NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 515 T 4.2689 8.1749 115.2424 61.3233 68.1811 173.4086 516 L 3.7260 8.6698 128.5117 53.0289 40.7114 175.0929 517 P 4.1386 0.0000 0.0000 63.2287 33.0231 175.4274 518 F 4.1394 6.9864 116.2123 59.1752 36.9213 176.3476 519 T 4.5108 7.3828 108.5033 62.1702 70.7804 173.8458 520 T 5.0689 7.9230 120.6132 62.2829 70.3869 173.7832 521 G 4.4125 9.0802 114.6994 45.1549 0.0000 172.2538 522 L 5.6546 8.8562 123.4890 52.9020 45.1098 175.5553 523 I 5.0986 8.6106 122.6222 59.8974 40.1664 173.9572 524 Y 4.7437 8.6355 126.9282 56.6900 42.6999 173.0570 525 D 4.2858 6.8767 121.3873 51.6147 44.3196 176.5416 526 S 3.8860 8.2379 120.7789 60.6962 62.9474 176.4955 527 V 3.1140 7.5069 122.9241 66.5157 30.7223 177.6192 528 M 4.0580 7.2423 115.9256 57.3401 31.6834 178.2931 529 L 4.0705 7.5286 119.4643 57.0735 41.5252 178.6443 530 K 3.7711 7.4115 116.0356 57.6321 32.2311 177.5051 531 H 4.4423 7.2840 119.1232 55.5550 27.8551 173.4978 532 Q 4.4046 7.7130 121.8203 53.2442 32.5958 174.7704 533 C 4.1362 8.4132 121.8101 59.4960 32.0456 174.5932 534 S 4.3152 8.4909 119.3045 60.2206 61.5916 174.8104 535 C 4.2104 8.1434 116.0852 58.7163 29.8449 174.2979 536 G 3.8416 7.7443 107.6153 46.5391 0.0000 173.4799 537 D 4.6916 7.3757 118.0829 51.5128 41.7408 175.8218 538 N 4.4511 8.5562 124.4422 55.5152 39.0606 177.7043 539 S 4.0150 8.0378 112.8896 61.0149 62.4089 174.9625 540 R 4.4160 7.3259 111.8715 56.2511 28.7038 176.6269 541 H 4.8497 7.6156 117.2252 53.1637 29.4285 171.9348 542 P 4.2691 0.0000 0.0000 65.0636 31.7948 177.9110 543 E 3.9999 6.4356 118.3725 54.3973 27.9195 174.4317 544 H 4.9107 7.4200 117.6398 52.4715 31.6049 175.8411 545 A 4.1088 8.6427 121.8029 55.3954 17.8922 180.0646 546 G 3.8374 8.4390 103.7825 48.1240 0.0000 175.3520 547 R 3.9763 7.6166 119.8071 59.7872 30.1751 179.0085 548 I 4.0122 7.7321 111.8418 63.8949 38.0084 177.8746 549 Q 4.1491 8.0317 120.6502 58.9527 28.9801 178.0104 550 S 4.1831 8.3591 115.4965 61.7749 62.9292 176.5656 551 I 3.7617 7.6828 123.7864 63.6454 36.7125 178.1708 552 W 4.3852 8.3824 129.4780 60.5385 30.4591 178.2271 553 S 3.9228 8.0219 113.7852 61.1256 62.6349 176.0648 554 R 3.7757 7.7084 121.9901 59.4027 29.7221 178.2243 555 L 3.8222 7.7046 118.3776 57.7516 41.5393 179.4568 556 Q 3.6621 7.2737 119.2476 59.1131 28.8333 177.7277 557 E 3.8597 8.2069 118.3695 59.7801 29.5072 178.8329 558 R 4.0463 7.8057 113.7469 56.4656 30.1282 177.0559 559 G 3.8172 7.8735 106.1528 46.9557 0.0000 175.4990 560 L 4.2718 7.9151 122.0308 56.3931 42.1109 178.6188 561 R 3.7941 7.8324 117.9214 59.5091 29.7715 178.8868 562 S 4.3268 7.9062 111.3705 60.8441 62.1877 175.5530 563 Q 4.1843 8.3468 121.4064 56.4771 28.7591 174.7736 564 C 5.2348 7.1971 117.2654 57.4358 31.3710 173.7999 565 E 4.1714 8.9527 123.0848 56.7631 29.8045 175.3083 566 C 5.2015 8.6975 125.3092 59.3328 29.4523 173.3328 567 L 4.9508 9.5277 122.8278 53.2804 44.7745 177.6821 568 R 4.4772 8.3773 118.8398 55.7720 31.0257 177.7799 569 G 3.9629 9.7664 103.7324 46.5779 0.0000 171.3070 570 R 2.5100 6.2431 112.6491 54.5085 32.2286 173.9320 571 K 4.1826 7.7880 118.8020 55.8147 32.6992 177.4163 572 A 4.3448 8.2932 126.6770 51.8428 19.1884 177.8250 573 S 4.3315 9.1467 115.8247 57.4636 64.4592 175.3653 574 L 3.8731 8.5229 121.4565 58.1466 41.0180 179.4888 575 E 3.9149 8.0264 117.5661 59.2560 29.9547 178.2020 576 E 4.1027 8.1327 118.5767 59.4408 29.5660 179.1502 577 L 3.8870 7.8392 118.8790 58.0204 40.1527 179.1821 578 Q 5.1111 8.2718 117.3506 56.6280 28.5191 177.9966 579 S 4.1721 7.8452 115.5025 60.2356 63.2842 174.8962 580 V 4.1072 7.4454 119.9391 63.2123 33.7215 174.7179 581 H 5.1246 7.9947 115.7447 53.2784 31.4970 173.9958 582 S 4.4819 8.2529 116.5644 57.9166 63.8073 175.1297 583 E 3.9578 8.8129 122.1286 59.4383 29.3572 179.2347 584 R 3.9050 7.9643 115.7870 59.4822 29.4407 178.2024 585 H 4.1301 8.3027 118.9641 58.9748 29.9415 177.3856 586 V 3.8202 7.9335 120.0527 66.2316 30.9513 178.0353 587 L 4.0929 8.0998 118.7159 57.4416 41.1605 179.2542 588 L 3.4629 7.6868 119.4716 58.0324 42.1343 178.0126 589 Y 4.5443 7.7499 113.4811 58.0936 38.7081 176.6188 590 G 4.1645 8.7475 107.9536 45.5617 0.0000 173.3431 591 T 4.8056 7.4396 108.6723 59.7323 72.0056 172.8059 592 N 5.1550 8.2600 118.0231 50.6901 41.8054 172.3190 593 P 4.6370 0.0000 0.0000 62.0078 31.8492 175.9766 594 L 4.6778 8.2433 123.3972 53.5210 41.8079 176.2756 595 S 4.3001 8.5554 121.2016 58.6840 62.9859 174.1669 *596 R 4.4304 8.2812 118.5020 55.9455 28.9760 175.0163 597 L 4.0151 7.4704 123.0859 56.4989 42.4223 177.9500 598 K 4.3663 8.4353 127.4937 53.3372 30.9136 173.9843 599 L 4.8711 7.9522 124.6038 51.4249 44.7903 177.4672 600 D 4.6001 8.3529 122.1698 53.3533 41.4760 177.3733 601 N 4.5290 8.7078 117.6324 55.9494 38.6495 177.9754 602 G 3.6032 8.1309 107.2171 47.7094 0.0000 175.7710 603 K 3.9996 8.2276 121.0888 59.1385 31.8643 179.4036 604 L 3.9651 7.6761 117.8325 57.8818 41.9575 179.2584 605 A 4.2279 8.4920 121.1381 54.7953 18.3632 180.0076 606 G 3.5142 7.8960 104.0970 48.0037 0.0000 176.0168 607 L 4.2237 7.7029 120.0611 56.9598 41.1704 179.0562 608 L 4.1881 7.7523 118.5648 57.0095 41.4883 178.8381 609 A 4.1815 7.6398 119.6212 55.3627 18.5683 177.0614 610 Q 4.3069 7.1951 116.0898 54.6412 31.8054 175.0137 *614 V 3.8390 8.0841 118.3712 63.4813 32.8716 174.8391 615 M 4.5766 8.7080 128.3238 55.3222 32.9414 175.7751 616 L 4.5616 8.8871 126.3784 52.9404 43.3296 175.8730 617 P 4.2762 0.0000 0.0000 66.0476 31.2496 177.5584 618 C 4.2544 8.0112 109.9118 58.7531 29.8536 174.4367 619 G 3.9220 8.2260 109.4671 45.3216 0.0000 173.9513 620 G 3.9838 7.6311 106.9742 45.6452 0.0000 173.0849 621 V 4.6618 8.3518 119.8557 62.2647 33.2674 174.8467 622 G 4.7145 8.7943 112.3964 44.9967 0.0000 173.3085 623 V 4.0026 8.9960 121.0182 63.8457 32.0379 175.5603 624 D 4.6991 7.5648 117.7868 51.8173 42.1819 174.8939 625 T 3.9838 8.7915 108.3449 65.4542 68.4004 174.9149 626 D 4.5129 8.1564 120.2861 56.0504 41.3401 176.3547 627 T 4.4925 8.5240 117.8704 62.1190 67.9067 173.8908 628 I 4.6339 8.2056 120.1598 59.8804 39.5174 175.4629 629 W 4.9668 8.8969 133.3061 55.6287 33.1783 174.1624 630 N 4.4496 8.8184 128.2572 52.9915 38.6989 175.9450 631 E 4.0596 8.8784 126.2882 58.6886 30.0929 178.0820 632 L 4.1678 7.9215 118.1988 56.5253 42.4800 177.7908 633 H 4.7308 7.6597 113.5917 56.3155 30.5700 176.6299 634 S 3.7148 7.2968 117.2646 61.0840 62.3731 176.5066 635 S 4.2937 7.0884 115.3661 61.3583 62.1835 175.6944 636 N 4.3717 8.0446 118.4125 56.3918 38.3138 176.9113 637 A 3.9373 7.7946 121.6530 55.2902 18.5231 179.6138 638 A 4.0706 8.0925 119.1644 55.3821 18.4559 180.1224 639 R 3.9822 8.3899 116.7379 59.0621 30.0920 179.1258 640 W 4.1330 8.9614 129.6875 59.6965 30.8447 177.6989 641 A 4.0955 8.5329 120.8717 55.4880 17.8263 179.5823 642 A 4.2266 7.6047 120.3791 54.6838 18.4189 180.1403 643 G 3.4394 7.9282 103.8488 47.6971 0.0000 176.1156 644 S 4.0405 8.0340 117.5142 61.4733 62.8817 176.9535 645 V 3.6362 7.7008 120.4803 66.2325 31.2870 178.1268 646 T 3.9676 7.9495 115.5706 66.8078 68.2869 176.3476 647 D 4.4572 8.2437 120.7667 57.1234 40.6339 178.3731 648 L 4.0019 8.1282 120.6962 58.1984 41.9785 178.9648 649 A 4.0407 8.1218 120.4495 55.3254 18.3222 179.5262 650 F 3.9044 8.3665 116.2688 60.5645 38.9474 177.8740 651 K 3.9631 8.0796 117.6800 59.6202 31.9244 179.4742 652 V 3.8426 7.7827 117.9493 65.4763 31.2920 177.7319 653 A 3.9853 8.0922 119.8224 55.3445 18.3083 179.5446 654 S 4.1714 8.2527 110.9220 58.9483 63.7730 173.9228 655 R 4.0089 7.7475 121.4830 57.4523 28.3097 176.2433 656 E 4.2464 8.4103 118.3888 57.2660 30.5759 175.5906 657 L 5.0117 7.6631 117.5166 52.6265 45.7165 177.0797 658 K 4.3260 10.7800 119.9613 59.5194 34.0498 176.0757 659 N 5.3811 7.4815 116.4210 52.5098 41.0074 172.3500 660 G 4.5028 8.3592 105.4163 46.5880 0.0000 172.0493 661 F 5.3728 8.9469 121.4866 56.3546 42.7533 173.2149 662 A 4.6701 8.9677 129.1532 50.7005 20.2575 176.1201 663 V 4.7179 8.7776 124.7304 62.0775 30.0250 175.2835 664 V 4.6026 7.9067 116.6717 59.0118 35.1584 175.1716 665 R 4.7163 8.0856 117.7464 53.8575 32.1716 172.7934 666 P 4.6207 0.0000 0.0000 61.9127 31.9092 173.9985 667 P 4.6775 0.0000 0.0000 62.5113 32.5666 176.7763 668 G 4.2061 9.4691 104.9099 44.0974 0.0000 174.7002 669 H 4.3421 8.4829 114.5472 57.8963 28.7995 176.2958 670 H 4.4177 7.9560 115.3936 56.1880 29.5364 174.7976 671 A 4.2777 8.0412 124.7090 51.4368 19.1238 176.6027 672 D 5.1837 8.3565 123.0027 52.0576 44.0246 176.0074 673 H 4.2084 9.8420 120.1049 58.3375 29.5981 176.5388 674 S 4.8917 7.6690 111.8022 57.8056 63.4497 173.7900 675 T 4.5105 7.9825 117.0442 63.0262 71.8671 173.1415 676 A 4.6886 8.2834 129.6338 50.7274 20.5936 175.7817 677 M 4.2214 7.8821 116.9220 55.8771 34.1593 174.6584 678 G 3.2910 9.4167 105.4078 46.8086 0.0000 174.8109 679 F 4.3058 8.2731 116.8221 57.2192 38.1698 175.0918 680 C 5.1907 7.4554 117.7959 57.1359 30.7030 173.8653 681 F 4.0258 8.7304 119.3897 58.3480 41.0159 175.6091 682 F 5.0677 7.7428 117.6814 55.4084 42.1321 174.2576 683 N 5.0250 8.9372 122.6406 52.1805 37.0031 175.4314 684 S 4.2150 8.4754 121.9582 61.3180 63.2790 176.0889 685 V 3.6539 7.8265 119.8396 66.0945 31.4012 177.8471 686 A 4.3547 8.2175 120.0221 55.0136 18.1623 179.7683 687 I 3.6544 8.0381 118.2988 64.5138 37.1814 178.1329 688 A 4.0042 8.1393 121.7156 55.5046 18.0740 178.9490 689 C 3.8572 8.1840 116.8816 63.0099 31.5866 176.2060 690 R 4.0538 8.1976 119.3267 59.2280 29.6682 179.1784 691 Q 4.0617 8.2835 117.8399 59.1214 28.9912 178.4368 692 L 3.2540 7.7416 120.3232 58.1518 41.4551 179.9420 693 Q 4.0287 7.5276 115.8486 58.4725 28.7152 177.9271 694 Q 4.1394 7.9528 120.2063 59.3108 29.2390 178.0202 695 Q 4.6517 7.8675 115.6615 56.2172 29.6776 176.1876 696 S 4.4683 7.9679 115.4579 56.0629 64.8692 173.3731 697 K 4.0482 8.4699 124.6104 57.4976 32.2916 177.8437 698 A 3.7445 8.7806 123.9685 52.1655 16.6396 178.2237 699 S 4.4046 7.6217 110.2933 58.3781 63.7237 173.7659 700 K 4.7836 9.3490 122.0223 54.7830 34.5459 175.1259 701 I 4.9761 8.9068 125.7467 59.3437 40.5979 174.1293 702 L 4.9841 8.6553 128.4733 53.4336 44.3084 174.8091 703 I 4.8885 8.9031 127.5719 59.5746 39.8599 174.5532 704 V 4.4487 8.3239 127.4843 61.1254 33.3056 173.8120 705 D 5.2156 9.1696 128.8137 52.4362 42.7228 175.5358 706 W 5.2007 8.2314 122.5244 55.9198 29.1177 176.1756 707 D 4.7281 7.7097 120.6303 54.9440 41.1390 177.3074 708 V 4.0061 9.3053 124.8834 64.2668 31.6972 175.7363 709 H 5.3141 8.5885 117.8139 54.2746 30.0672 174.4524 710 H 4.2831 8.9209 122.9379 56.4006 30.5771 177.1569 711 G 3.8797 8.6974 116.5263 42.0109 0.0000 173.5920 712 N 4.2046 7.9729 123.7003 56.6567 37.4190 177.4842 713 G 3.8904 7.5150 109.0915 46.9338 0.0000 175.7715 714 T 3.6626 7.5410 117.5786 66.2578 68.3185 175.9719 715 Q 3.7950 7.2411 120.1652 59.5996 29.0510 178.6531 716 Q 3.9968 7.9025 118.4979 59.2021 28.4956 178.7797 717 T 3.6061 7.6534 115.8524 65.8500 68.7817 175.1515 718 F 4.9036 7.4096 116.4460 57.2301 39.6634 176.7067 719 Y 4.1936 7.9315 125.0197 60.2614 38.5622 177.6465 720 Q 4.6438 8.0521 116.5259 55.5119 29.7458 174.9895 721 D 4.7330 7.8334 119.1441 51.4653 41.5275 174.4481 722 P 3.4011 0.0000 0.0000 64.0065 31.4656 177.4607 723 S 4.4272 8.5770 114.4077 59.3897 64.2645 173.8035 724 V 4.7387 7.5554 120.7058 60.9907 34.0366 174.1521 725 L 4.6114 8.6908 130.4153 53.5711 43.8156 174.0365 726 Y 5.1481 8.7253 128.1948 56.0329 41.0716 174.1786 727 I 4.4940 8.6415 127.7862 59.6046 39.9914 174.2145 728 S 4.9073 8.2960 122.7631 56.3705 64.5768 172.5795 729 L 4.9710 8.5983 127.2173 53.3527 43.1506 175.5542 730 H 5.3041 8.4085 118.1182 54.1297 32.5148 172.7485 731 R 4.6563 9.0411 121.6315 56.7755 29.7029 174.2864 732 H 4.7763 9.2720 123.7324 58.0135 32.1572 174.6767 733 D 4.2752 8.8962 115.9347 55.8129 38.6373 173.0231 734 D 4.2983 9.2452 110.7077 55.5866 39.6501 173.8387 735 G 3.8951 8.2050 103.8173 45.6340 0.0000 173.6232 736 N 5.0088 7.7535 114.7192 52.4688 39.2791 174.0538 737 F 5.0215 7.8315 119.8113 55.6673 42.5763 173.8741 738 F 4.0732 7.8780 128.5020 58.3043 39.4136 172.8962 739 P 3.3109 0.0000 0.0000 62.0872 31.1914 176.5431 740 G 3.7988 8.5260 107.3695 45.6363 0.0000 173.4642 741 S 4.5891 7.6120 113.5027 57.1485 65.5219 173.1109 742 G 3.2722 8.0475 104.5355 46.1948 0.0000 174.0955 743 A 3.9460 7.9021 121.0364 51.1714 19.3704 179.7055 744 V 3.7768 8.2354 119.9255 64.7034 31.3529 177.2155 745 D 4.4429 7.9428 117.4628 54.3418 39.6871 176.2775 746 E 4.4483 7.9837 119.8040 55.6177 28.2879 176.5765 747 V 4.7055 7.6680 115.8842 59.7003 32.7142 175.9316 748 G 2.7257 8.3702 104.9790 44.1889 0.0000 172.2868 749 A 4.5631 7.7279 119.8405 51.0679 23.4347 177.3297 750 G 3.7104 8.4957 107.3152 46.2882 0.0000 176.8506 751 S 4.0884 9.0403 117.1432 61.4081 63.0722 175.3056 752 G 3.9231 8.1327 107.3438 44.9825 0.0000 172.6873 753 E 3.7769 7.8170 121.8863 57.5551 29.5998 177.0430 754 G 3.0419 8.2584 115.5164 44.7867 0.0000 173.6093 755 F 4.8865 8.2339 117.6712 57.0006 40.7797 174.3304 756 N 5.4255 8.0728 118.4769 51.8686 41.8197 173.1730 757 V 4.2071 9.2060 127.0697 61.2874 33.9854 174.3712 758 N 4.8034 8.6822 126.9279 51.9348 39.0570 175.8361 759 V 3.5356 8.7861 126.6462 61.8596 30.4515 173.0310 760 A 3.9386 7.6171 123.9731 49.7552 19.0334 176.7364 761 W 4.6299 8.8057 122.4460 57.6538 30.1066 175.9378 762 A 5.0575 9.2275 126.4725 50.8622 21.0176 176.6352 763 G 4.0267 7.7142 105.5971 45.7179 0.0000 175.8239 764 G 3.9536 8.2560 105.3824 45.2482 0.0000 173.4659 765 L 4.4666 8.4785 117.6340 55.2109 43.2921 176.1855 766 D 4.7966 7.8067 118.1287 51.6783 42.0258 174.5264 767 P 4.5095 0.0000 0.0000 61.2083 32.3306 173.5853 768 P 4.4951 0.0000 0.0000 62.7625 32.3437 175.3072 769 M 3.9533 8.3392 124.5501 54.1433 33.3803 173.6004 770 G 3.8467 9.6189 117.1770 44.9088 0.0000 173.6024 771 D 4.2524 9.0676 119.4318 57.3340 40.9104 177.0558 772 P 4.1523 0.0000 0.0000 65.3126 31.3596 178.6166 773 E 3.8548 7.8750 117.0483 59.5768 29.4212 178.8621 774 Y 3.9892 8.0714 116.7282 61.0011 37.9597 178.3252 775 L 3.8176 8.1623 120.1263 57.7660 41.6676 179.5776 776 A 3.9913 8.1429 120.3761 54.9883 18.2532 179.2922 777 A 3.9450 8.6637 119.7281 55.5770 18.3335 179.9276 778 F 3.6924 8.5480 116.0419 60.6454 38.7392 178.1924 779 R 3.9054 7.9838 116.5402 59.1196 29.9719 178.4874 780 I 4.1003 7.7120 117.6958 62.3322 38.1201 176.6301 781 V 4.0120 7.6820 116.3266 64.2806 33.0462 177.7450 782 V 3.1316 7.1253 116.9500 66.1030 31.3902 177.8393 783 M 3.8926 7.8283 118.3501 57.9610 31.9296 177.0513 784 P 4.2037 0.0000 0.0000 65.5876 31.4159 178.8085 785 I 3.2518 7.3869 118.0217 64.0127 36.8583 178.2447 786 A 3.8935 7.7196 121.5958 55.3110 17.9274 179.9701 787 R 3.9223 7.8803 115.6941 59.1197 30.4052 178.5810 788 E 4.1912 8.1936 119.2608 59.2145 29.4961 178.5347 789 F 4.6633 8.4148 119.9581 59.9926 40.8853 174.3553 790 S 3.6587 8.1954 111.2028 58.1239 60.1698 169.0740 791 P 4.3040 0.0000 0.0000 62.5963 32.4069 178.0412 792 D 4.5239 8.7303 121.2671 57.1430 41.4698 176.4291 793 L 4.6612 7.7476 118.0970 53.5520 46.2696 174.5335 794 V 4.7863 8.6756 123.9691 61.1997 34.0156 174.1272 795 L 5.1131 8.7011 128.1589 53.1675 44.1781 175.5791 796 V 4.4055 8.6758 123.3439 61.1668 33.9747 174.9458 797 S 4.4884 8.7799 124.8520 57.8399 62.5703 172.8058 798 A 3.8257 8.3496 130.2752 50.0472 17.3050 176.1333 799 G 3.6894 7.6942 107.9494 44.6172 0.0000 171.2331 800 F 5.0032 8.7205 119.2527 57.0427 39.8101 176.8309 801 D 4.1551 8.3206 119.1790 54.3715 39.8060 176.5009 802 A 4.3343 8.1161 122.3341 52.6340 19.3232 177.1539 803 A 4.8609 7.9033 119.8324 51.2768 19.1901 176.9208 804 E 4.1537 8.3986 121.7286 57.6321 29.9365 176.9025 805 G 3.8452 8.7059 112.4057 45.6761 0.0000 173.0990 806 H 4.7785 7.9708 118.6184 52.9249 30.2567 172.8788 807 P 4.6286 0.0000 0.0000 62.7266 31.9969 177.0482 808 A 3.9301 8.3753 121.2550 55.1792 18.7134 178.3915 809 P 4.5375 0.0000 0.0000 64.9845 31.5619 177.0381 810 L 4.6696 8.4378 117.2308 53.6810 41.6124 178.3049 811 G 4.2939 7.8087 115.3787 42.4284 0.0000 173.4452 812 G 3.8813 8.0564 108.2601 45.0914 0.0000 172.4662 813 Y 4.8063 7.5181 117.2928 56.7551 40.1675 174.9479 814 H 4.7913 8.4280 115.9534 55.6071 30.1643 174.6478 815 V 3.6891 7.9955 119.5807 62.7333 32.0878 175.2738 816 S 5.0053 8.7485 121.4533 56.6314 66.2856 175.2747 817 A 4.1771 8.4937 124.0652 55.5599 18.1004 180.1854 818 K 4.0092 8.1091 116.4095 59.6269 32.1558 178.9445 819 C 4.0675 8.1012 118.7530 62.5967 31.5056 175.5310 820 F 3.8186 7.8328 119.4489 60.3850 38.5491 177.8177 821 G 3.7917 8.5699 105.6682 48.2358 0.0000 175.1483 822 Y 4.5168 8.6353 122.5627 60.5026 38.7898 177.6077 823 M 3.3785 8.2678 120.1961 58.3404 31.9952 178.7106 824 T 4.2278 8.0619 115.8370 66.9727 68.5025 176.3403 825 Q 4.1022 7.8503 119.8057 59.2928 29.3519 178.1614 826 Q 4.1304 8.1751 119.0241 59.0639 28.7443 178.6976 827 L 4.1852 8.2003 119.8412 58.0055 41.7391 179.4182 828 M 4.1484 8.1949 118.3704 58.0851 31.6302 177.8176 829 N 4.6257 8.0990 115.0679 53.8585 39.1474 174.8582 830 L 4.5327 7.6211 121.1950 53.9212 43.8543 175.9457 831 A 3.9320 8.5598 119.9848 52.7044 15.8982 179.0179 832 G 3.6936 9.2835 104.4959 47.8495 0.0000 175.6654 833 G 4.1823 8.5759 107.3874 44.0178 0.0000 174.9614 834 A 4.9370 7.7363 122.3112 50.8463 17.7200 175.3875 835 V 4.8264 8.1644 119.7452 61.2492 35.1085 173.9457 836 V 4.8495 8.6618 127.4287 61.2321 34.0743 174.2369 837 L 4.8619 9.1102 128.6132 53.7052 43.8072 175.7719 838 A 4.7432 8.3713 123.3058 49.5967 22.2765 175.3338 839 L 4.1851 8.4176 125.5179 55.7690 42.9009 174.0270 840 E 4.3744 8.6069 123.1943 56.9194 31.6902 179.6797 841 G 4.0017 6.9540 125.0587 44.4548 0.0000 172.6962 842 G 4.3860 9.4188 107.4568 46.4043 0.0000 173.2077 843 H 4.9179 8.8411 117.3080 54.0816 30.3038 173.4216 844 D 4.4403 7.9792 121.1159 53.9011 41.8212 176.1381 845 L 4.0638 8.6020 127.8733 58.0328 41.8340 179.5296 846 T 3.8150 7.8683 108.9722 64.7518 68.8697 175.9654 847 A 3.9848 8.4722 124.7285 54.8794 18.3572 179.7551 848 I 3.6248 8.2385 111.7677 64.1069 37.6890 178.2780 849 C 4.0854 8.3941 118.8295 62.6594 27.9058 175.5913 850 D 4.2704 8.4546 120.5751 57.2991 40.3583 178.7030 851 A 3.7615 7.7041 120.9238 55.3089 18.1570 179.8364 852 S 3.8277 7.7834 113.8683 61.4604 62.7905 176.5479 853 E 3.7424 8.0861 121.6818 59.1952 29.1989 178.7122 854 A 3.9724 8.0975 120.9103 55.4806 18.4791 179.4198 855 C 4.2838 8.3376 115.4795 63.0327 28.2763 176.6125 856 V 3.5599 8.0528 120.0565 65.8080 31.1050 177.7269 857 A 3.9839 8.2084 120.5010 55.2640 18.1131 179.5760 858 A 4.3975 7.7568 120.3423 54.7711 18.3380 179.6166 859 L 4.0392 7.8475 116.4266 58.2868 41.8322 179.6554 860 L 4.2563 7.7846 117.3701 55.8121 41.5547 177.9162 861 G 4.2109 7.6006 107.1716 45.2288 0.0000 173.4647 862 N 4.4450 8.5957 119.0960 53.2538 39.4921 173.9491 863 R 4.7037 8.3446 123.4411 54.2630 32.4689 175.7206 864 V 3.7288 8.4017 122.7912 62.1283 32.4862 174.8432 865 D 4.5782 8.2432 126.8358 51.9188 41.0556 174.9474 866 P 4.2495 0.0000 0.0000 65.3708 31.5362 178.6786 867 L 4.1390 7.9216 118.2528 57.1047 41.7454 178.3067 868 S 4.0712 7.8354 112.9856 59.8767 63.1027 174.0620 869 E 4.3379 7.1475 120.5077 54.2505 31.5267 176.8295 870 E 4.1211 8.5952 123.2388 58.8664 30.3810 179.0283 871 G 3.7876 7.9221 106.8607 47.3623 0.0000 174.5522 872 W 4.7344 7.7048 117.0623 57.1689 29.3093 177.1839 873 K 4.2820 7.7689 117.8326 57.6077 32.1306 177.2605 874 Q 4.1374 7.4007 119.3289 55.4745 29.5093 175.9364 875 K 4.2488 8.3600 124.1511 55.2051 32.9131 175.2901 876 P 4.4478 0.0000 0.0000 62.3325 32.0289 176.3477 877 N 4.4973 8.9279 118.8666 52.9168 39.0721 176.0106 878 L 4.0057 8.2542 121.5778 58.1269 42.0015 178.3297 879 N 4.3261 8.2271 115.8889 56.1594 38.4242 176.8650 880 A 4.2812 8.6683 122.4291 55.4866 18.4867 179.7498 881 I 3.6818 7.8423 118.1858 64.3983 37.2762 178.6754 882 R 3.8821 8.3880 119.8691 59.6746 29.8733 178.6838 883 S 4.1870 8.4846 115.2219 61.7347 62.7676 176.8396 884 L 3.8989 8.3091 121.8080 57.5134 41.3353 178.8211 885 E 3.8859 8.6464 119.6247 59.5694 29.4140 178.9673 886 A 4.0341 7.9138 120.0822 54.9584 18.3343 179.8472 887 V 3.4954 7.4770 116.5940 66.1607 31.6673 178.3321 888 I 3.6770 8.0072 119.8914 64.3220 36.7427 178.0569 889 R 3.8603 8.2443 118.4163 59.6490 30.2341 178.2280 890 V 3.7305 7.9673 117.6885 66.3117 31.6111 177.1343 891 H 4.8096 8.6594 114.4917 56.5873 28.6848 177.2213 892 S 4.1442 8.0009 116.4952 61.4018 62.5696 176.1572 893 K 3.8175 7.3359 121.3116 58.2876 31.8536 176.7623 894 Y 4.3442 7.6847 114.8963 57.2591 40.2024 175.7700 895 W 5.0023 7.3323 118.9284 53.2994 32.1648 175.8610 896 G 3.8426 9.5401 113.2828 48.8985 0.0000 175.0600 897 C 4.1395 8.6067 113.8711 60.3551 29.5155 174.2617 898 M 4.3317 8.1348 118.7138 55.5149 32.1966 175.8259 899 Q 4.2649 8.1009 119.7131 55.8851 29.9234 176.0034 900 R 3.9881 8.6545 118.2707 56.6822 31.0620 175.7923 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ 515 T 8.17 4.27 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 1.20 0.00 0.00 516 L 8.67 3.73 0.00 1.74 1.65 0.94 0.84 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 0.00 517 P 0.00 4.14 0.00 1.42 1.83 0.00 3.84 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 1.95 0.00 518 F 6.99 4.14 0.00 3.41 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 0.00 519 T 7.38 4.51 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 1.32 0.00 0.00 520 T 7.92 5.07 4.31 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 1.34 0.00 0.00 521 G 9.08 4.41 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 0.00 522 L 8.86 5.65 0.00 1.97 2.07 0.96 1.01 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 0.00 523 I 8.61 5.10 1.99 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 1.23 0.98 0.00 0.00 524 Y 8.64 4.74 0.00 1.84 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 525 D 6.88 4.29 0.00 3.00 1.79 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 0.00 526 S 8.24 3.89 0.00 3.96 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 0.00 527 V 7.51 3.11 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.47 0.00 0.00 0.04 0.00 0.00 528 M 7.24 4.06 0.00 2.05 1.89 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.70 0.00 529 L 7.53 4.07 0.00 1.59 1.66 0.94 0.92 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 0.00 530 K 7.41 3.77 0.00 1.54 1.41 0.00 1.23 0.00 0.00 1.40 0.00 0.00 2.75 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.25 1.32 7.81 531 H 7.28 4.44 0.00 2.88 3.18 0.00 5.91 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 0.00 532 Q 7.71 4.40 0.00 1.94 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.72 0.00 0.00 0.00 0.00 0.00 2.19 2.23 0.00 533 C 8.41 4.14 0.00 2.65 2.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 534 S 8.49 4.32 0.00 4.01 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 0.00 535 C 8.14 4.21 0.00 3.16 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 0.00 536 G 7.74 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 537 D 7.38 4.69 0.00 2.69 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 0.00 538 N 8.56 4.45 0.00 2.69 2.64 0.00 0.00 6.66 7.72 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 0.00 539 S 8.04 4.01 0.00 3.77 4.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 540 R 7.33 4.42 0.00 1.86 1.92 0.00 2.99 0.00 0.00 3.17 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.24 0.00 541 H 7.62 4.85 0.00 3.05 3.09 0.00 5.62 0.00 0.00 0.00 0.00 6.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 542 P 0.00 4.27 0.00 2.05 1.98 0.00 3.75 0.00 0.00 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.03 0.00 543 E 6.44 4.00 0.00 1.16 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.22 0.00 544 H 7.42 4.91 0.00 3.46 3.53 0.00 5.72 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 545 A 8.64 4.11 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 0.00 546 G 8.44 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 547 R 7.62 3.98 0.00 1.89 2.08 0.00 3.28 0.00 0.00 3.30 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.59 0.00 548 I 7.73 4.01 2.14 0.00 0.00 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.96 1.01 0.00 0.00 549 Q 8.03 4.15 0.00 2.33 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.82 0.00 0.00 0.00 0.00 0.00 2.45 2.51 0.00 550 S 8.36 4.18 0.00 4.13 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 0.00 551 I 7.68 3.76 2.23 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 1.52 0.87 1.12 0.00 0.00 552 W 8.38 4.39 0.00 2.90 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 0.00 553 S 8.02 3.92 0.00 4.07 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 0.00 554 R 7.71 3.78 0.00 1.91 2.12 0.00 3.28 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 1.57 1.66 0.00 555 L 7.70 3.82 0.00 1.52 1.38 0.95 0.71 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 0.00 556 Q 7.27 3.66 0.00 1.74 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.74 0.00 0.00 0.00 0.00 0.00 2.21 2.32 0.00 557 E 8.21 3.86 0.00 2.02 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.40 0.00 558 R 7.81 4.05 0.00 1.74 1.91 0.00 3.33 0.00 0.00 3.17 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.79 0.00 559 G 7.87 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 0.00 560 L 7.92 4.27 0.00 1.60 1.65 0.83 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 561 R 7.83 3.79 0.00 1.60 1.78 0.00 2.52 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 1.07 1.04 0.00 562 S 7.91 4.33 0.00 4.07 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 0.00 563 Q 8.35 4.18 0.00 2.21 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.77 0.00 0.00 0.00 0.00 0.00 2.34 2.63 0.00 564 C 7.20 5.23 0.00 3.08 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 0.00 565 E 8.95 4.17 0.00 2.29 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.39 2.43 0.00 566 C 8.70 5.20 0.00 3.07 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 0.00 567 L 9.53 4.95 0.00 1.69 1.59 1.02 0.90 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 0.00 568 R 8.38 4.48 0.00 1.95 2.28 0.00 3.58 0.00 0.00 2.25 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.69 0.00 569 G 9.77 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 0.00 0.00 0.00 570 R 6.24 2.51 0.00 1.37 1.59 0.00 2.72 0.00 0.00 3.13 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 1.16 0.00 571 K 7.79 4.18 0.00 1.58 1.74 0.00 1.81 0.00 0.00 1.84 0.00 0.00 2.92 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.71 1.60 7.81 572 A 8.29 4.34 1.16 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 0.00 0.00 573 S 9.15 4.33 0.00 3.95 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 0.00 574 L 8.52 3.87 0.00 1.72 1.74 0.89 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 575 E 8.03 3.91 0.00 1.93 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 2.39 0.00 576 E 8.13 4.10 0.00 2.18 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.31 0.00 577 L 7.84 3.89 0.00 1.73 1.47 0.13 0.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 578 Q 8.27 5.11 0.00 2.24 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 6.82 0.00 0.00 0.00 0.00 0.00 2.39 2.39 0.00 579 S 7.85 4.17 0.00 4.07 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 0.00 580 V 7.45 4.11 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.69 0.00 0.00 0.87 0.00 0.00 581 H 7.99 5.12 0.00 3.32 3.29 0.00 5.67 0.00 0.00 0.00 0.00 6.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 582 S 8.25 4.48 0.00 3.97 3.73 0.00 0.00 0.00 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0.00 1.83 1.71 0.90 1.04 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 0.00 608 L 7.75 4.19 0.00 1.92 1.69 0.91 0.56 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 0.00 609 A 7.64 4.18 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 0.00 610 Q 7.20 4.31 0.00 2.06 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.57 6.36 0.00 0.00 0.00 0.00 0.00 2.28 2.38 0.00 *614 V 8.08 3.84 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 0.97 0.00 0.00 0.94 0.00 0.00 615 M 8.71 4.58 0.00 2.07 1.97 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.65 0.00 616 L 8.89 4.56 0.00 1.90 1.61 1.07 1.30 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 0.00 617 P 0.00 4.28 0.00 2.05 2.14 0.00 3.71 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.10 0.00 618 C 8.01 4.25 0.00 3.12 3.07 0.00 0.00 0.00 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0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 693 Q 7.53 4.03 0.00 2.12 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.93 0.00 0.00 0.00 0.00 0.00 2.34 2.50 0.00 694 Q 7.95 4.14 0.00 2.43 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.91 0.00 0.00 0.00 0.00 0.00 2.42 2.45 0.00 695 Q 7.87 4.65 0.00 2.35 2.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.64 0.00 0.00 0.00 0.00 0.00 2.78 2.59 0.00 696 S 7.97 4.47 0.00 3.82 3.73 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 0.00 697 K 8.47 4.05 0.00 1.74 1.74 0.00 1.85 0.00 0.00 1.71 0.00 0.00 2.83 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.45 1.45 7.81 698 A 8.78 3.74 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 0.00 699 S 7.62 4.40 0.00 3.96 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 0.00 700 K 9.35 4.78 0.00 1.50 1.20 0.00 0.61 0.00 0.00 1.38 0.00 0.00 2.59 0.00 0.00 2.72 0.00 0.00 0.00 0.00 1.20 1.19 7.81 701 I 8.91 4.98 1.74 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.90 0.87 0.00 0.00 702 L 8.66 4.98 0.00 1.90 1.58 0.80 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 703 I 8.90 4.89 2.06 0.00 0.00 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.58 1.03 0.00 0.00 704 V 8.32 4.45 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 1.06 0.00 0.00 0.85 0.00 0.00 705 D 9.17 5.22 0.00 2.86 2.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 706 W 8.23 5.20 0.00 3.58 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 707 D 7.71 4.73 0.00 2.54 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 0.00 708 V 9.31 4.01 2.24 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 0.89 0.00 0.00 0.55 0.00 0.00 709 H 8.59 5.31 0.00 3.53 3.55 0.00 5.85 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 710 H 8.92 4.28 0.00 2.80 3.19 0.00 5.92 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 711 G 8.70 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 0.00 0.00 0.00 712 N 7.97 4.20 0.00 2.89 3.03 0.00 0.00 5.99 6.93 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 0.00 713 G 7.52 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 714 T 7.54 3.66 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.00 0.00 715 Q 7.24 3.79 0.00 2.16 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.95 0.00 0.00 0.00 0.00 0.00 2.30 2.72 0.00 716 Q 7.90 4.00 0.00 2.03 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.43 6.54 0.00 0.00 0.00 0.00 0.00 2.38 2.49 0.00 717 T 7.65 3.61 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.16 0.00 0.00 718 F 7.41 4.90 0.00 3.06 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 0.00 719 Y 7.93 4.19 0.00 3.25 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 0.00 720 Q 8.05 4.64 0.00 2.07 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.75 0.00 0.00 0.00 0.00 0.00 2.36 2.41 0.00 721 D 7.83 4.73 0.00 2.74 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 0.00 722 P 0.00 3.40 0.00 1.68 2.00 0.00 3.72 0.00 0.00 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.82 0.00 723 S 8.58 4.43 0.00 3.88 4.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 724 V 7.56 4.74 1.80 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 0.17 0.00 0.00 0.50 0.00 0.00 725 L 8.69 4.61 0.00 0.33 0.39 0.70 -0.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 726 Y 8.73 5.15 0.00 3.06 2.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 727 I 8.64 4.49 1.57 0.00 0.00 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.75 0.20 0.64 0.00 0.00 728 S 8.30 4.91 0.00 3.47 3.68 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 0.00 729 L 8.60 4.97 0.00 1.79 1.51 1.16 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 730 H 8.41 5.30 0.00 3.57 3.52 0.00 5.46 0.00 0.00 0.00 0.00 6.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 731 R 9.04 4.66 0.00 1.29 1.44 0.00 2.58 0.00 0.00 2.25 7.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.86 1.27 0.00 732 H 9.27 4.78 0.00 3.20 3.44 0.00 5.88 0.00 0.00 0.00 0.00 6.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 733 D 8.90 4.28 0.00 2.94 2.79 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 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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 0.00 842 G 9.42 4.39 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 0.00 843 H 8.84 4.92 0.00 3.35 3.47 0.00 5.73 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 844 D 7.98 4.44 0.00 2.54 2.49 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 0.00 845 L 8.60 4.06 0.00 1.77 1.74 0.99 0.79 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 0.00 846 T 7.87 3.81 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 1.22 0.00 0.00 847 A 8.47 3.98 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 0.00 848 I 8.24 3.62 2.11 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 1.89 1.27 1.21 0.00 0.00 849 C 8.39 4.09 0.00 3.11 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 0.00 850 D 8.45 4.27 0.00 2.72 2.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 851 A 7.70 3.76 0.13 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 0.00 0.00 852 S 7.78 3.83 0.00 3.72 3.73 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 0.00 853 E 8.09 3.74 0.00 2.06 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 2.24 2.25 0.00 854 A 8.10 3.97 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 855 C 8.34 4.28 0.00 3.24 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 0.00 856 V 8.05 3.56 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 0.97 0.00 0.00 0.48 0.00 0.00 857 A 8.21 3.98 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 858 A 7.76 4.40 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 0.00 859 L 7.85 4.04 0.00 1.96 2.02 1.21 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 860 L 7.78 4.26 0.00 1.82 1.73 0.94 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 861 G 7.60 4.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 862 N 8.60 4.44 0.00 2.75 2.92 0.00 0.00 7.03 7.17 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 0.00 863 R 8.34 4.70 0.00 1.83 1.86 0.00 3.29 0.00 0.00 3.18 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.76 0.00 864 V 8.40 3.73 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.64 0.00 0.00 1.08 0.00 0.00 865 D 8.24 4.58 0.00 2.70 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 0.00 0.00 0.00 866 P 0.00 4.25 0.00 2.38 2.27 0.00 3.69 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.09 0.00 867 L 7.92 4.14 0.00 1.75 1.73 0.92 0.88 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 0.00 868 S 7.84 4.07 0.00 3.76 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 0.00 869 E 7.15 4.34 0.00 1.16 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.47 0.00 870 E 8.60 4.12 0.00 1.94 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.19 0.00 871 G 7.92 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 872 W 7.70 4.73 0.00 3.42 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 0.00 873 K 7.77 4.28 0.00 2.00 1.89 0.00 1.71 0.00 0.00 1.64 0.00 0.00 2.95 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.47 1.40 7.81 874 Q 7.40 4.14 0.00 2.18 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.91 0.00 0.00 0.00 0.00 0.00 2.36 2.37 0.00 875 K 8.36 4.25 0.00 1.78 1.72 0.00 1.80 0.00 0.00 1.75 0.00 0.00 3.02 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.44 1.43 7.81 876 P 0.00 4.45 0.00 2.14 2.17 0.00 3.76 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.96 0.00 877 N 8.93 4.50 0.00 2.93 2.91 0.00 0.00 6.78 6.87 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 0.00 878 L 8.25 4.01 0.00 1.69 1.69 0.93 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 879 N 8.23 4.33 0.00 2.93 3.06 0.00 0.00 7.02 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 0.00 880 A 8.67 4.28 1.20 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 0.00 0.00 881 I 7.84 3.68 2.00 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.83 0.93 0.00 0.00 882 R 8.39 3.88 0.00 2.13 2.14 0.00 3.12 0.00 0.00 3.19 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.70 0.00 883 S 8.48 4.19 0.00 4.31 4.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 884 L 8.31 3.90 0.00 1.83 1.69 1.07 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 885 E 8.65 3.89 0.00 2.22 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 2.32 2.40 0.00 886 A 7.91 4.03 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 0.00 887 V 7.48 3.50 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 0.98 0.00 0.00 0.79 0.00 0.00 888 I 8.01 3.68 1.98 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.81 0.95 0.00 0.00 889 R 8.24 3.86 0.00 1.87 2.13 0.00 3.26 0.00 0.00 3.15 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.65 0.00 890 V 7.97 3.73 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.00 0.00 0.94 0.00 0.00 891 H 8.66 4.81 0.00 3.43 3.60 0.00 5.69 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 892 S 8.00 4.14 0.00 4.01 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 0.00 893 K 7.34 3.82 0.00 1.53 1.02 0.00 1.45 0.00 0.00 1.18 0.00 0.00 2.85 0.00 0.00 2.92 0.00 0.00 0.00 0.00 0.30 1.03 7.81 894 Y 7.68 4.34 0.00 2.70 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 895 W 7.33 5.00 0.00 3.37 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 0.00 896 G 9.54 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 897 C 8.61 4.14 0.00 3.09 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 0.00 898 M 8.13 4.33 0.00 2.14 2.55 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 2.67 2.67 0.00 899 Q 8.10 4.26 0.00 2.12 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 5.93 0.00 0.00 0.00 0.00 0.00 2.53 2.57 0.00 900 R 8.65 3.99 0.00 1.98 1.95 0.00 3.05 0.00 0.00 3.26 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.60 0.00 * Residues marked with a * may have inaccurate shift predictions.