NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 649 P 4.4267 0.0000 0.0000 61.7420 31.7956 175.4381 650 L 3.9683 8.0842 123.3626 53.7985 43.0447 174.7647 651 G 4.0143 7.6891 110.4448 45.0322 0.0000 172.3727 652 S 4.6358 8.7010 118.4548 56.6551 66.0122 173.6403 653 R 4.9873 8.8048 125.6780 54.5325 32.3116 175.0180 654 L 4.6830 8.9613 125.3064 53.6617 43.7499 175.9708 655 F 5.2173 8.9726 121.3403 55.8268 41.2678 174.4043 656 S 5.0033 9.0491 117.8021 56.4015 66.8507 172.5782 657 R 5.1973 8.5865 118.7693 54.6451 33.2340 173.9626 658 F 4.9223 9.6250 126.9535 56.6237 42.9546 172.9315 659 D 5.1217 7.8846 125.9030 52.7213 41.4680 176.0049 660 D 4.4312 9.1474 124.8863 53.8198 42.1365 176.2059 661 G 3.7657 8.4420 112.2419 44.7963 0.0000 173.4352 662 I 3.8165 8.1616 123.1171 60.2930 38.6749 174.8583 663 K 4.5287 8.3187 128.4485 54.1767 33.9388 175.8447 664 L 4.2013 8.2419 125.6504 54.3410 42.3474 176.2475 665 D 4.4792 8.3641 120.8945 56.4173 41.1341 177.6706 666 R 4.1742 8.7607 120.4254 56.2062 28.3536 176.5470 667 E 4.1942 7.7224 117.7233 56.0144 29.9950 176.2790 668 G 4.3033 8.3406 110.5254 43.5629 0.0000 171.0930 669 W 5.1584 8.1307 127.4838 54.9259 34.0154 176.0196 670 F 4.3150 6.3203 120.7409 59.4715 38.4608 175.6341 671 S 4.7951 6.4710 113.2212 55.8920 64.9489 174.3781 672 V 3.6869 8.2393 117.8678 64.2757 31.5064 176.8029 673 T 3.6836 7.5757 116.9624 61.9683 68.1350 173.3825 674 P 4.3772 0.0000 0.0000 62.2194 33.3297 176.5620 675 E 3.1560 8.0375 122.0638 59.5130 29.1910 179.7790 676 K 3.9988 7.7104 117.4859 59.3360 32.1543 179.3707 677 I 3.4341 7.7135 119.3912 64.1899 37.1896 177.9085 678 A 3.6271 8.0482 121.9536 55.2239 18.0919 179.2407 679 E 3.6895 8.2893 117.2520 59.9539 29.5750 179.3244 680 H 4.0029 7.9645 117.8098 59.1234 29.8368 177.2888 681 I 3.6935 8.0573 121.6230 64.4199 36.9531 178.2387 682 A 4.0661 8.1888 121.9007 55.0409 17.8887 179.8279 683 G 3.5570 8.1043 103.5676 48.0118 0.0000 175.8792 684 R 4.0473 7.9975 120.5325 58.9634 30.2490 179.3454 685 V 3.7992 8.3868 118.7402 66.0768 31.3800 178.2107 686 S 4.2778 8.2418 112.6948 60.8223 63.0049 175.4942 687 Q 4.3536 7.4995 118.3760 55.6563 29.0877 176.1425 688 S 4.3949 7.0861 116.0408 57.5744 63.5849 173.7311 689 F 4.2818 8.7691 124.5533 59.3909 39.3168 175.2190 690 K 3.4819 8.1448 128.9236 57.9839 29.2005 176.4849 691 C 4.6136 7.8708 116.3208 58.1441 28.1707 173.1761 692 D 4.7843 9.0473 123.8089 53.6564 43.1367 176.9553 693 V 4.6910 7.8295 119.1469 60.7537 34.3825 174.6225 694 V 4.7538 8.5485 127.4311 59.7625 34.5157 174.7262 695 V 4.2825 8.5118 124.3681 61.9085 32.7698 174.4011 696 D 5.0484 8.6641 129.3114 52.9942 40.6527 176.4607 697 A 3.5896 8.4446 128.6325 53.6967 18.8269 177.8040 698 F 4.7767 7.6990 112.9615 56.0624 39.8291 174.1305 699 C 4.6968 8.8822 118.4087 57.9515 31.3524 176.3963 700 G 3.6427 8.2157 110.4062 47.2195 0.0000 174.8546 701 V 3.7782 8.1380 116.2967 61.7876 31.6802 177.0708 702 G 3.8790 8.4442 109.2929 45.6590 0.0000 175.9681 703 G 3.5474 8.1296 108.1052 47.8050 0.0000 175.9946 704 N 4.0074 8.0701 118.6769 55.9136 38.6963 177.2263 705 T 4.0241 7.6466 116.9606 67.1356 68.6476 176.3011 706 I 3.6391 7.8750 121.3182 64.6127 36.8347 178.6023 707 Q 3.9133 7.1838 117.4560 58.7469 28.6678 178.3718 708 F 4.3249 7.8665 118.6713 60.5674 38.9676 177.6178 709 A 4.0667 8.2689 120.4092 55.0847 17.9411 179.5994 710 L 4.1285 7.9075 116.6939 57.3714 41.7695 178.8768 711 T 4.2588 7.5469 108.0780 61.7496 70.4932 175.1968 712 G 3.9331 7.5461 110.5957 46.1228 0.0000 172.8127 *714 R 4.2954 7.5422 119.2084 56.3225 32.6728 175.3499 715 V 4.6378 8.3788 121.7815 61.1636 35.0733 174.3526 716 I 4.6224 8.5709 128.7698 60.0187 38.4405 174.3016 717 A 5.0615 8.4824 130.4070 50.2011 20.9827 175.3293 718 I 5.2939 8.5177 123.5497 58.8547 40.6203 174.4941 719 D 4.9550 8.3602 124.5508 53.0034 44.2442 175.7842 720 I 3.9498 8.6550 124.2515 62.0846 38.8163 175.3265 721 D 4.7711 8.3188 120.7966 52.3712 42.2460 174.9847 722 P 4.3179 0.0000 0.0000 65.4603 31.3167 178.7340 723 V 3.5029 7.8716 118.3323 65.8534 31.4784 177.9613 724 K 3.8497 7.9613 117.6979 59.4946 31.8795 179.0731 725 I 3.4550 7.5297 119.1642 64.4055 36.9540 178.3263 726 A 3.8348 7.8157 121.3832 55.1601 18.1685 179.7261 727 L 3.8026 8.0410 117.3503 57.5972 41.5628 179.4694 728 A 4.3386 8.1525 122.4043 54.5775 18.2797 179.7902 729 R 3.4228 7.4377 116.7590 59.2479 30.1140 178.8194 730 N 4.2340 7.5863 116.1848 56.5799 38.6570 177.0178 731 N 4.3097 8.0530 117.2794 56.3829 38.5983 177.1610 732 A 4.1220 8.2632 122.1838 55.4763 18.5430 179.5982 733 E 3.9962 8.1533 116.5329 59.4250 29.2765 179.6468 734 V 3.6142 7.6489 117.5080 66.0580 31.6974 176.8634 735 Y 4.4124 8.0624 113.0634 57.2470 37.9475 175.6756 736 G 4.0181 8.0456 108.0013 46.6626 0.0000 174.4248 737 I 4.7680 8.0137 109.5112 59.9935 38.9182 176.7368 738 A 4.0904 8.4218 127.0371 55.9043 18.1921 180.2935 739 D 4.4817 8.1040 113.7544 55.7608 39.6957 177.3517 740 K 4.2325 8.1668 118.8012 57.0401 32.6879 175.8977 741 I 4.7566 7.3731 119.6631 59.2458 39.7426 175.0546 742 E 4.4502 8.8227 126.6614 54.6698 31.0294 175.2036 743 F 4.9289 8.6170 124.0963 57.0616 40.5312 175.5111 744 I 4.5832 8.9399 123.7002 59.6451 40.8288 174.0165 745 C 5.1905 8.3161 128.1444 58.7358 31.6937 172.5545 746 G 3.9750 8.0000 112.5621 46.1976 0.0000 170.5271 747 D 4.8609 8.0232 119.5303 53.1849 41.7596 176.2068 748 F 4.0762 9.0068 129.0713 61.7757 38.9503 177.0314 749 L 3.6928 7.9448 117.0170 57.4390 41.4164 178.9852 750 L 4.1883 7.6675 117.4882 56.8467 42.1720 178.4300 751 L 4.3496 7.7786 118.5024 56.7299 41.7404 178.7545 752 A 3.5984 7.4369 121.1043 55.2212 17.9669 179.5573 753 S 3.9618 7.3176 110.5493 60.0295 62.7905 174.8936 754 F 4.9683 7.3464 119.0079 56.9850 39.4688 175.0495 755 L 4.6891 7.3837 120.4308 52.8475 43.3885 175.8311 756 K 4.4350 8.0509 121.1670 54.7413 34.4263 175.1685 757 A 4.4389 8.0307 126.3577 51.6462 21.6681 175.2890 758 D 4.6305 8.6393 119.7977 56.1439 41.8664 177.5880 759 V 4.7146 7.5415 116.8410 61.0065 35.5929 174.0596 760 V 4.6647 8.5890 126.4522 61.0128 34.3828 173.6928 761 F 5.1666 9.3467 130.6835 56.5072 41.5819 174.0013 762 L 4.5050 8.3522 126.4388 52.6219 43.8275 176.1825 763 S 4.8330 8.0677 118.9049 55.9613 61.3788 171.2827 764 P 3.1626 0.0000 0.0000 60.5779 32.3711 174.8366 765 P 4.1944 0.0000 0.0000 62.6738 31.6587 177.0347 766 W 4.9796 8.2836 123.2074 55.5780 31.4391 175.1446 *774 A 4.3848 8.3552 119.9146 52.6204 19.8875 177.8398 775 E 4.2064 8.2926 115.0114 58.3323 30.2318 176.2220 776 T 4.7874 7.5641 113.6181 61.4517 71.3513 173.4707 777 F 4.1641 9.2528 129.9649 57.7687 40.8058 173.5321 778 D 5.0164 7.8270 126.5454 52.5025 41.8551 176.9261 779 I 3.8025 8.7401 121.4660 63.5501 38.0630 178.5868 780 R 4.2066 8.1125 121.2215 59.1244 30.5232 177.2780 781 T 4.1577 7.2238 115.3054 62.3530 67.5875 175.7915 *784 S 4.1613 7.6541 114.5907 57.3856 63.1812 171.3165 785 P 4.6194 0.0000 0.0000 61.4175 32.5842 175.5823 786 D 4.4752 8.7809 116.2393 54.8101 41.6312 177.6349 787 G 3.8277 9.2094 114.3307 48.7169 0.0000 175.5523 788 F 4.1455 9.2224 120.6678 60.2380 38.9760 177.4461 789 E 4.0371 8.5904 118.6073 59.4069 29.6139 178.6205 790 I 3.9725 8.0841 119.8937 64.6047 37.2211 178.2438 791 F 3.9221 8.2345 121.4594 61.0240 38.9991 177.0894 792 R 3.9831 8.2656 117.6725 59.6543 30.0758 178.2273 793 L 4.0070 8.0507 118.6207 57.8510 41.5697 179.6837 794 S 4.1827 8.2050 115.1545 61.3615 62.2657 176.6371 795 K 4.1152 7.7229 123.7034 58.6934 31.6170 178.9611 796 K 3.6851 7.4799 118.3880 59.1782 31.9106 178.9164 797 I 3.9358 7.2555 119.3368 62.9318 37.6216 175.7106 798 T 4.1847 6.5836 110.9079 61.8337 70.6406 173.0272 799 N 4.4922 8.7043 121.4044 54.9322 39.4630 175.8854 800 N 5.1058 7.9302 116.2479 51.9204 37.9890 173.3197 801 I 5.0574 8.3216 123.1496 59.1181 41.2822 174.1408 802 V 4.7911 8.8892 126.4512 61.2802 33.7873 173.4431 803 Y 4.9696 9.3179 129.9159 55.8688 40.7880 173.9542 804 F 5.0675 9.2289 130.9416 57.5200 40.2643 174.8341 805 L 4.3821 8.1870 125.4522 51.7020 46.5539 174.5547 806 P 4.0519 0.0000 0.0000 62.0188 31.7618 177.6237 807 R 3.7308 8.2289 116.5639 59.0355 29.5326 176.9141 808 N 4.6664 7.7948 114.4311 52.2802 37.5837 174.2083 809 A 4.1412 7.2716 121.9480 52.2747 18.9545 178.1562 810 D 4.3488 8.4762 121.8439 54.6200 41.8896 177.3586 811 I 3.8300 8.3197 129.0498 63.7977 37.2327 178.1477 812 D 4.3455 8.1747 119.8944 57.4171 40.4951 178.1517 813 Q 4.1320 8.2426 118.4519 59.2406 28.5776 179.2222 814 V 3.4509 7.5061 117.3290 66.1062 31.7963 177.6159 815 A 4.1811 8.4395 121.0211 55.1351 18.2428 179.7356 816 S 4.2180 8.2658 112.6013 61.3627 62.7264 176.7107 817 L 3.7662 7.3051 120.5477 57.1973 41.2997 178.4725 818 A 4.4454 8.1775 119.6877 51.9482 18.4616 178.2402 819 G 4.1095 7.6318 103.0870 44.2107 0.0000 171.4856 820 P 4.3229 0.0000 0.0000 64.2207 31.2598 176.9134 821 G 3.9309 9.0105 111.6774 45.1940 0.0000 173.4614 822 G 4.1374 8.1595 107.4627 45.1342 0.0000 172.8634 823 Q 5.2520 8.6027 122.5114 54.6576 30.7270 175.1633 824 V 4.4312 8.7000 124.1473 59.8245 35.4536 173.5453 825 E 4.8468 8.5184 123.6097 54.6172 32.3018 174.6829 826 I 4.3526 8.7427 129.2075 59.5648 38.5753 173.7288 827 E 4.9125 9.1195 129.5571 54.6160 30.8856 174.8960 828 Q 4.6742 9.3392 127.4787 55.0161 30.8304 174.5194 829 N 5.5349 9.1479 122.1491 51.8914 40.7647 173.7950 830 F 5.1287 9.5370 123.6744 55.5358 41.7589 174.3900 831 L 4.6073 8.7291 126.3637 53.2188 43.7747 175.8142 832 N 4.0077 9.1610 126.6498 55.2337 36.8307 173.8234 833 N 4.2214 8.4653 110.3367 53.4559 37.1243 174.3235 834 K 4.8061 7.5817 117.9657 54.4815 34.7408 175.4199 835 L 3.6730 8.5741 123.9958 55.0836 42.6695 175.4174 836 K 4.5774 8.6862 124.9648 57.8508 34.2504 176.0379 837 T 4.5436 7.4153 107.2538 60.5781 72.7493 171.8755 838 I 4.9423 8.3678 121.4039 59.7010 41.2615 175.1914 839 T 4.9680 9.2038 121.5825 61.8726 71.4541 172.7691 840 A 4.9907 9.0859 129.4907 50.6732 21.1414 175.2062 841 Y 5.2108 8.7114 119.9675 56.3002 41.3488 175.0004 842 F 5.0281 8.9231 120.4061 55.8706 43.5807 175.8494 843 G 3.8404 9.0329 107.6393 47.0661 0.0000 175.2519 844 D 4.7729 8.8879 123.0197 55.3856 40.7848 176.9459 845 L 4.3240 7.6838 120.7720 56.6170 42.2019 177.8333 846 I 3.7706 7.8340 118.8252 61.8134 37.4878 175.9697 847 R 4.0689 9.1694 123.3341 56.5260 29.8433 176.3896 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 649 P 0.00 4.43 0.00 2.09 2.14 0.00 3.67 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.13 0.00 650 L 8.08 3.97 0.00 1.85 1.61 0.93 0.59 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 0.00 651 G 7.69 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 652 S 8.70 4.64 0.00 3.90 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 0.00 653 R 8.80 4.99 0.00 1.95 1.89 0.00 3.40 0.00 0.00 3.32 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.69 0.00 654 L 8.96 4.68 0.00 1.58 1.58 0.95 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 655 F 8.97 5.22 0.00 2.85 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 0.00 656 S 9.05 5.00 0.00 3.94 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 0.00 657 R 8.59 5.20 0.00 1.91 1.86 0.00 2.92 0.00 0.00 3.04 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.87 0.00 658 F 9.62 4.92 0.00 3.08 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 0.00 659 D 7.88 5.12 0.00 2.31 2.43 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 0.00 660 D 9.15 4.43 0.00 2.74 2.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 661 G 8.44 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 0.00 662 I 8.16 3.82 1.86 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.73 0.90 0.00 0.00 663 K 8.32 4.53 0.00 1.71 1.67 0.00 1.69 0.00 0.00 1.67 0.00 0.00 3.00 0.00 0.00 2.75 0.00 0.00 0.00 0.00 1.33 1.48 7.81 664 L 8.24 4.20 0.00 1.75 1.57 0.92 1.11 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 0.00 665 D 8.36 4.48 0.00 2.65 2.63 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 0.00 666 R 8.76 4.17 0.00 1.98 2.19 0.00 3.37 0.00 0.00 3.23 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.58 0.00 667 E 7.72 4.19 0.00 2.12 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.26 0.00 668 G 8.34 4.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 669 W 8.13 5.16 0.00 3.17 2.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 670 F 6.32 4.32 0.00 1.98 2.54 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 0.00 671 S 6.47 4.80 0.00 3.91 3.97 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 0.00 672 V 8.24 3.69 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 0.60 0.00 0.00 0.71 0.00 0.00 673 T 7.58 3.68 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 0.76 0.00 0.00 674 P 0.00 4.38 0.00 2.19 1.99 0.00 3.71 0.00 0.00 4.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.25 0.00 675 E 8.04 3.16 0.00 1.16 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.47 0.00 676 K 7.71 4.00 0.00 2.06 2.01 0.00 1.75 0.00 0.00 1.79 0.00 0.00 2.92 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.42 1.45 7.81 677 I 7.71 3.43 2.03 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 1.98 0.94 1.00 0.00 0.00 678 A 8.05 3.63 1.17 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 0.00 0.00 679 E 8.29 3.69 0.00 2.09 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 2.35 2.37 0.00 680 H 7.96 4.00 0.00 2.60 2.77 0.00 5.79 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 681 I 8.06 3.69 1.77 0.00 0.00 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 1.56 0.51 1.08 0.00 0.00 682 A 8.19 4.07 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 683 G 8.10 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 684 R 8.00 4.05 0.00 2.12 1.94 0.00 2.96 0.00 0.00 2.89 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.51 0.00 685 V 8.39 3.80 2.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 1.27 0.00 0.00 686 S 8.24 4.28 0.00 4.09 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 0.00 687 Q 7.50 4.35 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0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 763 S 8.07 4.83 0.00 3.70 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 0.00 764 P 0.00 3.16 0.00 2.10 1.47 0.00 4.03 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.25 1.85 0.00 765 P 0.00 4.19 0.00 2.21 2.00 0.00 3.39 0.00 0.00 2.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.09 0.00 766 W 8.28 4.98 0.00 3.38 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 *774 A 8.36 4.38 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 0.00 775 E 8.29 4.21 0.00 1.94 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 2.25 2.32 0.00 776 T 7.56 4.79 4.23 0.00 0.00 0.00 0.00 0.00 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 0.00 777 F 9.25 4.16 0.00 3.02 2.79 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 0.00 788 F 9.22 4.15 0.00 3.35 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 0.00 789 E 8.59 4.04 0.00 2.20 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 0.00 2.45 2.53 0.00 790 I 8.08 3.97 2.20 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 1.80 1.16 1.09 0.00 0.00 791 F 8.23 3.92 0.00 3.27 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 0.00 792 R 8.27 3.98 0.00 2.07 2.20 0.00 3.34 0.00 0.00 3.28 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.74 0.00 793 L 8.05 4.01 0.00 1.76 1.33 0.97 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 794 S 8.21 4.18 0.00 3.60 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 0.00 795 K 7.72 4.12 0.00 1.85 1.88 0.00 1.42 0.00 0.00 1.70 0.00 0.00 3.25 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.45 1.34 7.81 796 K 7.48 3.69 0.00 1.74 1.74 0.00 1.59 0.00 0.00 1.51 0.00 0.00 2.92 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.39 1.55 7.81 797 I 7.26 3.94 1.95 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.37 0.87 0.00 0.00 798 T 6.58 4.18 4.38 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 1.21 0.00 0.00 799 N 8.70 4.49 0.00 2.81 2.94 0.00 0.00 6.97 8.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 800 N 7.93 5.11 0.00 2.95 2.87 0.00 0.00 6.89 7.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 801 I 8.32 5.06 1.89 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 1.00 0.60 0.73 0.00 0.00 802 V 8.89 4.79 2.38 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 0.98 0.00 0.00 1.08 0.00 0.00 803 Y 9.32 4.97 0.00 3.30 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 0.00 804 F 9.23 5.07 0.00 3.04 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 0.00 805 L 8.19 4.38 0.00 1.14 0.86 0.51 0.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 806 P 0.00 4.05 0.00 1.72 0.91 0.00 2.29 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 0.61 0.44 0.00 807 R 8.23 3.73 0.00 1.81 1.98 0.00 2.96 0.00 0.00 3.43 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.54 0.00 808 N 7.79 4.67 0.00 3.04 3.02 0.00 0.00 6.17 7.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 809 A 7.27 4.14 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 810 D 8.48 4.35 0.00 2.73 2.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 811 I 8.32 3.83 1.94 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.87 0.97 0.00 0.00 812 D 8.17 4.35 0.00 2.97 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 0.00 813 Q 8.24 4.13 0.00 2.31 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.77 0.00 0.00 0.00 0.00 0.00 2.68 2.47 0.00 814 V 7.51 3.45 1.98 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 0.75 0.00 0.00 0.72 0.00 0.00 815 A 8.44 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 0.00 816 S 8.27 4.22 0.00 4.15 4.32 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 0.00 817 L 7.31 3.77 0.00 0.97 0.13 0.25 0.05 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 0.00 818 A 8.18 4.45 1.61 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 0.00 0.00 0.00 819 G 7.63 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 0.00 820 P 0.00 4.32 0.00 2.21 2.12 0.00 3.86 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.00 0.00 821 G 9.01 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 0.00 0.00 0.00 822 G 8.16 4.14 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 823 Q 8.60 5.25 0.00 2.11 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 6.69 0.00 0.00 0.00 0.00 0.00 2.28 2.36 0.00 824 V 8.70 4.43 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 0.76 0.00 0.00 0.31 0.00 0.00 825 E 8.52 4.85 0.00 2.01 1.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.20 0.00 826 I 8.74 4.35 0.56 0.00 0.00 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.58 0.44 0.60 0.00 0.00 827 E 9.12 4.91 0.00 2.31 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 0.00 2.51 2.33 0.00 828 Q 9.34 4.67 0.00 2.34 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.60 6.56 0.00 0.00 0.00 0.00 0.00 2.43 2.77 0.00 829 N 9.15 5.53 0.00 2.78 2.95 0.00 0.00 6.50 7.98 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 0.00 830 F 9.54 5.13 0.00 3.02 2.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 831 L 8.73 4.61 0.00 1.82 1.57 0.95 0.21 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 0.00 832 N 9.16 4.01 0.00 2.91 2.89 0.00 0.00 7.26 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 0.00 833 N 8.47 4.22 0.00 2.89 2.87 0.00 0.00 7.03 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 0.00 834 K 7.58 4.81 0.00 1.95 1.97 0.00 1.35 0.00 0.00 1.61 0.00 0.00 2.93 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.56 1.37 7.81 835 L 8.57 3.67 0.00 1.23 1.48 0.28 0.47 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 0.00 836 K 8.69 4.58 0.00 1.65 1.84 0.00 1.77 0.00 0.00 1.79 0.00 0.00 3.00 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.59 1.53 7.81 837 T 7.42 4.54 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 1.32 0.00 0.00 838 I 8.37 4.94 1.61 0.00 0.00 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.65 0.75 0.00 0.00 839 T 9.20 4.97 4.38 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 0.92 0.00 0.00 840 A 9.09 4.99 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 0.00 841 Y 8.71 5.21 0.00 2.78 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 0.00 842 F 8.92 5.03 0.00 3.20 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 0.00 843 G 9.03 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 0.00 844 D 8.89 4.77 0.00 2.80 2.85 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 0.00 845 L 7.68 4.32 0.00 1.95 2.01 1.19 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 846 I 7.83 3.77 2.00 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.55 0.89 0.00 0.00 847 R 9.17 4.07 0.00 1.78 1.79 0.00 3.09 0.00 0.00 3.23 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.44 0.00 * Residues marked with a * may have inaccurate shift predictions.