NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 682 Q 4.3706 8.3444 119.1199 54.5200 30.1971 174.4439 683 L 4.4403 7.9601 118.3522 56.5858 43.8217 174.5336 684 I 4.4427 8.2227 119.5091 58.8308 39.9906 174.2324 685 P 4.4010 0.0000 0.0000 61.8495 33.1786 175.7725 686 P 4.2301 0.0000 0.0000 65.9554 31.4337 178.8975 687 L 4.0251 7.8523 118.3858 58.1604 41.9618 178.8889 688 I 3.8436 7.7131 119.4853 64.1655 37.2458 177.6656 689 N 4.4200 8.1581 118.1011 56.2797 38.7456 176.8154 690 L 4.1331 7.9330 123.4169 57.3298 41.9203 178.8766 691 L 4.0861 7.7387 118.2569 58.0434 41.7555 178.8276 692 M 4.2483 7.9992 118.1926 58.6066 31.9333 178.4049 693 S 4.2736 8.1709 114.3013 60.4830 63.0779 175.3617 694 I 4.5239 7.4370 114.4994 59.5084 37.8513 175.1820 695 E 4.1113 7.4684 123.3593 55.4732 29.7655 174.8623 696 P 4.4297 0.0000 0.0000 62.9144 31.7231 175.6002 697 D 4.6370 8.3434 119.5554 53.4899 41.6343 176.3971 698 V 3.6232 8.1855 120.1756 63.3316 31.8438 175.0086 699 I 4.4741 8.0841 126.9386 59.7133 39.2755 174.8205 700 Y 4.6049 8.4856 122.4761 56.9103 39.2374 175.5062 701 A 4.2495 9.3282 125.5117 52.5702 19.3037 178.3035 702 G 3.8352 8.7851 103.8696 46.9104 0.0000 172.9970 703 H 4.4474 8.4467 118.2877 54.6398 31.0946 174.1591 704 D 4.5873 7.9886 125.6946 53.0487 40.5004 175.8378 705 N 4.8607 8.6227 123.2408 53.9206 38.6154 176.1832 706 T 4.3331 8.2263 108.2393 61.5627 69.5771 174.7314 707 K 4.6336 7.1682 120.4596 53.6391 34.5913 174.3253 708 P 4.3198 0.0000 0.0000 62.6941 31.8192 176.3874 709 D 4.6489 8.4636 122.1771 54.7534 41.6324 176.3222 710 T 4.7215 8.2353 110.5896 59.0660 73.3679 174.7865 711 S 4.1443 8.8024 117.3031 61.9932 62.2473 176.9805 712 S 4.2247 8.0495 116.4413 61.4511 63.1115 176.3933 713 S 3.8927 8.2981 117.8033 60.9006 62.6324 176.4722 714 L 4.0816 7.8592 122.5436 57.4989 41.5969 179.2049 715 L 4.0016 7.9349 118.5503 57.9920 41.5523 179.6539 716 T 3.9280 8.6856 116.5279 66.7244 68.2809 177.0048 717 S 4.2058 8.0348 116.6949 61.4342 62.8865 176.6729 718 L 3.8261 8.0117 121.8331 57.7968 41.2886 179.3370 719 N 4.4832 8.1044 116.3616 56.0216 38.5718 177.4104 720 Q 3.9158 7.9277 120.7321 59.1340 29.1835 177.9729 721 L 4.1133 8.2560 121.7906 57.9268 41.9609 179.0644 722 G 3.6126 8.3929 106.2276 47.8495 0.0000 175.3189 723 E 3.8504 8.1941 121.9492 58.7828 29.6107 179.0826 724 R 3.9069 7.8657 117.7346 59.5448 30.2217 179.1016 725 Q 4.0814 8.2815 117.6913 58.6426 28.4977 178.9381 726 L 3.9063 7.5560 121.6622 58.1810 42.1859 178.9274 727 L 3.9643 7.7190 118.4562 57.8713 41.3947 179.5460 728 S 4.1752 8.0607 113.2521 61.1608 62.2115 176.4838 729 V 3.7210 7.9421 121.0956 66.0580 31.1577 178.0649 730 V 3.6366 7.8564 116.9120 65.9512 31.6682 177.6627 731 K 4.1130 8.2117 119.2089 59.2297 32.1544 178.3289 732 W 4.2950 8.5631 129.3227 60.8082 30.5574 177.9616 733 S 3.0871 8.3608 114.0576 60.9922 61.9385 176.1593 734 K 4.3022 7.7063 119.8533 57.8153 31.7920 177.5255 735 S 4.5471 7.5186 113.9723 57.7736 63.8381 173.5372 736 L 3.9744 7.5483 124.7090 53.1334 41.7356 174.2713 737 P 4.3637 0.0000 0.0000 64.7678 31.8689 175.3928 738 G 4.1690 9.1226 111.0518 45.8271 0.0000 175.2722 739 F 4.1057 8.5970 121.8010 61.3622 39.4509 177.5807 740 R 4.3554 7.9667 116.7994 58.4210 29.9675 177.4604 741 N 4.4398 7.5099 114.4983 55.2025 39.1918 175.1475 742 L 4.2156 7.3120 117.7012 54.2419 42.6532 176.2164 743 H 4.0053 8.5828 121.1320 56.4985 30.5390 176.0576 744 I 3.5861 8.2182 125.1343 64.6182 37.6690 177.9350 745 D 4.3898 8.3137 119.0323 57.3280 40.6344 178.3186 746 D 4.2480 8.0780 119.6293 57.1045 40.6684 178.7193 747 Q 3.6551 7.7676 118.1026 58.8918 28.6801 178.7173 748 I 3.7216 7.6228 120.6502 64.7727 37.1182 178.5524 749 T 3.7440 7.6858 117.7050 65.9996 68.2398 176.6922 750 L 4.0071 8.2686 121.1819 57.7788 41.5057 179.6673 751 I 3.9464 8.0341 119.8443 64.5253 37.1601 178.4388 752 Q 4.4164 8.4907 119.2177 59.4684 28.4185 178.4138 753 Y 4.7341 8.2228 116.0376 59.8019 38.1556 176.5199 754 S 4.6965 7.8931 111.4909 56.4465 64.9612 175.8139 755 W 4.3563 8.2771 121.1713 60.1150 27.6718 178.0168 756 M 3.8087 6.9190 118.8615 58.3338 31.6809 178.2306 757 S 4.0892 7.7935 113.9928 61.2499 63.2963 176.2084 758 L 4.0107 8.2213 122.7745 57.8876 41.3511 179.4451 759 M 4.2013 8.4570 118.9312 58.5075 31.9958 179.3398 760 V 3.6999 8.2005 119.2797 64.4972 31.5261 178.2313 761 F 4.5126 8.5157 121.9915 61.2120 39.1898 177.4864 762 G 3.8569 8.6075 105.5938 47.4816 0.0000 175.4194 763 L 4.0440 8.3792 123.0475 58.0290 42.0889 179.3124 764 G 3.4774 8.0220 105.5448 47.5134 0.0000 175.3283 765 W 4.1657 8.3228 130.9594 60.3088 30.5236 178.3318 766 R 3.4486 8.2256 118.1692 59.0903 29.3648 179.2465 767 S 4.0649 8.1711 115.1645 61.6574 62.4617 176.1389 768 Y 4.0953 8.3644 122.9335 60.2678 38.3261 177.7661 769 K 3.2995 6.8751 118.0418 59.0112 33.1736 178.2053 770 H 4.3746 7.5314 116.4650 57.1259 28.9507 176.1987 771 V 4.4384 6.8802 112.9396 61.1273 32.9307 175.4413 772 S 3.8142 8.4462 111.7472 58.4244 60.3138 172.9973 773 G 4.1500 8.7622 105.1691 46.7785 0.0000 175.5495 774 Q 4.6070 8.2236 119.2062 57.3780 29.2220 175.3833 775 M 4.4529 7.5137 115.1954 53.5249 36.9693 174.5025 776 L 3.9431 8.2321 120.4356 53.9088 42.6760 176.4016 777 Y 4.4674 8.6726 129.7143 56.0099 36.5492 175.8774 778 F 4.0898 8.1538 121.7252 59.7195 39.9695 175.5246 779 A 4.6332 7.5505 120.9605 50.0793 22.1657 175.1250 780 P 4.2917 0.0000 0.0000 64.2569 31.4060 177.4016 781 D 4.9319 8.0086 114.8889 52.8173 39.7742 177.0327 782 L 4.6541 8.0914 122.8367 54.2037 42.9611 173.0071 783 I 4.6663 7.6960 121.0875 58.9105 40.0538 175.0581 784 L 4.7204 8.8029 126.9419 52.8805 44.4748 176.5708 785 N 4.7766 8.4347 122.8523 51.2017 40.6036 174.9277 786 E 3.8587 8.5508 119.5808 59.7786 29.4426 178.4175 787 Q 3.8591 8.0507 118.5925 59.3988 28.9795 178.2998 788 R 3.9043 8.3403 118.1576 59.2467 30.2800 178.2322 789 M 4.1013 7.9285 118.8866 58.3009 31.8829 178.3946 790 K 2.7576 7.7146 117.4832 59.0621 32.2315 178.1854 791 E 4.3787 7.6257 115.7556 55.2441 29.8665 176.2549 792 S 4.4271 7.3712 114.4724 56.7065 64.4232 174.5957 793 S 4.1901 8.3669 116.2659 60.4676 62.9241 174.2422 794 F 5.5007 6.2286 113.0587 54.3712 37.4502 175.2364 795 Y 4.1838 7.8919 124.8396 61.6242 39.0732 176.8953 796 S 3.9386 8.1721 113.5210 61.0191 62.5489 175.6410 797 L 3.8315 7.7541 122.7175 57.8643 41.7925 178.4660 798 C 4.3017 7.8215 117.1645 62.5703 27.7981 176.0029 799 L 4.2338 7.4137 119.6991 57.9344 41.5410 179.2084 800 T 4.0127 7.6078 115.7372 67.1825 68.0813 176.6764 801 M 4.1532 8.0435 120.1673 57.8427 31.8797 178.5721 802 W 4.3707 8.2558 128.5159 60.0185 30.7553 177.8487 803 Q 3.9007 7.8541 118.0665 59.0366 28.1371 178.8952 804 I 3.3687 7.3432 120.0314 63.9286 37.1303 176.7730 805 P 4.0372 0.0000 0.0000 65.4927 31.0938 178.6883 806 Q 3.9268 7.8119 116.5924 58.8444 28.5375 178.6783 807 E 3.8827 7.9491 119.5308 59.4372 29.4437 179.1634 808 F 4.2163 7.8053 117.7470 60.6584 38.6602 177.8673 809 V 3.7462 7.5977 116.2135 66.0678 31.4603 177.7183 810 K 4.0700 7.9466 116.8141 59.6758 32.1005 178.9975 811 L 4.1233 8.4927 116.7766 54.7788 42.8371 176.7268 812 Q 3.6259 8.0363 116.9830 55.6667 26.4633 174.4536 813 V 3.8193 7.1708 116.4534 62.8843 32.7673 176.0625 814 S 4.7874 8.8633 122.2655 57.4600 65.7025 175.3268 815 Q 3.5435 8.6122 122.8154 59.3381 28.7681 178.1333 816 E 3.9758 8.1361 119.1372 59.4523 29.4964 179.0690 817 E 3.9602 8.1188 118.3943 59.1457 29.4603 179.0841 818 F 3.9893 8.1517 120.8577 61.2286 39.2042 176.9965 819 L 3.5040 7.6751 118.4244 58.0852 41.5216 179.5110 820 C 4.2352 7.8123 116.1916 62.9987 28.0522 176.0888 821 M 3.9778 8.1744 120.5258 58.2067 31.3165 178.6859 822 K 3.6542 7.9170 119.2170 59.2692 32.4582 178.7171 823 V 3.7983 7.5055 118.6529 66.0117 31.5055 178.0040 824 L 4.0737 7.7302 118.1773 57.7623 41.2580 179.5346 825 L 3.9226 7.6527 119.0382 57.6665 41.2941 179.2792 826 L 4.2839 7.6565 120.2884 56.4667 42.0357 177.8172 827 L 5.1060 7.5993 117.8915 54.6453 43.4824 176.3195 828 N 4.9171 8.0695 117.8953 54.2370 40.4996 174.2724 829 T 5.3050 7.9146 114.2856 62.6454 72.5386 172.9611 830 I 4.8312 8.5574 118.6852 58.1175 41.8753 173.2336 831 P 4.8019 0.0000 0.0000 62.2140 31.8375 177.7876 832 L 4.0540 8.5550 120.9060 57.8823 41.5739 178.3264 833 E 4.1326 8.1099 113.5061 56.3440 30.3512 177.2946 834 G 3.7229 8.3002 107.7750 44.5174 0.0000 172.4124 835 L 4.7326 8.0944 118.1649 52.5151 44.6918 177.1840 836 R 3.9997 8.5098 119.3935 59.1634 30.4187 179.1301 837 S 4.8259 8.2526 114.7827 57.4764 62.7880 175.9267 838 Q 4.0349 8.0564 124.6597 60.0170 29.0684 177.4805 839 T 3.9031 7.8838 115.7375 66.8524 68.6374 176.5424 840 Q 4.0356 8.1235 119.4574 58.9222 28.7433 178.6370 841 F 4.1962 8.7632 122.1249 61.4126 39.4716 177.1586 842 E 3.7293 8.5447 118.2530 59.2097 29.0667 179.1250 843 E 4.0238 8.1410 118.6705 59.0000 29.6194 179.0164 844 M 4.0274 7.6639 118.1387 58.6451 32.4455 178.1794 845 R 3.9369 7.6364 118.8595 59.6337 30.1458 178.6373 846 S 4.1855 8.0234 114.9415 61.5293 62.6795 176.9471 847 S 3.9964 7.6824 118.0820 61.8675 62.6293 176.3718 848 Y 4.1057 7.8227 118.5303 60.5650 37.5023 178.5610 849 I 3.9734 7.7823 121.3550 64.4950 37.3267 178.5516 850 R 3.9494 7.9961 119.0102 59.1298 29.7925 178.7580 851 E 3.9603 8.5328 119.7389 59.0053 29.5206 178.5659 852 L 4.0066 8.2179 120.5756 58.2871 42.0925 179.0668 853 I 3.7970 7.7718 119.3416 64.1804 36.7342 178.6458 854 K 3.9522 7.6969 117.9556 59.3513 32.2080 178.7388 855 A 4.1723 8.1645 121.1099 55.4546 18.1913 179.8078 856 I 3.8240 8.1938 118.5075 64.4480 35.7686 178.8762 857 G 3.6855 8.4896 106.6124 47.3486 0.0000 175.5517 858 L 4.2785 7.5776 120.1376 56.9852 41.5878 177.9603 859 R 4.4052 7.3334 113.4443 57.2799 32.4337 175.9574 860 Q 4.2881 8.2490 122.8074 55.1921 27.5447 175.7145 861 K 4.1667 8.4148 124.8380 56.7259 32.5194 178.5428 862 G 3.8535 7.8835 105.8934 44.3129 0.0000 174.5476 863 V 3.5777 8.2567 122.4044 65.8416 31.6337 178.8446 864 V 3.6248 7.6792 117.4758 65.9574 31.4401 177.9184 865 S 4.1402 8.0198 114.6424 61.7956 62.8724 176.7599 866 S 4.2138 8.4019 116.9642 61.4517 62.4251 176.4431 867 S 4.1787 7.8347 117.2056 61.2469 62.1452 175.8576 868 Q 4.0722 8.4045 122.7378 59.0604 28.7503 178.0713 869 R 4.3726 8.5045 121.7304 58.7140 30.1117 178.0559 870 F 4.0043 8.3143 120.6157 61.4527 39.2676 176.5005 871 Y 3.9848 8.0454 118.9459 60.8322 38.5153 178.0007 872 Q 3.9145 8.1404 118.9157 59.0346 28.8935 178.9998 873 L 3.9436 8.1639 120.6088 57.8511 41.5714 179.6242 874 T 3.3053 7.4013 109.7805 64.0256 68.6474 176.7865 875 K 3.7220 7.8681 122.9875 58.9898 31.8919 178.3472 876 L 3.8845 7.3005 119.0861 58.3196 42.3941 178.5267 877 L 4.0316 7.6389 118.5340 58.0956 41.1067 179.3407 878 D 4.4989 8.4287 118.8848 57.5259 40.2109 178.6006 879 N 4.4619 8.2105 116.6227 55.7494 38.4257 177.2824 880 L 4.0979 7.7444 120.2912 57.4317 41.6818 178.9167 881 H 4.1363 7.7655 116.2572 58.8547 28.0973 177.4758 882 D 4.3683 7.8157 119.6271 57.3594 40.6712 178.4917 883 L 4.4400 7.8277 121.6669 57.6344 42.0690 178.9416 884 V 3.5322 8.1115 118.7833 65.8219 31.3706 178.1918 885 K 4.2086 7.7282 117.7116 59.9107 32.3221 179.0804 886 Q 4.0333 7.7790 118.6701 58.9939 28.6527 179.0211 887 L 4.0456 7.6548 119.6086 58.1015 41.5912 179.2718 888 H 4.1810 8.1924 116.2308 58.6106 28.5581 177.5587 889 L 3.9584 8.3580 122.6134 58.4879 41.9275 178.5312 890 Y 3.7922 8.1995 119.3677 60.4575 38.7593 177.5646 891 C 4.2133 8.2914 119.9476 62.3026 31.6791 175.2310 892 L 4.0408 8.1696 122.0209 58.3837 41.7634 178.5960 893 N 4.2901 8.2911 116.4248 56.7760 38.2398 177.4278 894 T 3.8751 7.6668 115.9182 66.6147 68.6361 176.0846 895 F 4.3556 8.1308 122.1310 61.1500 39.1503 177.2980 896 I 3.5928 8.0082 119.7226 64.6832 36.7354 178.5025 897 Q 4.0987 7.9512 117.4879 58.4938 28.5159 178.4418 898 S 4.4556 7.4883 115.2765 59.4022 63.0498 174.1669 899 R 4.2620 7.0262 117.4122 54.3007 29.6130 175.6899 900 A 4.3032 7.9326 126.4266 51.5482 19.6641 174.8040 *909 M 4.5856 8.5098 123.7402 56.4398 34.2019 179.1653 910 S 4.4708 8.1656 119.1467 63.2351 62.8004 178.9916 911 E 4.4747 8.2393 122.3082 61.8635 29.6752 183.9394 912 V 3.9063 7.7734 119.2563 65.8782 31.3044 180.8578 913 I 4.1514 7.6082 117.2392 63.3883 36.8496 177.8730 914 A 4.1458 7.5960 120.9439 53.8276 18.4867 178.3418 915 A 4.4421 7.4065 116.4040 52.8187 19.8100 178.1479 916 Q 4.3083 7.7557 115.8676 57.1434 29.6508 177.6105 917 L 3.9397 7.5800 119.5166 57.2358 41.7819 177.0049 918 P 4.4583 0.0000 0.0000 63.6900 31.3059 176.5130 919 K 4.2781 8.0042 117.9965 56.2182 33.7156 176.6600 920 I 4.3256 7.5635 109.5187 60.0741 39.0001 174.9327 921 L 4.6346 7.9049 122.8226 53.0319 44.1716 175.3794 922 A 4.2673 8.2672 126.1182 52.5975 19.6913 177.8780 923 G 3.9557 8.9515 108.2776 45.7271 0.0000 173.9385 924 M 4.4232 7.8288 118.9341 55.3202 34.1051 175.4277 925 V 4.4449 7.3525 109.4166 59.0611 35.8180 174.9076 926 K 4.4031 8.6311 122.0018 54.3186 34.2238 173.5266 927 P 4.6779 0.0000 0.0000 62.3064 32.3335 176.7532 928 L 4.4094 8.8566 125.1691 53.3079 41.4709 176.0665 929 L 4.5480 8.0962 123.6467 54.0341 42.6546 177.7853 930 F 4.2914 9.5174 121.5563 59.3082 39.3524 175.8689 931 H 5.0662 8.4705 119.1924 54.1269 31.9713 174.2478 932 K 4.2498 8.8112 123.3075 54.9522 31.5982 175.3870 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 682 Q 8.34 4.37 0.00 2.09 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.79 0.00 0.00 0.00 0.00 0.00 2.18 1.93 0.00 683 L 7.96 4.44 0.00 1.61 1.64 0.93 0.76 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 0.00 684 I 8.22 4.44 1.89 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.74 0.93 0.00 0.00 685 P 0.00 4.40 0.00 2.24 1.96 0.00 3.63 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.18 0.00 686 P 0.00 4.23 0.00 2.14 2.11 0.00 3.59 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 2.11 2.15 0.00 687 L 7.85 4.03 0.00 1.71 1.90 0.95 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 688 I 7.71 3.84 2.02 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.43 0.93 0.00 0.00 689 N 8.16 4.42 0.00 2.88 2.95 0.00 0.00 6.77 6.70 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 0.00 690 L 7.93 4.13 0.00 1.79 1.84 0.93 0.42 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 0.00 691 L 7.74 4.09 0.00 1.95 1.82 1.05 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 692 M 8.00 4.25 0.00 2.26 2.10 0.00 0.00 0.00 0.00 0.00 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.65 2.64 0.00 693 S 8.17 4.27 0.00 4.17 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 0.00 694 I 7.44 4.52 1.94 0.00 0.00 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.95 0.96 0.00 0.00 695 E 7.47 4.11 0.00 2.18 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.39 2.33 0.00 696 P 0.00 4.43 0.00 2.25 2.12 0.00 3.71 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.92 0.00 697 D 8.34 4.64 0.00 2.73 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 0.00 698 V 8.19 3.62 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 0.48 0.00 0.00 0.92 0.00 0.00 699 I 8.08 4.47 1.88 0.00 0.00 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 1.59 0.80 0.95 0.00 0.00 700 Y 8.49 4.60 0.00 3.00 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 0.00 701 A 9.33 4.25 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 0.00 702 G 8.79 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 0.00 703 H 8.45 4.45 0.00 3.10 3.39 0.00 5.91 0.00 0.00 0.00 0.00 6.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 704 D 7.99 4.59 0.00 2.72 2.45 0.00 0.00 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0.00 0.00 2.65 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.47 0.00 837 S 8.25 4.83 0.00 3.92 3.86 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 0.00 838 Q 8.06 4.03 0.00 2.37 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.33 6.91 0.00 0.00 0.00 0.00 0.00 2.46 2.61 0.00 839 T 7.88 3.90 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 1.22 0.00 0.00 840 Q 8.12 4.04 0.00 2.31 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.91 0.00 0.00 0.00 0.00 0.00 2.46 2.49 0.00 841 F 8.76 4.20 0.00 3.03 3.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 842 E 8.54 3.73 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 2.45 2.80 0.00 843 E 8.14 4.02 0.00 2.14 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 2.52 2.44 0.00 844 M 7.66 4.03 0.00 2.19 2.10 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 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0.00 0.00 0.00 0.00 853 I 7.77 3.80 2.03 0.00 0.00 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.58 0.86 0.00 0.00 854 K 7.70 3.95 0.00 1.92 1.87 0.00 1.84 0.00 0.00 1.70 0.00 0.00 3.00 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.47 1.63 7.81 855 A 8.16 4.17 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 856 I 8.19 3.82 2.10 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.97 1.03 0.00 0.00 857 G 8.49 3.69 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 0.00 0.00 0.00 858 L 7.58 4.28 0.00 1.79 1.77 0.94 1.21 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 0.00 859 R 7.33 4.41 0.00 1.75 1.94 0.00 3.19 0.00 0.00 3.18 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.54 0.00 860 Q 8.25 4.29 0.00 2.09 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.00 6.97 0.00 0.00 0.00 0.00 0.00 2.50 2.38 0.00 861 K 8.41 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0.00 0.00 3.25 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.52 0.00 870 F 8.31 4.00 0.00 3.36 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 0.00 871 Y 8.05 3.98 0.00 3.18 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 0.00 872 Q 8.14 3.91 0.00 2.32 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.59 0.00 0.00 0.00 0.00 0.00 2.50 2.83 0.00 873 L 8.16 3.94 0.00 1.38 1.55 0.95 0.51 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 0.00 874 T 7.40 3.31 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 -0.65 0.00 0.00 875 K 7.87 3.72 0.00 1.03 1.61 0.00 1.44 0.00 0.00 1.31 0.00 0.00 3.03 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.25 1.36 7.81 876 L 7.30 3.88 0.00 1.83 1.91 1.13 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 877 L 7.64 4.03 0.00 1.86 1.69 0.73 0.76 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 0.00 878 D 8.43 4.50 0.00 2.94 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 0.00 879 N 8.21 4.46 0.00 2.93 2.85 0.00 0.00 6.97 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 0.00 880 L 7.74 4.10 0.00 1.76 1.63 0.84 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 881 H 7.77 4.14 0.00 3.29 3.31 0.00 5.62 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 882 D 7.82 4.37 0.00 2.87 2.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 883 L 7.83 4.44 0.00 1.69 1.65 0.99 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 884 V 8.11 3.53 2.10 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 0.89 0.00 0.00 0.92 0.00 0.00 885 K 7.73 4.21 0.00 2.23 2.18 0.00 1.37 0.00 0.00 1.63 0.00 0.00 2.90 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.63 1.66 7.81 886 Q 7.78 4.03 0.00 2.36 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.85 0.00 0.00 0.00 0.00 0.00 2.42 2.43 0.00 887 L 7.65 4.05 0.00 1.65 1.64 0.88 1.52 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 0.00 888 H 8.19 4.18 0.00 3.33 3.31 0.00 5.82 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 0.00 889 L 8.36 3.96 0.00 1.76 1.99 0.93 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 890 Y 8.20 3.79 0.00 3.29 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 0.00 891 C 8.29 4.21 0.00 3.26 3.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 892 L 8.17 4.04 0.00 1.84 1.85 1.04 0.76 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 0.00 893 N 8.29 4.29 0.00 2.54 2.69 0.00 0.00 7.09 6.58 0.00 0.00 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 T 7.67 3.88 4.57 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 1.29 0.00 0.00 895 F 8.13 4.36 0.00 3.27 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 0.00 896 I 8.01 3.59 2.02 0.00 0.00 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 1.58 1.28 0.89 0.00 0.00 897 Q 7.95 4.10 0.00 2.01 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.97 0.00 0.00 0.00 0.00 0.00 2.36 2.45 0.00 898 S 7.49 4.46 0.00 3.88 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 0.00 899 R 7.03 4.26 0.00 1.81 1.83 0.00 2.81 0.00 0.00 2.40 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 1.31 0.00 900 A 7.93 4.30 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 0.00 0.00 0.00 0.00 0.00 *909 M 8.51 4.59 0.00 2.11 2.19 0.00 0.00 0.00 0.00 0.00 -0.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.51 0.00 910 S 8.17 4.47 0.00 3.71 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 0.00 911 E 8.24 4.47 0.00 1.97 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 0.00 2.31 1.94 0.00 912 V 7.77 3.91 2.08 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 0.79 0.00 0.00 0.93 0.00 0.00 913 I 7.61 4.15 1.90 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 1.52 1.30 0.93 0.00 0.00 914 A 7.60 4.15 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 A 7.41 4.44 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 0.00 916 Q 7.76 4.31 0.00 2.08 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.97 6.81 0.00 0.00 0.00 0.00 0.00 2.44 2.37 0.00 917 L 7.58 3.94 0.00 1.73 1.72 0.92 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 0.00 0.00 0.00 0.00 0.00 0.00 918 P 0.00 4.46 0.00 2.12 2.13 0.00 3.76 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 1.98 0.00 919 K 8.00 4.28 0.00 1.74 1.33 0.00 1.61 0.00 0.00 1.38 0.00 0.00 3.16 0.00 0.00 3.22 0.00 0.00 0.00 0.00 1.10 1.21 7.81 920 I 7.56 4.33 1.88 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 1.29 0.64 0.99 0.00 0.00 921 L 7.90 4.63 0.00 1.86 1.50 0.91 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 922 A 8.27 4.27 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 0.00 923 G 8.95 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 924 M 7.83 4.42 0.00 1.93 2.01 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 2.46 2.49 0.00 925 V 7.35 4.44 1.73 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 0.11 0.00 0.00 0.69 0.00 0.00 926 K 8.63 4.40 0.00 1.75 1.80 0.00 1.61 0.00 0.00 1.63 0.00 0.00 2.85 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.29 1.34 7.81 927 P 0.00 4.68 0.00 1.70 1.26 0.00 3.62 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 1.87 1.94 0.00 928 L 8.86 4.41 0.00 1.40 1.52 1.19 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 929 L 8.10 4.55 0.00 1.63 1.85 0.92 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 930 F 9.52 4.29 0.00 2.73 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 0.00 931 H 8.47 5.07 0.00 3.20 3.30 0.00 5.65 0.00 0.00 0.00 0.00 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 932 K 8.81 4.25 0.00 1.77 1.58 0.00 1.84 0.00 0.00 1.74 0.00 0.00 2.84 0.00 0.00 2.69 0.00 0.00 0.00 0.00 1.36 1.00 7.81 * Residues marked with a * may have inaccurate shift predictions.