NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 547 Q 4.2652 8.3444 121.7104 56.2513 30.0577 174.3415 548 V 4.1744 8.2459 119.3211 60.5715 32.3132 173.7496 549 R 4.8384 8.3939 115.7888 54.4969 32.2963 175.4727 550 W 4.7084 8.9869 119.4049 57.1021 29.9846 175.9495 551 K 4.6476 8.8428 123.0557 55.1408 35.5244 174.9822 552 I 4.6825 8.4767 128.3542 60.8002 38.0045 175.0699 553 I 4.5646 8.7278 119.8693 58.9666 40.6728 174.6370 554 E 4.0676 8.3865 121.9195 55.0721 30.6883 176.0958 555 S 4.2439 7.5605 116.3497 56.4101 65.5467 171.9951 556 Y 4.7942 8.0768 124.4717 57.5296 39.9353 175.4349 557 E 3.8705 9.2586 120.9920 57.1484 27.5324 175.1677 558 G 4.0538 7.4317 107.1897 44.0986 0.0000 173.7033 559 N 4.5560 8.6261 115.4840 54.9835 38.8868 175.9336 560 S 4.8600 7.8203 112.4326 56.5357 65.9767 172.4587 561 Y 4.2865 8.4158 123.6939 55.9121 40.9083 175.3439 562 T 4.3249 7.1852 123.2625 62.1526 68.4684 174.4182 563 F 4.6407 8.8475 126.6071 58.9785 39.6760 176.4840 564 I 4.6539 7.5387 111.4630 58.8871 40.5718 174.0209 565 D 4.6814 8.4104 121.6426 52.0866 41.3989 175.2537 566 P 4.2456 0.0000 0.0000 65.8309 31.6698 177.8922 567 T 3.9391 8.0831 113.9577 66.6120 68.3727 174.3531 568 Q 4.3060 8.0502 119.0026 55.0315 29.9792 175.7790 569 L 3.6462 8.4046 115.8878 54.9241 38.5659 174.8728 570 P 4.6477 0.0000 0.0000 62.0631 32.0169 175.3530 571 Y 4.3184 8.7087 120.0627 58.7389 39.5289 175.6621 572 N 4.4783 8.5309 125.0419 52.1756 39.4817 175.1735 573 E 3.7283 8.3635 124.1504 57.1538 29.4304 178.9426 574 K 3.9794 7.8061 119.3102 58.8285 32.8711 178.0408 575 W 4.6010 7.8191 118.4847 57.4702 29.6698 175.4761 576 E 4.8651 7.8577 120.2366 56.0699 29.5307 175.9032 577 F 5.0373 9.1958 128.4387 55.5413 43.0974 172.2805 578 P 4.0216 0.0000 0.0000 62.7349 31.6949 176.8368 579 R 3.8828 8.9525 126.1555 59.5048 30.0566 177.9860 580 N 4.3203 7.9545 114.2576 56.1241 39.2969 174.6727 581 N 4.8241 8.1163 115.0461 53.2779 38.5720 173.5667 582 L 5.1724 7.8453 119.3279 53.0254 43.6498 175.6321 583 Q 4.4780 9.0055 125.8073 54.1615 31.0301 174.6769 584 F 4.9271 8.7369 125.7959 56.9461 39.6767 175.8423 585 G 4.3482 9.3181 110.4233 46.1699 0.0000 173.9016 586 K 4.4043 8.6040 123.9830 56.7055 34.4221 176.4716 587 T 4.2245 8.2546 118.8708 63.7514 68.3703 174.6800 588 L 4.1798 8.9165 127.9081 57.4281 42.5914 177.1017 589 G 4.0774 7.6972 102.8390 46.2587 0.0000 172.3989 590 A 4.9973 8.3434 120.2544 51.2084 22.1091 176.5688 591 G 4.3478 8.4306 111.2434 43.2350 0.0000 172.8324 592 A 3.7658 8.2844 121.1802 54.3178 18.5278 178.7504 593 F 4.8177 7.5969 112.4624 57.7847 41.1957 174.7810 594 G 4.6698 7.5709 106.4202 45.3727 0.0000 171.4672 595 K 5.0821 9.0114 117.6780 55.4419 36.5744 175.1750 596 V 4.8353 8.7798 121.5629 61.2752 34.0014 174.7818 597 V 4.7938 8.7099 120.9909 59.3017 35.2290 174.8199 598 E 4.5735 8.9956 124.5930 56.4116 31.0130 175.2426 599 A 5.0485 8.6632 125.2807 51.2379 23.6201 174.9412 600 T 4.6397 8.7277 116.2429 62.0398 70.7004 173.9090 601 A 5.0850 8.4304 127.9649 50.0955 21.7826 175.1084 602 F 4.8045 9.1652 121.4370 55.9045 40.7672 176.1703 603 G 4.0746 8.8284 113.4464 46.1653 0.0000 173.0269 604 L 4.5198 8.1088 120.8847 54.3278 43.7828 176.5361 605 G 4.2368 8.6940 112.9558 44.3258 0.0000 173.3424 606 K 4.0036 8.4418 116.7681 59.4131 32.0738 178.1643 607 E 4.1116 8.2436 115.6067 56.8607 30.6729 175.9761 608 D 4.6227 7.9362 118.5088 53.0691 39.0618 172.9764 609 A 4.6562 7.4374 122.3280 52.5033 21.0427 177.8015 610 V 4.8583 8.4291 119.1150 60.7387 32.4850 174.8112 611 L 4.7506 7.8940 127.0057 53.7279 44.3144 175.3819 612 K 4.3826 8.4879 119.7535 56.7932 32.6924 176.7706 613 V 4.6677 8.9335 116.8580 59.6224 36.6823 173.9545 614 A 5.1346 8.8784 123.6691 50.4521 21.5747 176.1724 615 V 4.7923 8.9984 121.4264 61.0069 34.5365 174.2204 616 K 5.0764 9.0957 130.0542 55.4964 34.2920 174.8455 617 M 5.1503 8.5095 122.3506 54.4037 35.0004 173.9952 618 L 4.6557 8.3063 119.2947 54.0780 42.9235 177.1444 619 K 4.4061 8.4566 120.8324 55.3201 33.7916 178.2354 620 S 4.1402 8.4174 114.8655 62.2314 62.7388 176.0585 621 T 3.9762 7.7736 114.4318 64.7265 68.4521 174.3614 622 A 4.4115 7.4760 125.9221 52.2668 19.5807 177.7352 623 H 5.1349 9.7907 122.2193 55.1154 31.7134 176.2442 624 A 3.9918 8.5278 122.8575 56.4553 18.4000 179.4229 625 D 4.3090 8.1131 116.9226 57.7007 40.9654 178.8957 626 E 3.8714 7.9970 118.5069 59.0488 29.5760 179.2362 627 K 3.9652 7.8198 118.6831 59.3982 32.0906 179.2518 628 E 3.9164 8.2384 118.6249 59.4167 29.3967 179.3021 629 A 4.0389 7.7386 120.5120 54.8209 18.2643 179.5341 630 L 3.8076 7.7596 118.5928 58.6782 42.2495 179.0961 631 M 3.9328 8.0541 118.6385 58.4575 31.9572 178.7584 632 S 4.1914 8.4689 113.7705 61.1803 62.6329 175.8657 633 E 3.8778 8.2357 122.3146 58.9475 29.4324 178.4996 634 L 3.8179 8.0343 120.7361 58.1196 42.1392 179.1399 635 K 4.1803 8.4215 120.1463 58.9234 31.9071 179.5038 636 I 3.8070 7.7032 119.7116 64.7712 36.8130 178.4552 637 M 4.1281 7.9505 119.4770 58.2705 31.6420 178.9636 638 S 4.1623 8.0325 114.3946 61.3659 63.0717 175.9666 639 H 4.5155 7.9389 120.8693 58.7880 29.7400 176.7863 640 L 4.1863 8.0183 120.4462 55.7338 41.7480 178.3448 641 G 4.1510 7.6138 102.9734 45.0827 0.0000 172.4486 642 Q 4.6240 8.2152 117.0034 55.6119 30.0475 175.1498 643 H 4.5121 8.5889 118.5414 54.5136 32.9949 174.5887 644 E 3.9402 8.2386 122.8105 58.8006 29.7633 177.4163 645 N 5.0906 8.2129 115.3219 52.7434 39.0743 173.4194 646 I 5.0690 7.2075 118.2505 59.1519 40.2330 175.8407 647 V 3.8719 8.8415 126.5671 63.3577 31.7786 175.2537 648 N 4.7760 9.1903 126.4863 52.1263 40.3204 174.7141 649 L 4.1586 8.3266 124.5520 55.3696 42.0808 176.3608 650 L 4.7345 9.4461 125.7408 53.9035 44.0951 176.4520 651 G 4.4009 7.3935 104.8037 46.8542 0.0000 170.8941 652 A 5.1522 8.7117 119.9627 50.9909 23.3068 175.7161 653 C 5.2747 9.2856 118.4700 58.5303 30.1131 174.6896 654 T 4.3684 9.1384 112.9520 61.3052 69.1775 174.1619 655 H 4.9376 7.7125 118.1664 55.4304 32.4318 173.2344 656 G 3.8727 8.7626 109.0657 44.5272 0.0000 174.2556 657 G 3.9835 7.7431 106.3447 43.9670 0.0000 170.9404 658 P 4.3387 0.0000 0.0000 62.2620 31.7967 176.5107 659 V 3.9629 8.2369 121.5165 63.1907 32.0264 175.0701 660 L 5.0414 9.1125 128.1357 52.8814 45.1135 175.4831 661 V 4.4808 8.7376 123.0200 61.1663 34.3209 174.0764 662 I 4.9834 8.7472 129.8397 60.0079 38.9629 175.0065 663 T 5.0600 8.7891 117.0442 59.1136 72.6427 173.0842 664 E 4.2927 8.4044 121.1834 56.8723 30.0677 176.3757 665 Y 4.4209 8.5374 124.9291 56.9777 40.1538 174.4905 666 C 4.2308 7.8060 124.5363 57.7810 28.5564 174.2622 667 C 3.4994 7.8632 120.6585 60.2731 29.4004 174.2178 668 Y 4.4579 7.4601 116.3024 57.4484 38.6368 177.3370 669 G 3.7694 7.5602 108.7426 45.3724 0.0000 172.5136 670 D 5.0355 8.2369 119.7696 52.5611 42.1974 177.1448 671 L 3.8495 8.8397 123.4009 58.0463 42.0870 179.3022 672 L 3.9781 7.8815 119.9808 58.1964 42.1338 178.3067 673 N 4.3345 8.5008 117.0297 56.5607 38.8728 176.5117 674 F 4.0874 8.0830 121.8092 61.2483 39.5026 177.0217 675 L 3.8683 8.3004 118.7989 58.0776 41.2684 179.9129 676 R 3.9596 7.8039 116.3671 59.0859 30.0859 179.1306 677 R 4.0108 8.0766 118.2096 59.1410 29.8589 179.1905 678 K 3.7738 7.5666 117.2374 59.2174 32.0114 179.0986 679 S 4.1986 7.9312 112.6780 59.8008 62.7224 173.9754 680 R 4.7872 7.4745 117.7241 55.5922 30.9465 176.6981 681 V 3.4932 8.2985 113.1855 64.2822 30.3736 178.0768 682 L 3.9014 9.0833 126.9466 58.4125 43.0587 175.9995 *693 S 4.2228 7.6294 110.9851 58.0357 63.9879 173.5383 694 T 4.0440 8.1111 118.8494 63.0282 69.0098 174.7016 695 L 4.1866 8.1024 124.5351 54.9945 42.4583 176.6794 696 S 4.7376 9.1037 117.8661 56.3027 66.2447 175.0652 697 T 3.7620 8.4377 115.9144 65.2730 67.2823 175.7617 *753 R 4.2981 7.8982 116.3962 56.1622 31.6930 177.3676 754 D 3.8941 7.9428 118.4416 57.0924 40.7436 178.6221 755 L 3.8161 7.5479 118.8884 57.6721 41.4583 179.4531 756 L 4.2137 8.3578 119.3077 58.1851 41.4746 179.3046 757 H 4.2941 7.8854 116.1475 58.7743 28.6156 177.8505 758 F 4.5574 7.9348 119.5520 60.9011 38.8235 177.6990 759 S 4.4189 8.3070 114.7037 62.0894 62.6222 177.2120 760 S 4.3119 8.6286 117.8867 61.6971 62.6227 176.7262 761 Q 4.0614 8.5240 121.0507 58.9703 28.3712 179.1209 762 V 3.6636 8.2228 119.0762 65.9767 31.5793 177.8345 763 A 3.7166 8.3302 120.5623 55.3265 18.1177 179.7169 764 Q 4.0648 8.5767 116.9165 58.9390 28.8320 178.9318 765 G 3.5935 8.0709 106.8222 48.2083 0.0000 175.6790 766 M 3.6566 8.0806 121.0703 57.6488 31.8905 178.6925 767 A 4.0391 8.0783 121.3980 54.8563 18.2408 179.5663 768 F 3.9980 8.0227 118.5832 61.3953 39.7464 176.8966 769 L 3.8385 7.8342 118.3636 57.9006 41.4973 179.4670 770 A 3.9421 8.1689 121.0182 55.1002 18.0713 179.5157 771 S 4.2331 7.6217 110.7613 60.0958 63.2188 175.6849 772 K 4.2751 7.4443 120.7440 54.9113 32.7511 175.3956 773 N 4.0696 7.8308 115.9824 54.5439 36.6365 173.1965 774 C 5.0262 7.9814 117.0349 57.3931 33.7477 172.5367 775 I 4.4391 8.4381 120.7944 59.6922 39.7475 175.5197 776 H 3.5255 9.7002 121.8366 58.0506 30.4367 177.2533 777 R 4.3178 9.2407 114.2485 56.6514 28.3813 176.4189 778 D 4.8131 7.8843 116.4794 52.6327 41.4556 175.8166 779 V 3.6042 8.1272 118.3478 62.9389 32.4453 174.4467 780 A 4.5883 8.1007 127.0386 51.6182 21.7122 176.7659 781 A 4.0995 8.9586 123.6326 55.1091 18.6188 180.6727 782 R 4.0448 8.1233 111.2597 58.6576 29.4960 177.0655 783 N 5.1683 8.2784 114.8426 52.8131 39.1285 173.9311 784 V 4.7568 7.7437 119.3666 61.2563 33.9879 174.6685 785 L 5.1312 9.1121 127.4121 53.0373 45.0647 175.1466 786 L 5.0309 8.6126 121.4000 53.5910 44.5237 175.9794 787 T 4.8597 8.4215 120.2228 59.9892 69.7420 172.4080 788 N 4.4308 8.5424 116.4883 55.5410 38.8802 175.7094 789 G 3.9611 9.2103 109.0275 45.5804 0.0000 172.9120 790 H 4.0053 8.4332 114.1883 56.3141 27.0628 175.0122 791 V 4.0680 7.4287 118.7031 62.9707 32.4085 174.8222 792 A 4.8804 9.1220 130.1698 51.5496 19.5551 176.8442 793 K 4.9585 9.5057 120.7622 54.5872 36.6551 175.6576 794 I 4.8713 8.3687 116.7006 59.7153 41.0027 174.2142 795 G 3.4660 7.4242 108.3582 45.9718 0.0000 172.9924 796 D 3.7663 6.9945 119.6827 52.9956 39.8025 175.9762 797 F 5.0984 7.9465 123.5250 56.7661 39.4898 177.2650 798 G 3.9696 7.7091 106.5076 48.3203 0.0000 176.0841 799 L 4.3041 7.9515 119.3204 56.3406 41.7499 178.3134 800 A 4.4406 7.8953 118.9132 51.0779 19.2147 176.5815 801 R 4.2077 7.8867 119.7723 54.7258 31.5033 176.4274 802 D 4.7967 8.2774 128.4425 52.7425 40.2387 176.3043 803 I 3.1712 7.4100 124.2419 64.7529 37.8159 178.8927 804 M 4.0331 7.9178 118.2413 57.7575 31.8359 176.7239 805 N 4.7444 8.3478 113.5554 52.6835 39.4195 173.6461 806 D 4.8514 7.6929 119.7980 52.3430 41.8401 177.0747 807 S 4.4473 8.6947 121.4934 60.1564 63.6712 174.9293 808 N 4.4948 9.2064 119.6018 55.3119 38.5239 173.7010 809 Y 4.8134 8.0132 116.6437 56.6036 38.8640 175.3580 810 I 4.3103 8.7696 126.7537 60.0333 39.2357 175.7206 811 V 4.0931 8.5120 126.6786 63.0549 32.0847 175.8507 812 K 4.3278 9.1451 131.4702 54.9797 31.9264 176.9799 813 G 4.1084 8.5136 113.8319 45.0128 0.0000 170.8727 814 N 4.6381 8.9155 121.2619 52.9478 41.1205 173.2097 815 A 4.9419 7.9671 119.0416 50.5096 22.9793 175.2988 816 R 5.1712 8.5237 116.5675 54.8262 33.2784 175.3255 817 L 5.0119 9.0232 124.4215 51.9444 45.5154 175.5682 818 P 4.8003 0.0000 0.0000 61.1632 29.5991 176.6796 819 V 3.7263 7.9925 125.9038 66.8336 31.9893 178.0602 820 K 4.1532 8.1736 117.0616 58.1536 32.0134 177.4583 821 W 4.6697 8.8429 118.0323 57.0394 29.9088 175.7174 822 M 4.5353 7.8302 118.2099 53.6717 32.8770 176.6745 823 A 2.5800 8.0749 124.3892 50.6926 20.5372 176.9279 824 P 3.2145 0.0000 0.0000 65.6961 31.0740 178.8363 825 E 4.0215 7.6012 116.7116 59.1416 29.4745 179.2207 826 S 4.3661 7.3617 116.9891 60.7429 62.6676 176.4573 827 I 3.6567 7.0005 121.7610 63.7457 36.8927 177.6443 828 F 4.8908 8.0945 117.2657 58.5593 39.3511 176.8991 829 D 4.8403 8.0910 115.9867 52.9168 41.7400 176.6479 830 C 4.6657 7.7651 114.5125 59.6346 26.0221 172.9485 831 V 3.7480 6.8982 119.9629 62.7212 31.5860 174.6470 832 Y 4.9434 8.4667 124.0100 55.9922 40.7900 175.1629 833 T 4.7786 9.1046 114.9752 59.0942 73.6798 174.7691 834 V 3.7188 8.3699 119.1619 66.4446 31.1817 177.7433 835 Q 4.0502 8.0812 117.5773 58.6970 28.5833 178.4731 836 S 4.3119 8.1191 115.3385 61.3812 63.1493 176.2938 837 D 4.6544 8.3873 122.6424 57.1804 40.2899 178.8312 838 V 3.5200 7.6477 118.4225 65.3979 31.7297 177.5547 839 W 4.7437 8.1517 129.5564 60.3309 30.5601 178.1418 840 S 4.8856 8.4910 116.0584 61.4877 62.3294 176.1003 841 Y 4.3125 8.8430 122.4622 60.6232 38.5470 178.4677 842 G 3.3572 8.3312 107.0007 47.5713 0.0000 175.8793 843 I 4.0819 8.0599 121.7749 64.1925 37.1446 177.9954 844 L 4.4487 8.5371 121.5486 58.2505 41.8496 178.9896 845 L 4.0672 7.8624 118.9113 57.6718 41.5853 179.3158 846 W 4.2020 8.4408 128.1561 60.4478 30.6598 177.8340 847 E 4.1014 8.7322 118.6154 59.5102 29.0069 179.3552 848 I 3.6490 8.0539 119.7866 64.3976 37.2809 177.8633 849 F 4.5064 8.4425 116.4730 57.9079 38.7606 176.7477 850 S 4.4512 7.4799 112.8653 56.8476 63.4147 173.6321 851 L 3.5086 8.9287 121.0935 56.0870 39.4408 174.8716 852 G 3.9963 8.5306 103.3765 45.8013 0.0000 174.8545 853 L 4.2811 7.3074 118.3717 53.9045 42.2634 176.7438 854 N 4.7090 8.6930 119.9948 52.6835 39.5519 173.3670 855 P 3.3455 0.0000 0.0000 63.4824 32.6498 175.3664 856 Y 3.4127 6.9134 115.7588 58.0426 35.1696 169.5361 857 P 4.5212 0.0000 0.0000 64.3418 32.2740 176.7257 858 G 4.1555 9.0029 111.0511 45.7156 0.0000 173.5841 859 I 3.9525 7.5337 120.5816 60.4054 37.0448 176.0237 860 L 3.9780 8.1966 125.8257 54.3424 42.1105 177.7632 861 V 3.3645 7.8753 121.9613 62.1809 30.6309 174.4096 862 N 5.0196 7.9097 124.2542 50.6831 40.2868 175.0835 863 S 4.4895 8.9256 112.9153 62.1920 62.7395 176.9888 864 K 4.0141 8.3759 121.2876 59.0815 31.7760 179.0920 865 F 3.8353 8.3554 121.0555 61.4496 39.1922 176.7447 866 Y 4.1513 7.6935 115.7110 61.1066 37.6596 178.6595 867 K 3.9230 8.0450 119.0910 59.3144 32.0393 179.2784 868 L 3.8848 7.5736 118.7818 57.9905 41.5783 180.0850 869 V 3.5941 7.2075 111.9914 64.1167 31.2064 178.2732 870 K 4.0570 8.0920 118.6168 59.8968 32.0987 177.6705 871 D 4.7364 8.0641 115.5334 54.4215 40.9606 177.0640 872 G 4.1127 7.8695 108.4202 45.2906 0.0000 173.4287 873 Y 4.2278 8.0627 120.7531 57.5477 39.2788 175.5747 874 Q 4.0317 7.1922 123.7300 53.6882 32.8036 175.1035 875 M 3.7165 7.2747 120.3759 54.9686 32.5200 176.3865 876 A 4.2316 8.1907 124.0764 51.4636 19.3577 177.4280 877 Q 3.2437 8.0324 121.1008 55.6347 29.2965 175.3909 878 P 4.2412 0.0000 0.0000 61.9699 32.2618 176.9624 879 A 3.5920 8.1948 122.3095 54.6714 18.1358 178.6147 880 F 4.7559 7.6998 110.9571 57.0712 39.6340 175.3097 881 A 4.1167 7.6601 125.6024 50.5650 19.0020 176.9154 882 P 4.4240 0.0000 0.0000 62.0816 33.4760 177.2860 883 K 3.9219 8.6180 120.3638 60.1334 31.4976 178.7746 884 N 4.4673 8.1113 116.0715 56.4202 38.5894 177.3253 885 I 3.7254 7.5855 120.8362 64.3251 37.1460 177.6114 886 Y 4.1478 7.9882 120.5102 60.7896 38.5901 178.3178 887 S 4.1289 8.1830 117.4572 60.7104 62.7337 176.8192 888 I 3.5110 7.2094 121.9892 64.4248 36.9588 177.9865 889 M 3.0106 7.2625 118.9095 58.2719 31.2853 178.7907 890 Q 3.6587 7.2599 117.5314 58.8858 28.6380 178.9732 891 A 3.8645 7.6345 121.5233 55.3618 18.1437 179.5070 892 C 4.0433 8.0118 115.4707 61.8539 27.7572 175.2395 893 W 4.0598 6.8693 118.0967 54.9719 29.2489 176.1151 894 A 4.1978 7.2087 122.7825 52.4082 18.3457 178.7579 895 L 4.2091 8.7895 123.0295 57.5756 42.1124 177.3183 896 E 4.2079 8.0819 120.7863 54.6232 29.8304 174.8931 897 P 4.2926 0.0000 0.0000 65.8653 31.5467 178.4394 898 T 4.1689 7.9301 106.0324 63.5150 69.0083 174.8499 899 H 4.6508 8.1952 118.7115 56.0698 29.1533 175.5201 900 R 4.4298 7.4490 119.2392 54.4953 30.7678 174.7227 901 P 4.4749 0.0000 0.0000 62.7406 32.2607 176.4814 902 T 4.1780 8.3860 110.1107 60.8474 71.2676 175.9161 903 F 4.1046 8.2740 120.2216 60.6520 38.8134 177.7493 904 Q 4.0298 8.1086 118.9088 59.2872 28.9471 178.0916 905 Q 4.0097 8.3045 119.2038 58.8935 28.6251 178.8583 906 I 3.7964 7.8770 120.9101 64.4731 37.1038 178.0991 907 C 4.1463 8.4698 117.9870 62.9620 27.8854 176.0851 908 S 4.1148 8.3184 114.6845 61.5409 62.0345 176.0721 909 F 4.2677 8.4673 123.2551 61.3277 39.1649 177.1039 910 L 3.9580 8.5378 119.1572 57.7134 41.2423 179.1631 911 Q 3.9983 8.3394 119.7218 59.2946 28.9296 178.3890 912 E 3.9220 7.8202 119.6413 59.4656 29.5336 179.3283 913 Q 3.8404 7.6914 117.7848 58.7573 28.6739 178.7045 914 A 4.0303 8.0540 121.9067 55.0066 18.3896 179.7441 915 Q 3.9520 7.9030 116.7437 58.8666 28.7989 178.2097 916 E 3.8871 8.1321 120.5007 59.3596 29.6558 178.4536 917 D 4.2863 8.0259 117.9574 57.2989 41.0829 178.1618 918 R 3.9651 7.7970 118.1533 58.5598 30.0647 178.1157 919 R 4.1275 7.5225 117.9999 59.0212 30.4213 177.9119 920 E 4.0804 7.9675 116.8092 59.3476 29.7764 176.8828 921 R 4.0680 7.7887 121.9587 56.5113 30.1544 175.7779 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 547 Q 8.34 4.27 0.00 1.98 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.96 0.00 0.00 0.00 0.00 0.00 2.20 2.46 0.00 548 V 8.25 4.17 2.15 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 1.07 0.00 0.00 1.10 0.00 0.00 549 R 8.39 4.84 0.00 2.08 1.89 0.00 3.06 0.00 0.00 3.20 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.63 0.00 550 W 8.99 4.71 0.00 3.09 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 0.00 551 K 8.84 4.65 0.00 1.79 1.56 0.00 1.61 0.00 0.00 1.63 0.00 0.00 2.81 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.32 1.42 7.81 552 I 8.48 4.68 1.86 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 1.43 0.96 0.91 0.00 0.00 553 I 8.73 4.56 1.80 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.56 0.89 0.00 0.00 554 E 8.39 4.07 0.00 1.70 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 2.08 2.14 0.00 555 S 7.56 4.24 0.00 3.60 3.54 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 0.00 0.00 0.00 0.00 556 Y 8.08 4.79 0.00 3.13 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 0.00 557 E 9.26 3.87 0.00 2.16 2.06 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 2.29 2.38 0.00 558 G 7.43 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 0.00 0.00 0.00 559 N 8.63 4.56 0.00 2.73 2.90 0.00 0.00 6.59 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 560 S 7.82 4.86 0.00 3.91 3.72 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 0.00 561 Y 8.42 4.29 0.00 2.75 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 0.00 562 T 7.19 4.32 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 1.16 0.00 0.00 563 F 8.85 4.64 0.00 3.16 3.21 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 0.00 564 I 7.54 4.65 1.91 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 1.44 0.64 1.02 0.00 0.00 565 D 8.41 4.68 0.00 2.77 2.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 566 P 0.00 4.25 0.00 2.09 2.11 0.00 3.72 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.69 0.00 567 T 8.08 3.94 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 1.21 0.00 0.00 568 Q 8.05 4.31 0.00 2.21 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.52 6.42 0.00 0.00 0.00 0.00 0.00 2.40 2.39 0.00 569 L 8.40 3.65 0.00 1.77 1.71 0.96 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 0.00 0.00 0.00 0.00 0.00 0.00 570 P 0.00 4.65 0.00 2.13 2.12 0.00 3.73 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.13 0.00 571 Y 8.71 4.32 0.00 2.97 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 0.00 572 N 8.53 4.48 0.00 2.78 2.73 0.00 0.00 7.19 7.65 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 0.00 573 E 8.36 3.73 0.00 1.96 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 2.34 2.26 0.00 574 K 7.81 3.98 0.00 1.57 1.78 0.00 1.16 0.00 0.00 1.45 0.00 0.00 2.83 0.00 0.00 2.17 0.00 0.00 0.00 0.00 1.31 0.43 7.81 575 W 7.82 4.60 0.00 3.79 3.43 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 0.00 576 E 7.86 4.87 0.00 2.33 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 2.51 2.30 0.00 577 F 9.20 5.04 0.00 3.07 2.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 578 P 0.00 4.02 0.00 1.61 1.76 0.00 2.20 0.00 0.00 3.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.88 0.00 579 R 8.95 3.88 0.00 1.87 1.94 0.00 3.20 0.00 0.00 3.32 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.69 0.00 580 N 7.95 4.32 0.00 2.66 2.75 0.00 0.00 6.97 7.79 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 0.00 581 N 8.12 4.82 0.00 2.55 3.13 0.00 0.00 6.69 6.35 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 0.00 582 L 7.85 5.17 0.00 1.70 1.13 1.08 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 583 Q 9.01 4.48 0.00 2.31 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 7.00 0.00 0.00 0.00 0.00 0.00 2.31 2.35 0.00 584 F 8.74 4.93 0.00 3.01 2.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 585 G 9.32 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 0.00 0.00 0.00 586 K 8.60 4.40 0.00 1.83 1.92 0.00 1.51 0.00 0.00 1.81 0.00 0.00 2.83 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.44 1.45 7.81 587 T 8.25 4.22 4.19 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 1.17 0.00 0.00 588 L 8.92 4.18 0.00 1.61 1.69 1.03 1.26 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 0.00 589 G 7.70 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 0.00 0.00 0.00 590 A 8.34 5.00 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 591 G 8.43 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 0.00 0.00 0.00 592 A 8.28 3.77 0.22 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 0.00 0.00 593 F 7.60 4.82 0.00 3.05 2.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 594 G 7.57 4.67 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 595 K 9.01 5.08 0.00 1.85 1.79 0.00 1.15 0.00 0.00 1.48 0.00 0.00 2.67 0.00 0.00 2.68 0.00 0.00 0.00 0.00 1.23 1.27 7.81 596 V 8.78 4.84 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.00 0.00 0.88 0.00 0.00 597 V 8.71 4.79 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 0.41 0.00 0.00 0.70 0.00 0.00 598 E 9.00 4.57 0.00 1.89 1.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 1.47 0.00 599 A 8.66 5.05 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 600 T 8.73 4.64 3.98 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 0.42 0.00 0.00 601 A 8.43 5.09 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 0.00 602 F 9.17 4.80 0.00 2.96 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 0.00 603 G 8.83 4.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 604 L 8.11 4.52 0.00 1.45 1.44 0.52 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 0.00 0.00 0.00 0.00 605 G 8.69 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 0.00 0.00 0.00 606 K 8.44 4.00 0.00 1.76 1.89 0.00 1.73 0.00 0.00 1.69 0.00 0.00 2.77 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.43 1.45 7.81 607 E 8.24 4.11 0.00 1.96 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 2.30 2.24 0.00 608 D 7.94 4.62 0.00 2.96 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 0.00 609 A 7.44 4.66 1.26 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 0.00 0.00 610 V 8.43 4.86 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 0.78 0.00 0.00 1.10 0.00 0.00 611 L 7.89 4.75 0.00 1.64 1.62 0.88 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 612 K 8.49 4.38 0.00 1.62 1.36 0.00 1.51 0.00 0.00 1.49 0.00 0.00 2.60 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.32 1.26 7.81 613 V 8.93 4.67 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.59 0.00 0.00 0.91 0.00 0.00 614 A 8.88 5.13 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 615 V 9.00 4.79 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 1.14 0.00 0.00 1.06 0.00 0.00 616 K 9.10 5.08 0.00 1.79 1.58 0.00 1.64 0.00 0.00 1.65 0.00 0.00 2.88 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.31 1.32 7.81 617 M 8.51 5.15 0.00 2.05 2.05 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.38 2.39 0.00 618 L 8.31 4.66 0.00 1.64 1.63 0.90 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 619 K 8.46 4.41 0.00 1.79 1.72 0.00 1.77 0.00 0.00 1.58 0.00 0.00 2.80 0.00 0.00 3.18 0.00 0.00 0.00 0.00 1.37 1.36 7.81 620 S 8.42 4.14 0.00 3.84 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 0.00 621 T 7.77 3.98 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 0.00 622 A 7.48 4.41 1.26 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 0.00 0.00 623 H 9.79 5.13 0.00 3.06 3.13 0.00 5.62 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 0.00 624 A 8.53 3.99 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 0.00 625 D 8.11 4.31 0.00 2.71 2.64 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 0.00 626 E 8.00 3.87 0.00 2.15 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 2.38 2.04 0.00 627 K 7.82 3.97 0.00 1.88 1.83 0.00 1.66 0.00 0.00 1.64 0.00 0.00 2.93 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.44 1.69 7.81 628 E 8.24 3.92 0.00 2.14 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.51 0.00 629 A 7.74 4.04 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 0.00 630 L 7.76 3.81 0.00 1.76 1.78 0.85 0.73 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 0.00 631 M 8.05 3.93 0.00 2.04 2.18 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 2.57 2.75 0.00 632 S 8.47 4.19 0.00 3.99 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 633 E 8.24 3.88 0.00 2.10 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 2.12 2.11 0.00 634 L 8.03 3.82 0.00 1.78 1.74 0.47 0.52 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 0.00 635 K 8.42 4.18 0.00 1.97 2.04 0.00 1.75 0.00 0.00 2.09 0.00 0.00 2.98 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.57 1.52 7.81 636 I 7.70 3.81 2.04 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 1.57 0.82 1.08 0.00 0.00 637 M 7.95 4.13 0.00 1.90 1.92 0.00 0.00 0.00 0.00 0.00 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.41 2.76 0.00 638 S 8.03 4.16 0.00 4.54 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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1.27 0.62 1.09 0.00 0.00 647 V 8.84 3.87 2.18 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 0.81 0.00 0.00 1.20 0.00 0.00 648 N 9.19 4.78 0.00 2.86 2.72 0.00 0.00 6.31 6.17 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 0.00 649 L 8.33 4.16 0.00 1.28 1.04 0.67 -0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.28 0.00 0.00 0.00 0.00 0.00 0.00 650 L 9.45 4.73 0.00 1.54 1.65 0.90 0.91 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 0.00 651 G 7.39 4.40 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 0.00 652 A 8.71 5.15 1.22 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 0.00 0.00 653 C 9.29 5.27 0.00 2.91 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 0.00 654 T 9.14 4.37 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 0.61 0.00 0.00 655 H 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7.99 3.73 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 0.97 0.00 0.00 1.11 0.00 0.00 820 K 8.17 4.15 0.00 1.49 1.47 0.00 1.63 0.00 0.00 1.74 0.00 0.00 2.54 0.00 0.00 2.63 0.00 0.00 0.00 0.00 0.70 1.14 7.81 821 W 8.84 4.67 0.00 3.68 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 0.00 822 M 7.83 4.54 0.00 1.96 2.01 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3.06 2.67 0.00 823 A 8.07 2.58 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 3.21 0.00 2.06 1.94 0.00 2.31 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.59 0.00 825 E 7.60 4.02 0.00 2.07 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 2.14 2.23 0.00 826 S 7.36 4.37 0.00 3.71 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 0.00 827 I 7.00 3.66 1.04 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.36 0.89 0.00 0.00 828 F 8.09 4.89 0.00 2.91 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 0.00 829 D 8.09 4.84 0.00 2.74 2.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 830 C 7.77 4.67 0.00 3.12 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 0.00 831 V 6.90 3.75 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 0.92 0.00 0.00 0.88 0.00 0.00 832 Y 8.47 4.94 0.00 2.96 2.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 833 T 9.10 4.78 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 1.23 0.00 0.00 834 V 8.37 3.72 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.95 0.00 0.00 835 Q 8.08 4.05 0.00 2.20 2.16 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 1.58 0.00 0.00 0.00 0.00 0.00 0.00 869 V 7.21 3.59 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 -0.04 0.00 0.00 0.81 0.00 0.00 870 K 8.09 4.06 0.00 2.00 2.02 0.00 1.46 0.00 0.00 1.57 0.00 0.00 2.84 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.42 1.37 7.81 871 D 8.06 4.74 0.00 2.83 2.70 0.00 0.00 0.00 0.00 0.00 0.00 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 G 7.87 4.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 873 Y 8.06 4.23 0.00 2.87 2.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 874 Q 7.19 4.03 0.00 1.88 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.77 0.00 0.00 0.00 0.00 0.00 2.10 2.47 0.00 875 M 7.27 3.72 0.00 1.25 1.10 0.00 0.00 0.00 0.00 0.00 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 1.43 0.00 876 A 8.19 4.23 1.26 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 0.00 0.00 877 Q 8.03 3.24 0.00 0.93 1.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.99 0.00 0.00 0.00 0.00 0.00 2.04 1.87 0.00 878 P 0.00 4.24 0.00 2.26 1.41 0.00 3.39 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.65 0.00 879 A 8.19 3.59 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 880 F 7.70 4.76 0.00 3.29 3.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 881 A 7.66 4.12 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 882 P 0.00 4.42 0.00 2.11 1.96 0.00 3.37 0.00 0.00 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.15 0.00 883 K 8.62 3.92 0.00 1.87 1.84 0.00 1.75 0.00 0.00 1.87 0.00 0.00 3.08 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.54 1.66 7.81 884 N 8.11 4.47 0.00 2.75 2.92 0.00 0.00 7.16 7.32 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 0.00 885 I 7.59 3.73 1.54 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.66 0.00 0.00 0.00 886 Y 7.99 4.15 0.00 2.94 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 0.00 887 S 8.18 4.13 0.00 4.08 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 0.00 888 I 7.21 3.51 1.98 0.00 0.00 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.03 0.95 0.00 0.00 889 M 7.26 3.01 0.00 0.51 1.57 0.00 0.00 0.00 0.00 0.00 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.29 0.00 890 Q 7.26 3.66 0.00 1.84 1.91 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 2.13 1.49 0.00 891 A 7.63 3.86 1.18 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 0.00 0.00 892 C 8.01 4.04 0.00 2.42 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 0.00 893 W 6.87 4.06 0.00 3.03 2.27 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 0.00 894 A 7.21 4.20 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 0.00 895 L 8.79 4.21 0.00 1.72 1.81 0.99 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 896 E 8.08 4.21 0.00 1.95 1.69 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 2.11 2.24 0.00 897 P 0.00 4.29 0.00 2.22 2.11 0.00 3.64 0.00 0.00 4.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.08 0.00 898 T 7.93 4.17 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 0.00 899 H 8.20 4.65 0.00 3.33 3.36 0.00 5.67 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 900 R 7.45 4.43 0.00 1.94 1.82 0.00 3.39 0.00 0.00 3.62 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 1.87 0.00 901 P 0.00 4.47 0.00 2.03 1.92 0.00 3.67 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.80 0.00 902 T 8.39 4.18 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 1.17 0.00 0.00 903 F 8.27 4.10 0.00 3.05 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 0.00 904 Q 8.11 4.03 0.00 2.20 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.90 0.00 0.00 0.00 0.00 0.00 2.46 2.54 0.00 905 Q 8.30 4.01 0.00 2.25 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.59 0.00 0.00 0.00 0.00 0.00 2.36 2.38 0.00 906 I 7.88 3.80 2.03 0.00 0.00 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.74 1.01 0.00 0.00 907 C 8.47 4.15 0.00 3.19 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 0.00 908 S 8.32 4.11 0.00 3.93 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 0.00 909 F 8.47 4.27 0.00 3.19 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 0.00 910 L 8.54 3.96 0.00 2.00 1.78 1.12 0.77 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 0.00 911 Q 8.34 4.00 0.00 2.33 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.81 0.00 0.00 0.00 0.00 0.00 2.36 2.42 0.00 912 E 7.82 3.92 0.00 1.88 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 2.31 2.53 0.00 913 Q 7.69 3.84 0.00 2.09 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.82 0.00 0.00 0.00 0.00 0.00 2.04 2.21 0.00 914 A 8.05 4.03 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 0.00 915 Q 7.90 3.95 0.00 2.16 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.12 6.74 0.00 0.00 0.00 0.00 0.00 2.37 2.51 0.00 916 E 8.13 3.89 0.00 2.03 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 2.26 2.45 0.00 917 D 8.03 4.29 0.00 2.83 2.77 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 0.00 918 R 7.80 3.97 0.00 1.95 2.11 0.00 3.30 0.00 0.00 3.14 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.62 0.00 919 R 7.52 4.13 0.00 2.02 2.01 0.00 3.30 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 1.60 1.65 0.00 920 E 7.97 4.08 0.00 1.97 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.60 0.00 921 R 7.79 4.07 0.00 1.77 2.05 0.00 3.57 0.00 0.00 3.40 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.69 0.00 * Residues marked with a * may have inaccurate shift predictions.