420 177.5629 686 F 4.1797 8.3635 122.4696 61.2737 39.1826 176.7778 687 D 4.2358 8.3008 118.6564 57.5778 40.6346 178.9225 688 Q 3.8730 7.9363 118.3355 58.8684 28.6464 178.3291 689 C 3.9933 7.7631 119.6527 62.5190 31.7730 175.4194 690 L 3.7926 7.5784 122.1389 58.2208 41.3434 178.4594 691 M 4.0100 7.8385 117.2867 58.7770 32.4155 178.0552 692 I 3.9040 7.7592 119.8765 64.3762 36.9138 178.4299 693 L 4.2908 8.3847 119.5894 57.0390 41.2060 178.1888 694 N 4.8050 7.6438 113.6740 52.2222 39.7629 175.4130 695 S 4.3254 7.5508 118.7929 57.0998 63.6373 172.0020 696 P 4.3908 0.0000 0.0000 64.5760 31.1777 176.8774 697 G 3.9686 9.0914 109.6885 45.6780 0.0000 173.8467 698 N 5.0853 8.1520 115.8571 53.1490 39.7988 175.0546 699 Q 4.8415 7.9662 119.5345 54.5165 26.7482 176.4803 700 I 3.7546 7.5532 113.5805 62.4407 38.3174 177.6691 701 L 4.5075 7.5938 120.5199 54.3229 41.9619 178.0219 702 S 3.9519 7.8136 115.1122 61.0187 62.7493 175.9318 703 G 3.7745 7.9402 108.1677 46.9670 0.0000 173.7924 704 L 4.6003 7.7340 120.4298 54.0409 42.7084 177.4392 705 S 4.4800 9.2829 117.0638 57.8703 65.1797 175.2009 706 I 3.8342 8.3072 121.8480 64.4510 37.6225 177.8617 707 E 4.0072 8.1562 118.9293 59.3922 29.3843 178.9455 708 E 3.9990 8.2984 118.6974 59.4648 29.4831 178.6732 709 Y 4.1247 8.6627 119.8436 60.8387 38.9982 178.4608 710 K 3.8203 8.3934 119.4815 59.6701 32.1099 179.5717 711 T 3.8623 7.8823 115.9959 66.8634 68.3210 176.9386 712 T 3.7916 8.2036 118.0464 66.6464 68.3843 176.7488 713 L 3.9977 7.8073 120.9918 57.5078 41.5383 179.5626 714 K 3.8156 7.8505 119.3392 59.5580 32.0807 179.0531 715 I 3.7027 7.6883 120.1134 64.2938 37.0070 178.4271 716 I 3.7231 8.1360 121.1628 64.1707 36.8727 178.3125 717 K 3.3524 8.1711 120.5658 59.4800 31.8843 178.6555 718 Q 3.8620 7.9873 117.9795 59.0073 28.4177 178.9722 719 A 3.9395 7.9566 120.5837 55.2797 18.7266 179.5087 720 I 3.9260 7.9398 118.2905 64.5396 37.2094 178.6954 721 L 3.9798 8.2133 119.8700 57.6161 41.1855 179.3051 722 A 4.1033 7.9914 120.1717 54.6248 18.3209 178.7699 723 T 4.3757 7.6114 106.3961 61.5172 69.3357 174.1378 724 D 4.6927 8.1100 123.4642 53.5397 41.1199 176.3451 725 L 4.1127 8.8113 129.3598 58.2749 41.8905 178.6062 726 A 4.0285 8.4652 120.8890 55.0626 18.2902 179.5964 727 L 3.9780 8.0942 117.6379 57.7269 41.6425 179.0473 728 Y 4.0350 7.8827 119.1320 60.9534 38.6782 177.9827 729 I 3.2699 7.5954 119.1735 64.1990 37.2185 178.0858 730 K 4.0371 7.8136 119.6497 58.4741 32.4976 178.1025 731 R 4.3903 7.6492 116.0834 55.9186 30.7193 177.9225 732 R 3.4252 7.6508 119.2079 59.2103 29.9499 178.6499 733 G 3.9588 7.6514 104.3910 48.0866 0.0000 174.7506 734 E 3.9684 8.1604 121.9214 58.6977 29.5980 178.5907 735 F 4.3269 7.6951 119.4584 61.5548 39.4604 177.1258 736 F 4.2677 7.9827 117.5357 60.4726 38.5799 177.5017 737 E 3.9621 8.6547 118.6102 59.4548 29.3671 179.2566 738 L 4.0323 7.9123 118.7701 58.0404 41.8946 179.7253 739 I 3.5791 7.4611 119.5197 64.1991 36.7361 178.3784 740 R 3.8198 7.8115 118.4143 59.3107 30.0036 177.9078 741 K 4.3382 8.1123 115.2654 55.1813 32.4664 176.3836 742 N 4.2173 7.6988 114.9382 54.9958 36.5787 174.7755 743 Q 4.5155 8.4322 113.8676 55.3088 30.0025 176.1229 744 F 4.4826 8.1784 121.4917 58.3676 39.7379 173.8637 745 N 4.4828 10.2093 127.0034 51.4280 40.3666 174.7472 746 L 3.7493 7.8565 126.4560 57.1986 41.8500 178.6492 747 E 3.9741 7.8187 116.7759 58.0006 29.8117 176.7045 748 D 4.5399 7.9934 120.1776 52.6671 42.0648 174.5325 749 P 4.2058 0.0000 0.0000 66.6405 30.9799 177.8718 750 H 4.2223 8.6290 117.6666 59.1379 29.7219 177.3553 751 Q 4.1070 8.2248 119.5043 58.6254 28.6036 178.3517 752 K 4.0265 8.3841 121.1562 59.5067 32.1934 178.4704 753 E 3.9282 8.0507 119.1635 59.1416 29.5511 178.5371 754 L 3.8563 7.9173 120.4161 58.0911 42.1014 178.6856 755 F 3.9308 8.6404 120.9245 61.2766 39.3352 177.0293 756 L 3.6922 8.1488 118.3843 57.6099 41.3632 179.4461 757 A 3.8938 7.6623 120.4370 55.3538 18.2470 179.6524 758 M 3.8448 7.7026 117.2359 58.1753 31.8880 178.7593 759 L 3.6582 7.6093 120.9058 58.1568 42.1226 178.8736 760 M 3.9516 7.7600 118.6117 58.7166 31.8924 178.8903 761 T 3.6756 7.6789 115.4520 66.4681 68.3398 176.3992 762 A 3.7227 7.6749 121.5473 55.5329 18.7813 179.2368 763 C 4.3054 8.1808 115.0534 62.9121 28.0182 175.8170 764 D 4.4281 8.2044 118.8353 56.4367 41.0698 177.2214 765 L 4.7551 7.8895 117.7088 54.3729 42.2408 177.9692 766 S 4.3607 8.2576 116.7221 60.0282 62.5755 176.1601 767 A 4.0642 8.1491 124.3988 55.0311 18.0463 178.7046 768 I 4.0141 8.2882 116.8340 63.0976 38.2384 176.9377 769 T 4.3942 7.8380 108.7354 61.9427 69.6299 175.1067 770 K 4.4018 7.5178 121.9186 55.3702 32.8136 175.4513 771 P 4.3363 0.0000 0.0000 62.8377 32.9595 177.1188 772 W 4.8801 8.8728 131.8736 60.5363 30.5904 176.5439 773 P 3.8369 0.0000 0.0000 65.8353 30.4904 178.3377 774 I 4.0277 7.5967 119.0306 64.1763 37.1784 177.8453 775 Q 4.0107 8.2972 120.6465 59.2127 28.9380 178.3366 776 Q 3.7636 7.6669 119.1904 58.8662 28.7111 179.1082 777 R 3.8430 7.4909 117.5639 59.3591 30.1251 179.2226 778 I 3.8522 8.1480 119.5180 64.3425 36.9853 178.4012 779 A 3.8520 8.5017 122.1085 54.8464 18.1245 179.3191 780 E 3.8465 7.9577 117.6432 59.3737 29.6968 179.0907 781 L 3.9802 7.6600 118.5988 57.6753 41.6672 179.6474 782 V 3.0917 7.4203 117.9053 65.6959 31.3638 177.7955 783 A 3.6997 7.8447 120.7028 55.3932 18.2043 179.6573 784 T 3.9905 7.9658 114.1128 66.8886 68.3600 176.4374 785 E 4.1768 7.9293 120.9536 58.7859 29.7580 178.5822 786 F 4.0711 8.4054 117.1013 60.1821 38.9617 176.8007 787 F 5.0163 8.1491 115.2707 58.1628 39.7585 176.3107 788 D 4.8459 8.2685 117.2877 53.7807 41.2270 176.2566 789 Q 3.2714 8.3336 117.9097 56.8881 27.4782 175.5716 790 G 4.1821 7.6107 103.1307 45.0983 0.0000 176.5181 791 D 4.6102 8.2333 120.7132 55.8955 41.8205 178.7308 792 R 4.7130 7.4380 111.9318 56.2771 33.1118 175.2228 *808 E 4.3293 7.7150 115.1706 56.2402 30.2606 178.0164 809 K 3.5282 8.6483 121.4808 60.6756 31.5080 178.1036 810 K 3.8043 8.0675 119.0031 59.8963 31.6727 177.7906 811 N 4.2906 8.0867 114.6766 54.7496 39.0160 176.6109 812 K 4.3052 8.1394 119.4108 56.9961 32.5267 178.5473 813 I 3.5574 7.0766 120.8260 63.8787 37.0491 176.1038 814 P 4.1648 0.0000 0.0000 65.8028 31.2520 178.8182 815 S 4.1933 8.0353 112.3094 61.5921 62.8873 176.1554 816 M 4.0417 8.0880 122.2768 58.3986 31.6915 178.7116 817 Q 3.8675 7.9885 118.4252 58.7764 28.6353 179.0482 818 V 3.7754 7.8162 119.3918 66.0276 31.5274 178.3255 819 G 3.6518 8.3118 105.5488 47.6989 0.0000 175.4678 820 F 4.3144 8.5167 123.0612 61.1339 39.3935 177.2289 821 I 3.5095 8.2385 119.8255 64.4844 36.7248 178.1927 822 D 4.3024 8.0643 117.9964 57.4599 40.7876 178.5005 823 A 4.1795 8.1249 120.0537 54.2696 18.4572 178.5433 824 I 4.3567 7.6058 116.2160 63.0163 39.1521 177.7050 825 C 4.0786 7.3817 116.5896 62.4424 28.3991 175.4749 826 L 4.0053 8.0411 120.8884 58.3453 41.2137 179.6688 827 Q 3.7257 8.0330 116.8261 58.8247 28.5911 178.7374 828 L 4.2961 7.9303 120.5263 58.7599 42.2636 178.6307 829 Y 4.2657 7.7406 116.3468 60.8162 37.4615 178.4086 830 E 4.0869 8.2440 119.0610 59.2858 29.9457 178.7018 831 A 4.1330 8.2705 121.1289 55.1031 18.4308 179.3859 832 L 4.1873 8.3359 118.8826 58.8441 42.2184 179.4275 833 T 4.1816 7.9963 115.0398 66.8267 68.0636 176.4235 834 H 4.3087 7.7852 117.3780 58.7121 28.7486 177.6296 835 V 4.0907 7.6533 118.9637 64.6432 31.7814 175.9182 836 S 4.4061 8.3449 114.6642 57.0232 64.0214 174.1476 837 E 4.2034 8.8665 128.3492 58.6275 29.3659 178.7913 838 D 4.6746 8.1199 116.4985 56.0049 41.2597 176.8833 839 C 4.3568 8.3757 117.3191 59.5834 28.3493 174.7315 840 F 4.1732 8.3141 126.3967 60.1509 38.7706 175.1544 841 P 4.1512 0.0000 0.0000 65.6047 30.7356 178.4930 842 L 3.4540 7.0608 118.8133 57.2807 41.4413 179.0089 843 L 3.7233 7.2833 119.6913 57.9938 42.1095 178.1558 844 D 4.0106 7.5577 118.3111 57.2922 41.0354 178.5912 845 G 3.9147 7.8515 107.6061 47.2348 0.0000 175.2293 846 C 4.3190 7.7390 122.2444 61.8386 31.6165 175.8388 847 R 3.9133 7.9704 119.6580 59.3405 29.6702 179.2275 848 K 3.9134 8.0146 118.1370 59.5363 31.9713 179.2207 849 N 4.3394 8.2251 116.8669 55.9882 38.4379 177.4925 850 R 4.0566 8.1064 120.3474 59.4282 30.2229 178.2585 851 Q 3.8965 8.0897 119.3016 59.1459 29.0954 178.5633 852 K 3.3321 7.5687 119.2591 59.0884 31.7749 179.5099 853 W 4.5298 8.2709 119.6130 59.7360 28.9355 178.4411 854 Q 4.0361 8.7448 119.9392 59.0297 28.2699 178.0957 855 A 3.9577 7.7753 120.7465 55.3283 18.7448 179.3531 856 L 4.1356 7.8980 116.7381 57.7930 41.4508 179.5032 857 A 4.1561 8.2763 120.5001 55.2431 18.4618 178.9276 858 E 4.2033 8.0757 114.1044 55.5943 29.6645 173.1478 859 Q 3.6710 7.9879 127.5211 55.4506 28.8774 173.6248 860 Q 4.2122 8.6804 120.6014 56.0431 28.9492 175.7708 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 8.44 4.18 0.00 1.93 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 2.14 2.28 0.00 536 E 8.31 4.36 0.00 2.00 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 2.25 2.38 0.00 537 T 8.64 3.79 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 7.84 3.83 0.00 1.90 1.88 0.00 3.22 0.00 0.00 3.25 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.67 0.00 539 E 7.96 3.90 0.00 2.02 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.30 0.00 540 L 8.18 3.85 0.00 1.74 1.77 0.88 0.87 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 3.93 0.00 2.19 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.58 0.00 0.00 0.00 0.00 0.00 2.36 2.38 0.00 542 S 7.78 4.12 0.00 3.92 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 0.00 543 L 7.94 4.09 0.00 1.78 1.74 0.92 1.06 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 8.44 4.09 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 7.75 4.24 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 6.91 4.16 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 0.00 547 V 8.05 3.90 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 0.81 0.00 0.00 0.93 0.00 0.00 548 V 8.25 3.97 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 0.96 0.00 0.00 0.99 0.00 0.00 549 P 0.00 4.47 0.00 2.25 2.07 0.00 3.87 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 2.02 1.99 0.00 550 S 8.54 4.30 0.00 4.10 4.08 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 0.00 551 A 8.49 3.99 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 7.99 3.92 0.00 2.09 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 7.03 0.00 0.00 0.00 0.00 0.00 2.37 2.48 0.00 553 T 7.95 4.05 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 1.24 0.00 0.00 554 L 8.15 4.28 0.00 1.72 1.78 0.99 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 555 K 7.94 4.35 0.00 2.31 2.24 0.00 1.73 0.00 0.00 1.74 0.00 0.00 2.96 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.41 1.63 7.81 556 I 7.25 3.47 1.38 0.00 0.00 0.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.42 0.54 0.00 0.00 557 T 7.74 4.25 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 1.39 0.00 0.00 558 D 7.82 4.67 0.00 2.93 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 0.00 559 F 8.68 4.33 0.00 3.04 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 0.00 560 S 8.10 4.52 0.00 3.92 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 0.00 561 F 7.74 4.06 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 0.00 562 S 7.09 4.17 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 4.66 0.00 2.99 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 7.03 4.43 0.00 3.09 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 8.09 4.23 0.00 2.09 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.25 2.26 0.00 566 L 7.75 4.68 0.00 1.76 1.66 1.18 1.28 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 0.00 567 S 8.95 4.60 0.00 4.03 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 8.50 4.38 0.00 2.67 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 7.90 3.92 0.00 1.73 1.66 0.91 0.99 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 0.00 570 E 8.07 4.04 0.00 2.25 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 3.46 2.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.00 0.00 572 A 7.89 4.08 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 0.00 573 L 8.10 4.01 0.00 1.91 1.77 0.95 0.85 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 0.00 574 C 8.40 4.21 0.00 3.51 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 0.00 575 T 8.29 4.13 4.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 576 I 8.03 3.87 2.10 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 1.43 0.98 0.99 0.00 0.00 577 R 8.19 3.93 0.00 1.93 2.04 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 1.56 1.52 0.00 578 M 7.88 3.25 0.00 1.89 2.19 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 1.68 0.00 579 F 8.31 4.14 0.00 3.37 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 0.00 580 T 8.29 3.97 4.44 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 1.27 0.00 0.00 581 D 8.38 4.71 0.00 3.00 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 7.49 4.54 0.00 1.81 1.75 1.02 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 583 N 8.19 4.42 0.00 2.98 2.90 0.00 0.00 7.01 6.15 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 0.00 584 L 8.17 4.31 0.00 2.15 2.07 0.85 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 585 V 7.93 3.69 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 1.08 0.00 0.00 1.04 0.00 0.00 586 Q 8.00 3.88 0.00 2.21 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.68 0.00 0.00 0.00 0.00 0.00 2.40 2.45 0.00 587 N 8.09 4.20 0.00 2.15 2.05 0.00 0.00 6.95 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 588 F 7.38 4.89 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 0.00 589 Q 7.74 3.31 0.00 2.12 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.27 6.83 0.00 0.00 0.00 0.00 0.00 2.32 2.46 0.00 590 M 7.93 4.27 0.00 1.97 2.01 0.00 0.00 0.00 0.00 0.00 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.75 2.72 0.00 591 K 8.44 4.28 0.00 1.79 1.73 0.00 1.69 0.00 0.00 1.74 0.00 0.00 2.88 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.52 1.49 7.81 592 H 8.94 4.03 0.00 3.24 3.34 0.00 5.87 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 8.20 3.89 0.00 2.08 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 2.36 2.36 0.00 594 V 7.61 3.87 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 1.41 0.00 0.00 0.92 0.00 0.00 595 L 7.97 3.88 0.00 1.65 1.68 0.12 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 596 C 8.12 4.06 0.00 3.11 2.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 597 R 8.19 3.85 0.00 1.95 2.19 0.00 3.23 0.00 0.00 3.09 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 1.61 0.00 598 W 8.44 4.67 0.00 3.56 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 0.00 599 I 8.10 3.33 1.98 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.87 0.85 0.00 0.00 600 L 7.72 3.67 0.00 1.70 1.55 0.84 0.79 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 0.00 601 S 7.70 3.92 0.00 3.80 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 602 V 7.24 3.39 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 1.11 0.00 0.00 -0.38 0.00 0.00 603 K 7.33 3.24 0.00 0.79 1.17 0.00 1.24 0.00 0.00 0.61 0.00 0.00 2.59 0.00 0.00 2.47 0.00 0.00 0.00 0.00 0.94 0.45 7.81 604 K 7.78 3.93 0.00 1.71 1.86 0.00 1.79 0.00 0.00 1.61 0.00 0.00 2.98 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.37 1.40 7.81 605 N 7.73 4.63 0.00 2.71 2.60 0.00 0.00 6.78 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 0.00 606 Y 7.51 4.57 0.00 3.22 3.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 607 R 8.36 4.56 0.00 1.95 2.21 0.00 3.49 0.00 0.00 3.39 7.31 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 8.75 4.14 0.00 1.78 1.92 0.00 1.77 0.00 0.00 1.78 0.00 0.00 3.12 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.52 1.47 7.81 609 N 8.14 4.51 0.00 2.86 2.96 0.00 0.00 5.92 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 7.83 4.75 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 0.82 0.00 0.00 1.13 0.00 0.00 611 A 9.73 4.21 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 0.00 612 Y 8.25 4.57 0.00 2.77 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 0.00 613 H 8.71 4.27 0.00 2.92 3.04 0.00 5.85 0.00 0.00 0.00 0.00 6.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 614 N 7.24 5.25 0.00 2.95 3.21 0.00 0.00 5.72 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 8.92 3.56 0.00 3.27 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 0.00 616 R 7.93 3.53 0.00 1.95 2.03 0.00 3.58 0.00 0.00 3.05 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.69 0.00 617 H 7.84 3.88 0.00 2.46 3.05 0.00 5.78 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 7.22 3.72 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 619 F 7.67 3.58 0.00 1.51 2.52 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 0.00 620 N 8.02 3.99 0.00 2.83 2.76 0.00 0.00 7.09 7.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 621 T 7.68 3.78 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 1.13 0.00 0.00 622 A 7.84 3.94 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 0.00 623 Q 7.68 3.53 0.00 1.21 1.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.75 0.00 0.00 0.00 0.00 0.00 1.58 1.16 0.00 624 C 8.05 4.10 0.00 3.14 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 0.00 625 M 7.97 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 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0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.01 1.21 0.00 0.00 635 Q 8.06 3.98 0.00 2.18 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.81 0.00 0.00 0.00 0.00 0.00 2.36 2.41 0.00 636 N 8.12 4.46 0.00 2.75 2.87 0.00 0.00 6.88 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 8.00 4.32 0.00 1.90 1.83 0.00 1.68 0.00 0.00 1.63 0.00 0.00 3.06 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.43 1.49 7.81 638 L 7.10 4.94 0.00 1.61 1.76 1.02 1.04 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 0.00 639 T 8.93 4.50 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 8.59 4.50 0.00 2.91 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 0.00 641 L 8.02 3.97 0.00 1.73 1.71 0.97 0.98 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 8.14 4.00 0.00 2.24 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 2.35 2.38 0.00 643 I 7.99 3.74 2.09 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.82 0.94 0.00 0.00 644 L 8.31 3.88 0.00 1.73 1.77 0.86 0.47 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 0.00 645 A 8.28 3.97 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 8.14 3.90 0.00 1.82 1.70 0.91 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 647 L 7.85 3.88 0.00 1.60 1.39 0.79 -0.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 648 I 7.78 4.07 1.94 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.92 1.15 0.00 0.00 649 A 8.54 4.15 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 0.00 650 A 8.23 3.96 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 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1.84 1.77 0.00 3.25 0.00 0.00 3.21 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.49 0.00 668 S 7.54 4.59 0.00 3.98 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 0.00 669 E 8.45 4.20 0.00 1.75 1.83 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 2.24 2.26 0.00 670 H 7.95 5.02 0.00 3.25 3.30 0.00 5.62 0.00 0.00 0.00 0.00 6.81 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 4.58 0.00 2.16 2.16 0.00 3.81 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.99 0.00 672 L 7.67 4.35 0.00 1.57 1.31 0.97 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 673 A 8.15 4.02 1.46 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 0.00 0.00 0.00 674 Q 8.03 4.07 0.00 2.05 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.87 0.00 0.00 0.00 0.00 0.00 2.30 2.30 0.00 675 L 7.63 4.03 0.00 1.28 1.58 0.79 1.04 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 8.09 4.37 0.00 3.12 3.29 0.00 5.79 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 685 H 8.22 4.15 0.00 3.39 3.36 0.00 5.67 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 0.00 686 F 8.36 4.18 0.00 3.16 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 0.00 687 D 8.30 4.24 0.00 2.95 2.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 688 Q 7.94 3.87 0.00 2.12 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.80 0.00 0.00 0.00 0.00 0.00 2.25 2.29 0.00 689 C 7.76 3.99 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 0.00 690 L 7.58 3.79 0.00 1.01 1.47 0.94 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 0.00 691 M 7.84 4.01 0.00 2.14 2.10 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 2.59 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0.00 0.00 -0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.67 0.09 0.57 0.00 0.00 701 L 7.59 4.51 0.00 1.82 1.84 1.00 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 702 S 7.81 3.95 0.00 3.95 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 0.00 703 G 7.94 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 704 L 7.73 4.60 0.00 1.82 1.70 0.91 1.02 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 0.00 705 S 9.28 4.48 0.00 4.04 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 8.31 3.83 1.90 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.51 0.95 0.00 0.00 707 E 8.16 4.01 0.00 2.06 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 2.43 2.37 0.00 708 E 8.30 4.00 0.00 2.36 2.07 0.00 0.00 0.00 0.00 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0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 734 E 8.16 3.97 0.00 2.06 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 2.49 2.45 0.00 735 F 7.70 4.33 0.00 3.08 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 0.00 736 F 7.98 4.27 0.00 3.18 2.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 737 E 8.65 3.96 0.00 2.21 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 2.54 2.52 0.00 738 L 7.91 4.03 0.00 1.97 2.01 1.21 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 0.00 0.00 0.00 0.00 0.00 0.00 739 I 7.46 3.58 1.69 0.00 0.00 0.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.76 0.46 0.61 0.00 0.00 740 R 7.81 3.82 0.00 1.85 2.12 0.00 3.24 0.00 0.00 3.21 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.63 0.00 741 K 8.11 4.34 0.00 1.74 1.81 0.00 1.92 0.00 0.00 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0.00 0.00 791 D 8.23 4.61 0.00 2.80 2.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 792 R 7.44 4.71 0.00 1.85 1.87 0.00 3.33 0.00 0.00 3.25 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.62 0.00 *808 E 7.71 4.33 0.00 2.03 1.64 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 2.26 2.31 0.00 809 K 8.65 3.53 0.00 1.40 0.96 0.00 1.51 0.00 0.00 1.33 0.00 0.00 2.83 0.00 0.00 2.91 0.00 0.00 0.00 0.00 0.62 1.17 7.81 810 K 8.07 3.80 0.00 1.80 1.82 0.00 1.72 0.00 0.00 1.83 0.00 0.00 3.00 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.54 1.59 7.81 811 N 8.09 4.29 0.00 2.72 2.86 0.00 0.00 7.01 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 0.00 812 K 8.14 4.31 0.00 1.75 1.78 0.00 1.67 0.00 0.00 1.61 0.00 0.00 2.91 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.35 1.52 7.81 813 I 7.08 3.56 1.94 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 1.52 0.85 0.51 0.00 0.00 814 P 0.00 4.16 0.00 2.29 2.62 0.00 3.75 0.00 0.00 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.59 0.00 815 S 8.04 4.19 0.00 4.06 4.15 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 0.00 816 M 8.09 4.04 0.00 2.08 2.21 0.00 0.00 0.00 0.00 0.00 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.80 2.62 0.00 817 Q 7.99 3.87 0.00 1.28 1.56 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 1.63 1.16 0.00 818 V 7.82 3.78 2.28 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 1.14 0.00 0.00 1.12 0.00 0.00 819 G 8.31 3.65 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 0.00 0.00 0.00 820 F 8.52 4.31 0.00 3.09 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 8.24 3.51 2.07 0.00 0.00 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.91 0.95 0.00 0.00 822 D 8.06 4.30 0.00 2.66 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 8.12 4.18 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 0.00 824 I 7.61 4.36 1.27 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 1.55 1.16 0.91 0.00 0.00 825 C 7.38 4.08 0.00 3.02 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 8.04 4.01 0.00 1.64 1.73 0.97 0.93 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 0.00 827 Q 8.03 3.73 0.00 2.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.90 0.00 0.00 0.00 0.00 0.00 2.13 2.29 0.00 828 L 7.93 4.30 0.00 1.93 1.55 1.10 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.00 0.00 0.00 0.00 0.00 0.00 829 Y 7.74 4.27 0.00 3.13 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 0.00 830 E 8.24 4.09 0.00 2.03 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.48 0.00 831 A 8.27 4.13 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 0.00 832 L 8.34 4.19 0.00 2.03 2.00 1.19 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 833 T 8.00 4.18 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 1.33 0.00 0.00 834 H 7.79 4.31 0.00 3.35 3.30 0.00 5.65 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 0.00 835 V 7.65 4.09 2.39 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 0.83 0.00 0.00 0.88 0.00 0.00 836 S 8.34 4.41 0.00 3.94 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 0.00 837 E 8.87 4.20 0.00 2.08 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.38 2.31 0.00 838 D 8.12 4.67 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 0.00 839 C 8.38 4.36 0.00 3.20 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 0.00 840 F 8.31 4.17 0.00 3.21 3.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 841 P 0.00 4.15 0.00 2.13 2.31 0.00 3.73 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 1.49 2.23 0.00 842 L 7.06 3.45 0.00 1.48 1.00 0.89 0.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.54 0.00 0.00 0.00 0.00 0.00 0.00 843 L 7.28 3.72 0.00 1.68 1.49 0.96 1.24 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 0.00 844 D 7.56 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 7.85 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 7.74 4.32 0.00 2.84 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 0.00 847 R 7.97 3.91 0.00 1.99 1.93 0.00 3.13 0.00 0.00 3.17 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.75 0.00 848 K 8.01 3.91 0.00 1.90 1.78 0.00 1.61 0.00 0.00 1.61 0.00 0.00 2.93 0.00 0.00 3.28 0.00 0.00 0.00 0.00 1.40 1.59 7.81 849 N 8.23 4.34 0.00 3.04 3.17 0.00 0.00 6.62 7.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 850 R 8.11 4.06 0.00 1.95 2.11 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 1.68 1.71 0.00 851 Q 8.09 3.90 0.00 2.16 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.58 0.00 0.00 0.00 0.00 0.00 2.28 2.47 0.00 852 K 7.57 3.33 0.00 0.79 0.74 0.00 0.61 0.00 0.00 0.96 0.00 0.00 2.59 0.00 0.00 2.47 0.00 0.00 0.00 0.00 1.01 0.39 7.81 853 W 8.27 4.53 0.00 3.44 3.37 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 0.00 854 Q 8.74 4.04 0.00 2.25 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.80 0.00 0.00 0.00 0.00 0.00 2.37 2.43 0.00 855 A 7.78 3.96 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 856 L 7.90 4.14 0.00 2.17 1.95 1.18 1.07 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 0.00 857 A 8.28 4.16 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 0.00 858 E 8.08 4.20 0.00 2.10 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 2.69 0.00 859 Q 7.99 3.67 0.00 2.19 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.05 6.85 0.00 0.00 0.00 0.00 0.00 2.49 2.34 0.00 860 Q 8.68 4.21 0.00 2.06 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.02 6.65 0.00 0.00 0.00 0.00 0.00 2.31 2.36 0.00 * Residues marked with a * may have inaccurate shift predictions.