NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 682 Q 4.3311 8.4445 119.1197 54.8530 29.2700 176.9136 683 L 4.0321 9.2202 120.8914 56.2610 42.0026 177.5383 684 I 4.3213 8.2885 119.1145 59.7518 39.0904 174.0824 685 P 4.3106 0.0000 0.0000 62.2404 32.8416 175.3500 686 P 4.2432 0.0000 0.0000 65.8699 31.3049 178.6739 687 L 3.9486 7.8624 118.4098 58.2440 42.0503 179.0002 688 I 3.7940 7.6847 119.3652 64.2887 37.1755 177.7339 689 N 4.3567 8.1893 117.9760 56.4005 38.6513 176.7663 690 L 3.9628 8.1606 121.9370 58.1735 42.0218 178.8646 691 L 4.1358 7.8899 117.6715 58.1720 41.7211 179.1240 692 M 4.2647 8.2231 118.8082 58.4731 31.7374 178.9640 693 S 4.2781 8.0562 112.9932 60.3215 63.3058 175.3782 694 I 4.3442 7.1472 114.5520 59.8696 38.2015 175.6736 695 E 4.1330 7.4244 121.1899 55.7378 29.8902 175.2121 696 P 4.4273 0.0000 0.0000 62.6758 31.9913 175.4647 697 D 4.6954 8.3065 119.6349 52.7151 42.3495 176.0118 698 V 3.6356 8.2000 120.4912 61.9653 31.4581 175.4579 699 I 4.4738 8.0712 123.1770 59.7689 39.2551 174.8237 700 Y 4.4759 8.5762 122.6422 56.8088 39.2244 175.6458 701 A 4.2216 9.3786 125.3268 52.5184 19.0994 178.3364 702 G 3.9304 8.6184 103.8301 46.6233 0.0000 173.7153 703 H 4.3600 8.4494 117.7627 54.9911 30.5402 173.8810 704 D 4.5260 8.0888 125.3334 53.6324 41.4881 175.7511 705 N 4.6834 8.5406 123.3628 53.7742 38.9408 176.0168 706 T 3.9360 7.4290 111.6126 64.4246 69.5976 176.7620 707 K 4.0263 8.0458 128.0704 53.9058 32.7703 178.0858 *709 D 4.4745 8.0726 115.2589 55.3152 41.2118 171.6335 710 T 4.2659 7.5258 108.7224 62.1098 69.6911 172.9573 711 S 4.0069 8.0118 118.0597 61.9866 62.5594 176.8520 712 S 4.1729 7.8818 116.9365 61.7452 62.7894 176.8758 713 S 4.0237 7.8981 115.3234 61.2930 62.2723 175.8688 714 L 3.8338 8.2768 123.3622 58.0364 41.8129 178.9145 715 L 3.8529 8.1933 119.4177 57.9235 41.4554 179.6032 716 T 3.7483 8.2816 116.0378 66.7495 68.1777 176.9514 717 S 4.1147 8.0139 117.0691 61.5409 62.7500 176.7764 718 L 3.8880 7.8418 121.7463 57.7468 41.2988 179.3259 719 N 4.3253 8.0953 116.6102 56.0751 38.4206 177.2914 720 Q 3.9756 8.1901 121.2853 59.1152 29.1709 178.0377 721 L 4.1327 8.3318 121.8086 58.1329 42.1211 179.1852 722 G 3.8413 8.3799 105.9634 47.7090 0.0000 175.3591 723 E 4.0373 8.3700 121.6149 59.3680 29.7641 179.2467 724 R 4.0880 8.1136 117.9765 59.1119 29.9935 179.1574 725 Q 4.0891 8.3504 118.3023 58.7347 28.7786 178.1834 726 L 4.1670 8.2984 121.4494 58.2302 42.1496 178.7451 727 L 4.0158 7.8964 119.7691 58.1723 41.8854 178.9621 728 S 4.1497 7.9667 112.6411 61.4467 62.3266 176.2841 729 V 3.7563 8.3029 121.4172 65.9710 31.0332 178.1421 730 V 3.6895 7.8621 117.0187 65.9903 31.7386 177.8241 731 K 4.1660 8.1929 118.2021 59.2019 31.9208 178.8969 732 W 4.3173 8.6208 129.1542 60.7416 30.7940 178.1269 733 S 3.3395 8.5637 113.9513 60.7851 61.9622 176.1165 734 K 4.2764 7.8713 120.8266 57.9554 32.0112 177.4827 735 S 4.5221 7.5858 113.2275 57.8335 64.4138 173.8647 736 L 3.7810 7.0357 123.0031 53.7279 41.5031 174.1918 737 P 4.3754 0.0000 0.0000 64.7410 31.9217 175.0838 738 G 4.2357 9.1347 111.0007 45.7789 0.0000 175.1643 739 F 4.1081 8.4033 121.8891 61.1430 39.3516 177.2794 740 R 3.9604 8.0083 114.3748 58.2585 29.2028 176.8932 741 N 4.5160 7.6955 114.8966 54.6140 39.0341 175.6114 742 L 4.1864 7.3320 118.2160 53.8897 42.6229 176.8143 743 H 4.0102 8.6865 120.7374 56.7493 31.5522 176.2679 744 I 3.5705 8.0356 127.6193 64.9026 36.9696 178.3601 745 D 4.3699 8.1396 118.9023 57.4543 40.6786 178.4743 746 D 4.2172 7.8783 118.9495 57.1883 40.8856 178.5318 747 Q 3.6564 7.8574 118.5283 58.9498 28.7271 179.0157 748 I 3.7318 7.6919 120.5456 64.6974 37.1320 178.5708 749 T 3.5971 7.8348 116.3974 66.6240 68.2219 176.6261 750 L 4.0428 8.2600 121.1011 57.7734 41.6579 179.6636 751 I 3.8440 8.0594 119.6380 64.6939 36.9232 178.5121 752 Q 4.1281 8.0149 117.2751 59.2000 28.3229 178.2204 753 Y 4.5734 8.6635 118.4479 60.9556 37.9545 178.1528 754 S 4.6557 8.5290 112.9866 58.2976 63.6608 175.4385 755 W 4.6117 8.3660 133.3660 61.5315 30.3114 177.1983 756 M 3.2460 8.1051 116.9176 58.4349 31.7008 178.2009 757 S 4.0251 7.9453 114.6394 61.7656 63.1444 176.5972 758 L 3.9992 8.3916 121.8313 57.9146 41.2628 179.6900 759 M 4.0415 7.8292 118.9936 58.3929 31.9010 179.2319 760 V 3.5903 7.9100 119.5014 64.6029 31.5653 178.2008 761 F 4.3840 8.5758 121.6780 61.1455 39.2295 177.4316 762 G 3.7987 8.4699 105.5275 47.6181 0.0000 175.4602 763 L 3.9712 8.1186 122.8760 57.8231 42.0765 179.3082 764 G 3.3050 8.0582 105.7742 47.3512 0.0000 175.4545 765 W 4.1674 8.2637 130.9088 60.3236 30.5886 178.2998 766 R 3.6028 8.0937 118.0083 59.2095 29.4075 179.3115 767 S 4.0056 8.0984 115.0719 61.5029 62.9061 176.0397 768 Y 4.1478 7.8484 122.0910 60.8407 38.3603 178.4330 769 K 3.2097 7.2971 118.1785 58.9704 32.0460 178.4525 770 H 4.4222 7.6396 115.1366 56.5495 29.4310 176.2678 771 V 4.4363 7.0207 112.9761 61.3455 32.7234 175.5452 772 S 3.8835 8.6844 111.6633 58.2481 60.3780 173.5445 773 G 4.0044 8.3491 105.8561 46.4034 0.0000 175.2010 774 Q 4.5374 8.4646 117.6258 56.7432 29.1216 175.3185 775 M 5.1430 7.6478 116.1594 53.9722 36.7455 174.6625 776 L 3.6600 8.3093 121.7332 53.6980 42.4867 175.6769 777 Y 4.4307 8.2539 129.1090 56.0767 36.1116 175.0098 778 F 4.1329 8.2979 121.3543 59.8940 39.9201 175.3893 779 A 4.4506 7.6258 120.0389 50.5303 22.2402 175.1259 780 P 3.8049 0.0000 0.0000 65.1602 31.3807 177.4164 781 D 4.8330 7.9325 114.5360 53.0152 40.0322 176.9845 782 L 4.5413 7.9175 123.4866 54.0299 43.5286 172.1210 783 I 4.6769 7.8473 121.2595 59.0396 39.2526 174.5211 784 L 4.9121 8.9427 128.0414 53.2194 44.1944 175.7227 785 N 5.7639 8.4302 118.9804 51.3708 40.5077 173.3978 786 E 4.3429 9.3388 116.8338 60.2487 29.7093 179.4520 787 Q 4.0022 8.4017 115.6445 59.3223 28.7627 177.9605 788 R 4.4680 7.9424 114.0223 56.6730 30.0897 177.1921 789 M 5.1196 7.8107 117.7769 53.7835 32.0907 175.5026 790 K 4.0733 8.1748 120.6245 58.9194 33.2789 178.4933 791 E 4.2489 8.2204 120.3800 55.6018 30.7848 177.0920 792 S 4.1101 9.0069 122.0491 61.9673 62.6890 176.7757 793 S 4.1837 8.9008 116.7467 61.2722 62.2803 175.9466 794 F 4.1320 8.3674 123.0011 61.2996 39.2695 176.3606 795 Y 4.1636 9.0519 120.0181 60.7621 38.6988 178.1830 796 S 3.9004 8.0958 116.1243 61.3448 62.9433 176.3161 797 L 3.7813 7.4643 122.7171 58.4133 41.6658 178.8885 798 C 3.9346 7.6502 116.4748 62.6761 27.7519 176.0675 799 L 4.0955 7.5257 119.7371 58.0179 41.3488 179.4742 800 T 3.9850 7.6283 115.5134 66.9225 68.4995 176.7727 801 M 3.9849 7.9737 120.6381 57.9441 32.0017 178.4746 802 W 4.1042 8.4980 128.6984 60.1922 30.6827 177.8821 803 Q 4.1534 7.9307 117.8820 58.9551 27.9737 178.7832 804 I 3.3320 7.5027 120.5325 63.8235 37.1192 176.5188 805 P 3.9508 0.0000 0.0000 65.7041 31.0892 178.5819 806 Q 3.9915 7.9667 116.5009 59.1992 28.5674 178.9522 807 E 3.9629 8.1153 119.4107 59.1539 29.4898 179.4092 808 F 4.2442 8.0361 118.3548 60.3847 38.5887 177.8883 809 V 3.6210 7.6255 117.0392 65.7076 31.4505 177.1387 810 K 4.0502 7.9519 118.7040 59.5436 32.0443 177.7570 811 L 4.1478 8.1272 116.0583 54.9421 42.3708 176.5617 812 Q 3.6022 7.6200 116.3803 55.4381 26.4815 174.5522 813 V 3.8260 7.3673 116.1449 63.2182 32.7107 175.8452 814 S 4.8534 8.8394 121.9536 57.2728 65.8824 175.2612 815 Q 3.4990 8.6955 122.9846 59.1404 28.4863 178.0325 816 E 3.9553 8.2478 119.1937 59.7093 29.5369 179.1700 817 E 3.9834 8.0787 117.9904 59.3164 29.4502 179.1631 818 F 4.0257 8.1833 120.7191 61.2430 39.1690 177.1692 819 L 3.6365 8.0263 118.8048 57.9365 41.5201 179.3759 820 C 4.2738 7.8002 116.3658 63.0343 28.0882 176.0704 821 M 4.0203 8.1882 120.4652 58.0224 31.4754 178.6983 822 K 3.6053 7.9878 120.1457 59.3307 32.3527 179.0998 823 V 3.6239 7.4641 118.6608 65.9447 31.1435 178.0528 824 L 4.0468 7.5454 117.5224 57.5314 41.7096 179.1778 825 L 4.0084 7.7659 119.0991 57.7108 41.3291 179.0134 826 L 4.1265 7.4906 120.2055 56.9392 41.9249 178.0808 827 L 5.0119 7.4376 116.1408 54.7619 43.0741 176.5951 828 N 4.8355 8.2338 116.7567 54.1510 39.3994 174.1912 829 T 5.3692 7.7302 112.6934 62.9172 72.8321 172.9546 830 I 4.8904 8.6683 117.5843 58.3748 41.7286 172.9099 831 P 4.8626 0.0000 0.0000 62.0614 32.0506 177.6060 832 L 3.9426 8.6841 121.7919 57.9958 41.6015 178.4601 833 E 4.0535 8.0881 113.2440 56.3852 30.0250 176.9203 834 G 3.7982 7.9864 107.0524 45.0826 0.0000 172.7714 835 L 4.3925 8.3244 118.9042 53.2898 42.9574 177.9157 836 R 3.9729 8.8750 119.9920 59.1624 30.5243 179.2149 837 S 4.7201 8.8055 115.3523 57.4949 61.9307 175.6801 838 Q 4.0101 7.9099 125.1622 59.8156 29.1801 177.2124 839 T 3.8881 7.9052 115.8983 66.9225 68.6080 176.2585 840 Q 4.0246 8.1216 120.7699 58.9648 28.9706 177.9336 841 F 4.1943 8.4564 122.0528 61.4389 39.5103 177.0758 842 E 3.8012 8.5246 118.2483 59.2950 29.2390 179.2151 843 E 3.9763 8.2065 118.8258 59.3934 29.4758 179.0698 844 M 4.0616 8.0187 118.3327 58.7104 32.4130 178.2186 845 R 3.8583 7.9145 119.0484 59.5591 30.0993 178.6966 846 S 4.1894 8.1948 115.2506 61.5554 62.8503 176.8115 847 S 4.0734 8.2037 116.9989 61.4576 62.7494 175.8924 848 Y 4.0876 8.0956 119.7985 60.0829 37.8157 177.8967 849 I 3.9977 7.7687 121.3953 64.3903 37.2609 178.5158 850 R 3.9899 8.2830 119.1043 59.0679 29.7462 178.7001 851 E 3.9849 8.1321 119.3659 58.9002 29.5065 178.5595 852 L 4.0064 8.1355 120.7054 58.0487 42.0943 179.0111 853 I 3.8061 7.8225 119.5155 64.3738 36.8421 178.4742 854 K 3.9433 7.9060 117.8142 59.3993 32.1097 178.7978 855 A 4.1713 8.3322 121.2423 55.4050 18.3391 179.7927 856 I 3.8292 8.1463 118.6410 64.4606 36.9686 178.9215 857 G 3.7367 8.3084 105.9018 47.4515 0.0000 175.2451 858 L 4.2263 7.6532 122.9063 57.8330 41.6450 178.0489 859 R 4.4071 7.8165 115.5391 58.5032 31.6480 180.4416 860 Q 4.3838 7.9429 124.8585 55.2761 25.9639 178.8874 861 K 4.2312 8.4092 126.2796 56.6806 32.5727 178.0629 862 G 3.8775 7.8655 107.7737 45.4151 0.0000 174.8532 863 V 3.7257 8.3355 116.8947 63.5085 31.6156 179.3159 864 V 3.6073 7.6849 117.7823 65.9353 31.4633 178.1094 865 S 4.1421 8.0079 113.8413 61.6007 62.5655 176.4451 866 S 4.1662 8.4419 118.6300 60.9277 62.8051 176.4485 867 S 4.2872 8.4059 119.3972 61.9365 62.1731 176.7773 868 Q 4.1755 8.4379 123.6873 60.1874 27.8374 180.4121 869 R 4.4996 8.4898 121.9706 58.6577 30.0866 178.4400 870 F 4.0559 8.2855 120.4476 61.2512 39.4127 176.4469 871 Y 4.0631 8.1824 118.8432 60.8593 38.1952 178.1459 872 Q 3.8739 8.2081 118.9082 58.9448 28.9338 178.8582 873 L 3.9555 7.9250 120.2918 57.8705 41.6882 179.6410 874 T 3.2277 7.3861 109.6477 64.0839 68.5083 176.6920 875 K 3.8355 7.6770 122.6957 58.9418 31.8582 178.5656 876 L 3.9085 7.3268 119.9281 57.9823 42.3939 178.6900 877 L 4.0305 7.5767 118.5089 57.7094 41.4932 179.0292 878 D 4.4620 8.1830 118.8213 57.7174 40.9901 178.8125 879 N 4.4709 8.3508 116.2629 55.7808 38.4439 177.3848 880 L 4.0151 7.6904 120.5930 57.6725 41.4369 178.9170 881 H 4.1258 7.8926 116.0910 59.0926 28.4747 177.4137 882 D 4.3496 8.0113 118.4725 57.1816 41.0573 178.1499 883 L 4.0469 7.7028 120.2330 58.3586 42.1041 179.3239 884 V 3.5399 8.2747 118.2500 65.5908 31.3201 177.6952 885 K 3.9361 7.8477 119.5530 59.6574 31.9295 178.7457 886 Q 4.0880 7.9977 117.9017 58.7943 28.5122 178.6054 887 L 4.0877 7.7124 119.7042 57.8916 41.6706 178.9487 888 H 4.3374 8.5340 116.6207 58.8479 28.6394 177.5941 889 L 3.9994 8.0455 122.0129 58.4105 42.0071 178.2413 890 Y 4.0272 8.1675 119.5169 60.7945 38.6138 177.6557 891 C 4.3417 8.6716 119.7734 62.6247 31.7336 175.1893 892 L 4.0431 8.3753 122.2061 58.2922 41.6174 178.6837 893 N 4.3070 8.4094 116.3920 56.8481 38.3153 177.6207 894 T 3.9202 7.6533 115.6094 66.2615 68.8414 176.3737 895 F 3.1368 8.4581 123.1732 61.1363 39.2102 177.3593 896 I 3.6003 7.8589 118.0923 63.4317 37.0497 177.4739 897 Q 4.5232 7.5377 117.1060 55.4275 28.9395 177.3414 898 S 4.2537 7.5772 120.3520 62.6375 62.5867 177.4208 899 R 3.8845 7.8548 123.8746 60.8396 29.0074 180.4117 900 A 4.2155 7.8866 121.1395 54.4900 18.5837 178.1006 901 L 4.3027 8.3778 113.8099 54.5420 42.1255 176.8595 902 S 3.7529 7.5548 113.6292 59.5395 60.7052 171.5247 903 V 4.2544 8.1138 122.5022 61.6191 32.6640 175.4686 904 E 4.4261 8.4886 123.8568 55.2294 30.4088 172.6317 905 F 4.7492 8.7495 121.6375 53.8930 41.0708 174.1015 906 P 4.5095 0.0000 0.0000 62.3212 33.1739 177.1482 907 E 4.0003 8.7404 119.2412 60.0902 29.3228 179.6725 908 M 3.9928 8.3802 118.4403 58.7427 32.0127 178.6463 909 M 3.5236 8.6498 118.6189 58.4010 32.2753 178.2265 910 S 4.0064 8.2981 115.6002 61.7146 63.0581 176.3779 911 E 3.8754 8.1837 121.8126 59.0918 29.3046 179.1121 912 V 3.4416 7.1476 118.4052 65.8273 31.2959 178.1501 913 I 3.5389 7.5296 119.4135 64.2858 36.6556 178.3575 914 A 3.9237 7.7211 120.4098 55.0634 18.2940 179.2255 915 A 4.1600 7.9445 118.1962 54.3053 18.8140 178.4171 916 Q 4.4986 8.1393 114.3029 56.2232 31.8862 177.6806 917 L 3.9064 7.8072 118.0163 57.5069 41.7205 177.6820 918 P 4.2522 0.0000 0.0000 65.4659 31.2959 178.5607 919 K 3.9392 7.9577 117.8304 59.5609 32.2372 178.8053 920 I 3.6078 8.1030 120.4893 64.4109 36.7995 178.5068 921 L 4.0592 8.1183 118.8522 57.4779 41.5385 178.7123 922 A 4.2759 7.7824 118.1327 52.1619 18.3916 177.6540 923 G 3.8132 7.7756 105.2570 46.8273 0.0000 173.6901 924 M 4.4913 7.8928 116.9917 55.2087 32.3690 176.3450 925 V 4.4767 7.3661 109.8535 59.9375 36.8410 175.2004 926 K 4.3691 9.0164 123.7542 54.0982 33.0997 173.1692 927 P 4.6254 0.0000 0.0000 62.3251 32.0044 175.9892 928 L 4.5805 8.9193 124.8122 53.5189 42.8887 176.3031 929 L 4.9990 8.2262 122.0376 53.0498 45.0036 176.7069 930 F 4.2856 9.7079 120.9438 59.1125 39.4494 176.1848 931 H 5.0157 8.6384 119.3569 54.0902 31.6478 174.3130 932 K 4.2485 8.8344 123.9331 54.9284 31.5695 174.3444 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 8.44 4.33 0.00 2.09 1.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 7.06 0.00 0.00 0.00 0.00 0.00 2.18 1.93 0.00 683 L 9.22 4.03 0.00 1.74 1.61 0.92 0.50 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 0.00 684 I 8.29 4.32 1.88 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 1.00 0.92 0.00 0.00 685 P 0.00 4.31 0.00 2.29 1.97 0.00 3.62 0.00 0.00 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.19 0.00 686 P 0.00 4.24 0.00 2.14 2.11 0.00 3.58 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 2.10 2.15 0.00 687 L 7.86 3.95 0.00 1.68 1.88 0.92 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 688 I 7.68 3.79 2.04 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 1.55 0.98 0.93 0.00 0.00 689 N 8.19 4.36 0.00 2.88 2.99 0.00 0.00 6.84 6.65 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 0.00 690 L 8.16 3.96 0.00 1.93 1.90 0.94 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 691 L 7.89 4.14 0.00 1.90 1.83 1.14 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 0.00 0.00 0.00 0.00 0.00 0.00 692 M 8.22 4.26 0.00 2.11 2.29 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 2.92 2.57 0.00 693 S 8.06 4.28 0.00 4.09 4.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 694 I 7.15 4.34 2.03 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 1.03 1.02 0.00 0.00 695 E 7.42 4.13 0.00 2.13 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 2.60 2.41 0.00 696 P 0.00 4.43 0.00 2.20 2.08 0.00 3.68 0.00 0.00 3.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.87 0.00 697 D 8.31 4.70 0.00 2.69 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 0.00 698 V 8.20 3.64 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.76 0.00 0.00 0.58 0.00 0.00 699 I 8.07 4.47 1.89 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.90 0.98 0.00 0.00 700 Y 8.58 4.48 0.00 2.95 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 0.00 701 A 9.38 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0.00 0.00 0.00 0.00 826 L 7.49 4.13 0.00 1.77 1.98 0.95 0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 827 L 7.44 5.01 0.00 1.68 1.70 0.77 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 828 N 8.23 4.84 0.00 3.02 2.82 0.00 0.00 7.00 6.61 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 0.00 829 T 7.73 5.37 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 1.03 0.00 0.00 830 I 8.67 4.89 1.69 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 1.10 0.47 0.00 0.00 831 P 0.00 4.86 0.00 2.25 2.07 0.00 3.79 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 2.00 1.89 0.00 832 L 8.68 3.94 0.00 1.64 1.73 0.92 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 833 E 8.09 4.05 0.00 2.05 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 2.24 2.22 0.00 834 G 7.99 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4.29 0.00 4.07 4.06 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 0.00 868 Q 8.44 4.18 0.00 2.09 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.58 0.00 0.00 0.00 0.00 0.00 2.29 2.23 0.00 869 R 8.49 4.50 0.00 2.01 2.03 0.00 3.15 0.00 0.00 3.23 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.53 0.00 870 F 8.29 4.06 0.00 3.35 3.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 871 Y 8.18 4.06 0.00 3.29 3.23 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 0.00 872 Q 8.21 3.87 0.00 2.31 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.59 0.00 0.00 0.00 0.00 0.00 2.49 2.79 0.00 873 L 7.92 3.96 0.00 1.44 1.56 0.90 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 874 T 7.39 3.23 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 -0.38 0.00 0.00 875 K 7.68 3.84 0.00 1.12 1.60 0.00 1.43 0.00 0.00 1.30 0.00 0.00 2.99 0.00 0.00 3.22 0.00 0.00 0.00 0.00 1.23 1.35 7.81 876 L 7.33 3.91 0.00 1.84 1.90 1.10 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 877 L 7.58 4.03 0.00 1.87 1.69 0.71 0.62 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 0.00 878 D 8.18 4.46 0.00 2.99 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 0.00 0.00 0.00 879 N 8.35 4.47 0.00 2.84 2.85 0.00 0.00 7.10 6.25 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 0.00 880 L 7.69 4.02 0.00 1.79 1.61 0.78 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 881 H 7.89 4.13 0.00 3.26 3.32 0.00 5.62 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 0.00 882 D 8.01 4.35 0.00 2.80 2.73 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 0.00 883 L 7.70 4.05 0.00 1.70 1.78 0.90 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 884 V 8.27 3.54 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 0.75 0.00 0.00 0.88 0.00 0.00 885 K 7.85 3.94 0.00 1.83 2.00 0.00 1.70 0.00 0.00 1.66 0.00 0.00 2.97 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.47 1.53 7.81 886 Q 8.00 4.09 0.00 2.29 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.59 0.00 0.00 0.00 0.00 0.00 2.39 2.40 0.00 887 L 7.71 4.09 0.00 1.76 1.67 0.83 1.07 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 0.00 888 H 8.53 4.34 0.00 3.38 3.37 0.00 5.64 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 0.00 889 L 8.05 4.00 0.00 1.84 1.89 0.97 0.94 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 0.00 890 Y 8.17 4.03 0.00 3.31 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 0.00 891 C 8.67 4.34 0.00 3.32 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 0.00 892 L 8.38 4.04 0.00 1.93 1.72 0.99 0.72 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 0.00 893 N 8.41 4.31 0.00 2.87 2.78 0.00 0.00 7.05 6.97 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 0.00 894 T 7.65 3.92 4.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 895 F 8.46 3.14 0.00 2.85 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 0.00 896 I 7.86 3.60 1.97 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 1.51 0.85 0.86 0.00 0.00 897 Q 7.54 4.52 0.00 2.04 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.72 0.00 0.00 0.00 0.00 0.00 2.25 2.45 0.00 898 S 7.58 4.25 0.00 4.44 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 0.00 899 R 7.85 3.88 0.00 1.84 1.98 0.00 3.25 0.00 0.00 3.34 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.27 0.00 900 A 7.89 4.22 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 0.00 901 L 8.38 4.30 0.00 1.66 1.74 0.92 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 902 S 7.55 3.75 0.00 3.98 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 0.00 903 V 8.11 4.25 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 0.61 0.00 0.00 1.00 0.00 0.00 904 E 8.49 4.43 0.00 2.07 1.71 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 2.24 2.15 0.00 905 F 8.75 4.75 0.00 3.10 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 0.00 906 P 0.00 4.51 0.00 2.41 2.03 0.00 3.68 0.00 0.00 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.22 0.00 907 E 8.74 4.00 0.00 2.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.44 2.38 0.00 908 M 8.38 3.99 0.00 2.01 2.34 0.00 0.00 0.00 0.00 0.00 2.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.74 2.54 0.00 909 M 8.65 3.52 0.00 2.22 1.90 0.00 0.00 0.00 0.00 0.00 2.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.71 2.61 0.00 910 S 8.30 4.01 0.00 4.18 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 0.00 911 E 8.18 3.88 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 2.26 2.30 0.00 912 V 7.15 3.44 1.50 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 0.78 0.00 0.00 0.63 0.00 0.00 913 I 7.53 3.54 1.17 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.48 0.15 0.00 0.00 914 A 7.72 3.92 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 7.94 4.16 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 916 Q 8.14 4.50 0.00 2.14 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.07 6.70 0.00 0.00 0.00 0.00 0.00 2.31 2.58 0.00 917 L 7.81 3.91 0.00 1.82 1.72 1.04 0.88 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 0.00 918 P 0.00 4.25 0.00 2.16 2.11 0.00 3.59 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.16 0.00 919 K 7.96 3.94 0.00 1.83 2.01 0.00 1.97 0.00 0.00 1.89 0.00 0.00 3.01 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.49 1.54 7.81 920 I 8.10 3.61 1.87 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.81 0.84 0.00 0.00 921 L 8.12 4.06 0.00 1.66 1.75 0.96 0.80 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 0.00 922 A 7.78 4.28 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 0.00 923 G 7.78 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.89 4.49 0.00 2.03 2.17 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.70 0.00 925 V 7.37 4.48 1.72 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 0.29 0.00 0.00 0.71 0.00 0.00 926 K 9.02 4.37 0.00 1.75 1.85 0.00 1.63 0.00 0.00 1.65 0.00 0.00 2.84 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.32 1.36 7.81 927 P 0.00 4.63 0.00 1.76 1.46 0.00 3.64 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 1.91 1.98 0.00 928 L 8.92 4.58 0.00 1.71 1.48 1.18 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 929 L 8.23 5.00 0.00 1.57 1.69 0.94 0.94 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 0.00 930 F 9.71 4.29 0.00 2.84 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 0.00 931 H 8.64 5.02 0.00 3.17 3.34 0.00 5.85 0.00 0.00 0.00 0.00 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 932 K 8.83 4.25 0.00 1.77 1.58 0.00 1.84 0.00 0.00 1.74 0.00 0.00 2.87 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.