NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 682 Q 4.2994 8.3029 119.1211 55.0438 29.4987 177.1479 683 L 4.1976 9.0536 117.3709 55.2147 41.2460 176.0111 684 I 4.2658 7.8101 121.0145 60.5580 39.2704 174.4166 685 P 4.3164 0.0000 0.0000 62.3173 32.9677 175.4324 686 P 4.2401 0.0000 0.0000 66.0362 31.3204 178.7757 687 L 3.9661 7.8738 118.2206 58.2277 42.1101 178.9050 688 I 3.8661 7.7241 119.3823 64.3545 37.1496 178.0190 689 N 4.4118 8.0802 117.2357 56.0984 38.3657 177.5209 690 L 4.0613 8.1120 122.0776 57.3372 41.5539 179.2873 691 L 4.0866 8.1438 117.9785 58.3646 41.6996 179.1230 692 M 4.2347 8.1193 117.9838 58.5766 32.1077 178.4185 693 S 4.2530 8.2180 114.5440 60.4311 63.0403 175.3626 694 I 4.4849 7.4257 114.3740 59.7831 38.1351 175.5135 695 E 4.1482 7.5010 121.6363 55.6706 29.8667 175.2206 696 P 4.5622 0.0000 0.0000 62.2508 32.3012 175.8004 697 D 4.6512 8.3624 119.2173 53.5942 41.4707 176.8881 698 V 3.7307 8.2903 120.8032 62.1728 31.7656 175.4940 699 I 4.5161 8.1731 123.8931 59.9232 38.7401 174.9556 700 Y 4.3906 8.6572 122.2831 57.0810 39.1038 175.4650 701 A 4.1897 9.2367 126.0350 52.9562 19.2688 179.0781 702 G 3.9790 9.3047 103.1613 45.3090 0.0000 173.1513 703 H 4.1540 8.1470 120.8850 56.9645 30.5572 174.1614 704 D 4.2056 7.9719 122.4050 50.6581 39.4234 176.5010 705 N 3.8432 8.4068 112.3435 53.3982 38.3075 173.5862 *708 P 4.1467 0.0000 0.0000 61.8497 32.8303 176.5244 709 D 4.3546 8.2623 118.9689 53.8465 38.8619 176.2896 710 T 4.3745 7.9938 116.3497 60.3922 71.9764 175.4891 711 S 3.9418 8.2880 114.7746 61.3423 62.3159 176.2456 712 S 4.1006 7.8843 117.8719 61.5319 62.3249 176.5089 713 S 4.2111 8.1756 116.4377 60.5376 62.7970 176.1927 714 L 3.9393 7.6219 124.1012 57.8938 41.9650 178.5992 715 L 3.9564 7.7989 118.9116 58.0449 41.5348 179.6501 716 T 3.7408 7.8526 115.7191 66.7477 68.3736 176.9595 717 S 4.1474 7.7422 116.4067 61.4792 62.7741 176.7508 718 L 3.9569 7.7231 121.7791 57.5852 41.2471 179.1841 719 N 4.3552 8.1036 116.6893 55.9810 38.4013 177.3143 720 Q 3.9218 8.1375 121.1851 59.0927 29.1058 178.0193 721 L 4.1108 8.0497 121.5960 58.0152 42.0805 179.1754 722 G 3.6744 8.0799 105.8235 47.7231 0.0000 175.1487 723 E 3.9300 8.4528 122.3218 59.2997 29.5745 179.2908 724 R 4.0202 8.1738 117.9070 59.2998 30.0030 179.1029 725 Q 4.1765 8.4273 119.7348 58.0125 28.7193 178.2337 726 L 4.0029 8.4403 122.0541 58.0053 42.1250 178.7497 727 L 4.0005 7.7997 120.1850 58.2835 41.5970 179.1569 728 S 4.2166 7.9762 113.8924 61.3070 62.8673 176.5455 729 V 3.7204 8.2262 122.2110 65.8307 31.1238 178.0321 730 V 3.6616 7.6707 116.3427 66.2338 31.1685 177.7930 731 K 4.1619 8.2625 118.0557 59.0798 31.7531 179.2310 732 W 4.2322 8.5416 129.1337 60.5726 30.3936 178.1933 733 S 3.1906 8.6319 114.4263 61.0132 61.8401 176.2839 734 K 4.2631 7.6215 119.6898 58.0783 31.9622 177.5694 735 S 4.4896 7.6588 113.4717 57.9648 64.3563 173.8241 736 L 3.6940 6.9913 122.0933 54.0135 41.3718 174.2108 737 P 4.3349 0.0000 0.0000 64.6066 31.7295 175.8211 738 G 4.1893 9.0847 111.0482 45.7337 0.0000 175.2971 739 F 4.0171 8.4696 121.9995 61.2297 39.3364 177.1647 740 R 4.1739 8.0668 113.8791 58.0180 29.1446 176.4351 741 N 4.6437 7.7002 115.4230 53.3036 38.9298 174.8190 742 L 4.5063 7.2497 118.7133 52.9916 43.6923 176.3875 743 H 4.0265 8.2931 119.7050 56.8409 31.6178 176.3689 744 I 3.6494 8.1015 126.5269 64.4793 36.9300 178.4433 745 D 4.3519 8.1949 119.3041 57.4956 40.6672 178.4198 746 D 4.1861 7.9476 118.7438 57.3525 40.8620 178.6026 747 Q 3.6537 7.9635 118.4758 59.0143 28.6336 179.1060 748 I 3.7656 7.8065 120.6235 64.6580 37.1484 178.6905 749 T 3.5766 7.9729 116.6097 66.5495 68.2753 176.8004 750 L 4.0250 7.9813 120.9309 57.7132 41.7381 179.6680 751 I 3.8285 7.9739 119.7313 64.7681 36.9825 178.6492 752 Q 4.3411 8.2393 117.3267 59.0693 28.5398 178.1858 753 Y 4.6258 8.2972 117.6037 59.8439 38.3932 176.8725 754 S 4.7087 8.1817 113.0595 57.5778 63.8501 175.6718 755 W 4.4391 8.3452 121.7462 60.3941 27.5785 177.7738 756 M 3.3896 6.5617 118.4514 58.0310 31.6639 178.0286 757 S 4.0568 7.7684 113.8226 61.5432 63.0009 176.2888 758 L 4.0125 8.0392 122.4514 57.8914 41.2958 179.4511 759 M 4.2340 8.3651 118.9600 58.1126 31.9369 179.0148 760 V 3.8540 7.9610 119.3045 64.2015 31.8864 178.3184 761 F 4.2841 8.4717 121.8247 60.8868 39.4224 176.9638 762 G 4.0581 8.4141 104.2695 46.3398 0.0000 175.4412 763 L 4.0811 7.5594 121.9693 57.8007 42.0424 178.9059 764 G 3.2207 7.7675 105.7021 47.2926 0.0000 175.3129 765 W 4.1693 8.0497 130.4810 60.2943 30.5913 178.0136 766 R 3.6514 7.8377 117.3050 59.4041 29.5829 179.2238 767 S 3.9997 8.0151 114.6607 61.8731 62.9893 176.2952 768 Y 4.3517 8.2599 122.3981 60.0534 38.1807 177.6749 769 K 3.1964 7.2060 119.8198 58.4426 32.5116 177.6201 770 H 4.4415 7.7047 114.7434 56.2516 29.4836 175.8354 771 V 4.4385 7.0484 113.8005 61.9515 32.7068 175.5880 772 S 3.8147 9.2962 111.4802 59.3609 60.4983 173.2931 773 G 4.0056 8.4362 105.2982 46.6715 0.0000 175.0310 774 Q 4.7784 8.3778 116.4311 55.7101 29.0731 175.3757 775 M 4.8905 7.6321 116.2511 54.0165 36.1555 174.6193 776 L 3.7538 7.7326 122.1885 53.8829 41.6063 176.0239 777 Y 4.5841 7.9319 128.5435 55.8022 37.2795 175.8131 778 F 4.0416 7.9876 122.0605 59.6475 39.8010 175.4197 779 A 4.5079 7.6411 120.9928 50.0863 22.1072 175.2601 780 P 3.8373 0.0000 0.0000 64.0053 31.3595 177.4467 781 D 4.9161 7.5126 115.4882 52.6014 39.8572 176.9809 782 L 4.5245 7.7449 122.4896 54.4897 43.8203 172.2865 783 I 4.8684 7.7335 121.5322 58.7522 40.3050 174.6208 784 L 4.8714 8.8128 126.7301 53.0683 44.6205 176.1815 785 N 5.4281 8.5034 121.3663 51.3835 39.8926 175.3725 786 E 4.2370 8.9835 116.7355 59.5828 29.7445 179.5625 787 Q 4.0588 8.4395 117.6704 58.5372 28.8034 177.2650 788 R 4.2542 7.7377 113.2662 57.1112 30.8272 177.0063 789 M 4.8392 7.1987 118.2449 53.9133 30.8505 175.7601 790 K 4.0496 7.8449 121.6169 59.2188 33.3856 178.3337 791 E 4.1185 8.0553 119.1852 56.4795 31.3364 176.9772 792 S 4.2363 8.8596 120.3676 61.6303 62.6107 176.3526 793 S 4.2505 8.6127 116.7122 61.8916 62.6128 176.4136 794 F 4.0810 8.7362 123.6097 61.1524 39.2627 176.3401 795 Y 4.4060 8.3588 119.1781 60.4943 38.2718 177.6063 796 S 3.9223 8.3314 114.7158 60.7873 62.4336 175.8627 797 L 3.7690 7.7817 123.2226 58.2589 41.7193 178.6261 798 C 3.9352 7.6412 116.6033 62.9260 27.8306 176.1921 799 L 4.1266 7.6016 119.3646 58.0666 41.2214 179.4421 800 T 4.1677 7.4802 115.5697 66.7408 68.5673 176.9695 801 M 3.9965 8.0242 120.7495 57.8399 31.8615 178.3488 802 W 4.2343 8.5314 128.5335 59.9071 30.7468 177.9191 803 Q 4.0041 7.8715 118.3236 59.1633 28.0007 178.2868 804 I 3.3914 7.5476 120.8101 63.7742 37.1904 176.7470 805 P 3.9254 0.0000 0.0000 65.7863 31.0292 178.3400 806 Q 4.0580 7.8412 118.3416 58.8314 28.5898 178.2333 807 E 4.0352 8.1463 119.7267 59.0545 29.4597 179.2596 808 F 4.1039 8.1191 118.2460 60.5828 39.0354 177.8723 809 V 3.7607 7.7121 117.7801 65.6861 31.0738 178.0672 810 K 3.9899 7.6582 118.8263 59.5995 32.1037 177.8842 811 L 4.1219 8.2316 116.0731 55.0360 42.3213 176.7987 812 Q 3.5635 7.2369 115.5394 55.4817 26.2771 174.0005 813 V 3.7709 7.5525 117.2475 62.8562 32.7106 176.2787 814 S 4.8517 9.0202 122.2566 57.3426 66.0116 175.2037 815 Q 3.5529 8.7211 122.8517 59.2393 28.6210 178.4500 816 E 3.9457 8.0751 119.0606 59.5080 29.7475 178.8569 817 E 3.9774 8.3223 118.6709 59.3569 29.4423 178.9425 818 F 4.1179 8.3712 120.8735 61.4825 38.8426 176.8739 819 L 3.4939 7.5695 117.7405 58.2057 41.5806 179.6418 820 C 4.2302 7.8133 116.2908 63.0847 28.1605 176.0993 821 M 3.9824 8.0838 120.3415 58.0437 31.2542 178.7202 822 K 3.4656 7.6540 119.3545 59.2129 32.6506 178.7911 823 V 3.7034 7.3224 117.9225 65.8917 31.2374 177.9870 824 L 4.0181 7.6994 118.4795 57.8021 41.2602 179.5391 825 L 3.9374 7.5965 118.8359 57.5435 41.2302 179.2469 826 L 4.1284 7.6636 119.5188 57.2013 42.0340 177.8862 827 L 5.1013 7.4144 117.3978 54.7620 43.1354 176.1986 828 N 4.9988 7.8548 116.0953 53.8275 40.0113 174.0059 829 T 5.3500 7.7992 112.4729 62.9221 72.7328 172.7159 830 I 4.7986 8.7250 118.0037 58.3224 41.8358 173.0156 831 P 4.8173 0.0000 0.0000 62.4115 31.8608 177.7808 832 L 3.9449 8.5935 121.0807 57.8805 41.5998 178.2196 833 E 4.1433 8.1187 113.3141 56.1181 30.0041 176.6411 834 G 3.7548 8.1395 107.3082 45.0623 0.0000 172.5510 835 L 4.5192 8.8814 121.4558 53.3021 43.8567 178.4083 836 R 3.9427 8.7974 118.4458 59.5863 30.1625 179.6976 837 S 4.6758 8.7851 116.9176 57.2384 60.1539 175.2987 838 Q 3.9814 7.6900 126.2387 59.6521 29.4044 177.0813 839 T 3.9382 8.0891 118.5525 67.6789 68.6233 177.1146 840 Q 4.0468 8.1233 121.6681 59.9563 27.9779 180.3319 841 F 4.3800 8.2044 121.0675 61.7304 39.4928 177.2804 842 E 3.8290 8.8266 118.6795 59.2892 29.1319 179.2231 843 E 3.9858 8.4250 119.0187 59.3591 29.3694 178.9489 844 M 4.0126 7.9415 118.4184 58.6300 32.4549 178.3280 845 R 3.8845 7.9731 119.1424 59.4175 30.0906 178.7144 846 S 4.2078 7.9171 114.7352 61.5288 62.6997 176.7634 847 S 4.0053 7.8604 117.6985 61.6983 62.5208 176.1579 848 Y 4.0949 7.7215 119.0068 60.3723 37.6874 178.0684 849 I 4.0409 7.6901 120.9428 64.3034 37.3879 178.4918 850 R 3.9655 8.3143 119.2299 59.0634 29.9473 178.6922 851 E 3.9442 8.4034 119.5764 59.0377 29.6112 178.6092 852 L 4.0321 8.1317 120.5377 58.3109 42.2152 179.0478 853 I 3.8622 7.9059 119.6432 64.2747 36.7128 178.6083 854 K 4.0105 7.7743 118.4799 59.3755 31.6591 179.0080 855 A 4.1700 7.9862 120.7412 54.8879 18.1754 179.6281 856 I 4.0320 7.9174 118.7519 63.9398 37.1023 178.0312 857 G 3.7842 7.9049 104.5448 46.1660 0.0000 175.2440 858 L 4.2157 7.4303 120.1672 56.9049 41.7616 177.8251 859 R 4.4948 7.9727 115.2492 56.2168 32.4364 175.9635 860 Q 4.4196 8.0888 116.1395 54.1869 30.2264 175.1278 *862 G 3.8942 8.0295 107.1058 45.8528 0.0000 174.0523 863 V 3.6339 8.1394 119.0347 65.3457 31.9742 178.6742 864 V 3.6323 7.6261 117.7448 65.9372 31.3546 177.9704 865 S 4.1561 8.0504 113.9253 61.2303 63.0248 176.4264 866 S 4.2158 7.7002 117.7014 61.2425 62.8856 176.4495 867 S 4.2356 8.5537 117.0391 60.9476 62.0959 176.0510 868 Q 4.1205 8.3971 121.3469 58.5822 28.6190 178.1089 869 R 4.3836 8.0238 120.7111 58.0634 30.0985 178.3867 870 F 4.1276 8.2837 120.8866 61.4179 39.3645 176.3263 871 Y 4.0043 7.9816 119.2317 60.7971 38.0061 178.2262 872 Q 4.0463 8.2195 118.7256 59.2239 28.7912 178.9446 873 L 4.0203 7.8880 120.1086 57.6695 41.6223 179.3329 874 T 3.3194 7.3981 109.0557 63.2836 68.7185 176.7707 875 K 3.9035 7.4849 122.8832 58.8809 31.9647 178.3806 876 L 3.9239 7.4617 119.6662 58.0878 42.2610 178.6364 877 L 4.0588 7.5079 118.7766 57.8467 41.6779 178.9963 878 D 4.4882 7.9426 118.7194 57.7472 40.8181 178.7332 879 N 4.5575 8.5129 115.8291 55.1945 38.3595 177.0986 880 L 4.0231 8.0475 121.5160 57.4567 41.5628 178.6912 881 H 4.1485 7.9311 116.2279 59.2336 28.4916 177.5021 882 D 4.3592 7.9962 118.4819 57.0302 40.4645 178.2033 883 L 4.0376 7.5733 121.0954 58.2637 42.1943 179.3266 884 V 3.4846 8.4721 118.5962 65.4680 31.3226 177.7439 885 K 3.8840 7.7207 119.8560 59.6497 31.9948 178.7726 886 Q 4.0592 7.7968 117.4612 58.8672 28.5680 178.5997 887 L 4.0359 7.7911 119.6267 57.9095 41.6008 179.1105 888 H 4.2557 8.2590 116.1997 58.8259 28.7087 177.4901 889 L 3.9940 7.9948 122.0589 58.4736 41.9286 178.3940 890 Y 4.0156 8.2400 119.4041 60.6735 38.6254 177.5308 891 C 4.3798 8.6124 119.7574 62.6969 31.7565 175.3320 892 L 4.0043 8.4205 122.2975 58.2840 41.4827 178.7213 893 N 4.3609 8.2607 116.5630 56.5969 38.2411 177.5926 894 T 3.9586 7.8177 116.3980 66.2098 68.7138 176.5865 895 F 3.7107 8.4745 123.0222 61.3374 39.2834 177.2989 896 I 3.5980 7.9086 118.2049 63.5163 37.0680 176.8990 897 Q 4.5743 7.5519 117.2951 55.4268 29.3134 177.1865 898 S 4.2630 8.1383 117.4164 62.0225 62.4891 176.9368 899 R 3.8199 7.8821 120.5209 58.9858 29.7464 178.4043 900 A 3.9633 7.8374 118.6831 55.3688 18.6809 179.2426 901 L 4.0971 7.7587 114.5936 54.9928 41.6923 177.4461 902 S 3.7552 7.5877 112.4685 59.0711 62.2352 171.9713 903 V 4.1460 7.6823 120.5900 62.2424 32.0784 175.0103 904 E 4.4743 8.1692 127.1926 55.6343 30.3429 176.0032 905 F 4.7421 8.6084 120.6973 54.8215 41.9455 174.3180 906 P 4.6281 0.0000 0.0000 61.6822 33.4890 177.2988 907 E 3.9784 8.7145 118.5013 60.2980 29.2669 179.7548 908 M 4.0478 8.3373 118.2603 58.6603 32.0389 178.8781 909 M 3.7334 8.7179 119.1996 58.4767 32.1780 178.9565 910 S 4.0860 8.5905 115.6809 61.3886 62.9291 176.6090 911 E 3.8716 7.9303 121.7366 59.4025 29.5120 179.2128 912 V 3.5848 7.2607 112.3502 64.5098 31.5038 178.2227 913 I 3.6342 7.3501 119.0952 64.5616 36.6588 178.0921 914 A 3.9271 7.6641 120.4320 55.3862 18.3825 179.3213 915 A 4.1444 8.3464 118.4183 54.5989 18.7454 178.4539 916 Q 4.5313 8.3648 114.1838 56.1459 31.8925 177.5812 917 L 3.9015 8.1549 118.2986 57.5670 41.6443 177.8150 918 P 4.2127 0.0000 0.0000 65.4164 31.3483 178.4578 919 K 3.8892 8.0303 117.9018 59.6146 32.0725 178.6909 920 I 3.5539 7.7174 119.8782 64.2942 36.7956 178.2302 921 L 3.9977 7.8028 118.4194 57.8358 41.6057 178.9710 922 A 4.2782 7.8641 116.7731 51.8526 18.2766 177.3210 923 G 3.8609 8.1025 105.9256 47.2058 0.0000 174.0241 924 M 4.5117 7.8864 116.4909 55.0675 32.4980 176.2886 925 V 4.5254 7.3654 109.9425 59.8551 36.9727 174.9145 926 K 4.4089 8.8590 123.1747 54.2908 33.5501 173.3324 927 P 4.7296 0.0000 0.0000 62.2062 32.2504 176.0453 928 L 4.4162 8.5600 125.0779 53.6667 42.1824 176.2964 929 L 4.9210 8.3640 123.7894 53.1447 44.0295 176.5508 930 F 4.4493 9.4734 119.7115 58.4406 39.9489 176.1328 931 H 4.6062 8.6294 122.3108 55.9341 29.4559 172.9898 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 8.30 4.30 0.00 2.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.92 6.97 0.00 0.00 0.00 0.00 0.00 2.26 1.93 0.00 683 L 9.05 4.20 0.00 1.74 1.59 0.92 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 684 I 7.81 4.27 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 1.31 0.99 0.93 0.00 0.00 685 P 0.00 4.32 0.00 2.24 1.98 0.00 3.64 0.00 0.00 3.92 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 2.12 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 2.17 0.00 687 L 7.87 3.97 0.00 1.70 1.88 0.95 0.70 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 0.00 688 I 7.72 3.87 2.06 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 1.67 1.06 0.93 0.00 0.00 689 N 8.08 4.41 0.00 3.00 2.88 0.00 0.00 6.99 6.30 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 0.00 690 L 8.11 4.06 0.00 1.92 1.75 0.93 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 691 L 8.14 4.09 0.00 1.81 1.84 1.09 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 692 M 8.12 4.23 0.00 2.33 2.09 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.63 2.62 0.00 693 S 8.22 4.25 0.00 4.16 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 0.00 694 I 7.43 4.48 2.03 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 1.95 1.04 1.02 0.00 0.00 695 E 7.50 4.15 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 2.63 2.41 0.00 696 P 0.00 4.56 0.00 2.21 2.09 0.00 3.65 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.90 0.00 697 D 8.36 4.65 0.00 2.76 2.72 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 0.00 698 V 8.29 3.73 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.78 0.00 0.00 0.88 0.00 0.00 699 I 8.17 4.52 1.92 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 1.49 0.86 0.99 0.00 0.00 700 Y 8.66 4.39 0.00 2.96 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 0.00 701 A 9.24 4.19 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 0.00 702 G 9.30 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 871 Y 7.98 4.00 0.00 3.22 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 0.00 872 Q 8.22 4.05 0.00 2.40 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.58 0.00 0.00 0.00 0.00 0.00 2.49 2.70 0.00 873 L 7.89 4.02 0.00 1.50 1.59 0.97 0.54 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 0.00 874 T 7.40 3.32 2.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.28 0.00 0.00 875 K 7.48 3.90 0.00 1.54 1.86 0.00 1.49 0.00 0.00 1.36 0.00 0.00 3.00 0.00 0.00 3.21 0.00 0.00 0.00 0.00 1.41 1.44 7.81 876 L 7.46 3.92 0.00 1.89 1.86 1.08 1.00 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 7.51 4.06 0.00 1.66 1.65 0.63 1.03 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 0.00 878 D 7.94 4.49 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 0.00 879 N 8.51 4.56 0.00 2.82 2.85 0.00 0.00 7.13 6.31 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 0.00 880 L 8.05 4.02 0.00 1.82 1.61 0.92 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 881 H 7.93 4.15 0.00 3.35 3.32 0.00 5.81 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 8.00 4.36 0.00 2.62 2.72 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 0.00 883 L 7.57 4.04 0.00 1.78 1.79 0.93 0.76 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 0.00 884 V 8.47 3.48 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.52 0.00 0.00 0.84 0.00 0.00 885 K 7.72 3.88 0.00 1.96 1.98 0.00 1.60 0.00 0.00 1.65 0.00 0.00 3.04 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.44 1.54 7.81 886 Q 7.80 4.06 0.00 2.14 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.58 0.00 0.00 0.00 0.00 0.00 2.38 2.39 0.00 887 L 7.79 4.04 0.00 1.80 1.64 0.91 1.04 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 0.00 888 H 8.26 4.26 0.00 3.39 3.31 0.00 5.64 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 889 L 7.99 3.99 0.00 1.82 1.90 0.95 0.82 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 8.24 4.02 0.00 3.21 3.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 891 C 8.61 4.38 0.00 3.36 3.36 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 0.00 892 L 8.42 4.00 0.00 1.89 1.70 0.94 0.59 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 0.00 893 N 8.26 4.36 0.00 2.86 2.79 0.00 0.00 6.99 7.10 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 0.00 894 T 7.82 3.96 4.66 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 0.00 0.00 1.49 0.00 0.00 895 F 8.47 3.71 0.00 2.80 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 0.00 896 I 7.91 3.60 1.93 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 1.56 0.89 0.89 0.00 0.00 897 Q 7.55 4.57 0.00 2.05 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.06 6.69 0.00 0.00 0.00 0.00 0.00 2.26 2.31 0.00 898 S 8.14 4.26 0.00 4.43 4.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 899 R 7.88 3.82 0.00 1.81 1.99 0.00 3.27 0.00 0.00 3.32 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.59 0.00 900 A 7.84 3.96 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 0.00 0.00 0.00 0.00 0.00 901 L 7.76 4.10 0.00 1.69 1.75 0.94 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 902 S 7.59 3.76 0.00 4.15 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 0.00 903 V 7.68 4.15 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.64 0.00 0.00 0.96 0.00 0.00 904 E 8.17 4.47 0.00 1.98 1.87 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 2.35 2.28 0.00 905 F 8.61 4.74 0.00 3.13 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 0.00 906 P 0.00 4.63 0.00 2.47 2.00 0.00 3.67 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 2.11 2.18 0.00 907 E 8.71 3.98 0.00 1.99 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 0.00 2.43 2.38 0.00 908 M 8.34 4.05 0.00 2.03 2.38 0.00 0.00 0.00 0.00 0.00 2.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.67 2.58 0.00 909 M 8.72 3.73 0.00 2.00 2.22 0.00 0.00 0.00 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.65 2.59 0.00 910 S 8.59 4.09 0.00 4.12 4.13 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 0.00 911 E 7.93 3.87 0.00 2.10 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 0.00 2.28 2.35 0.00 912 V 7.26 3.58 1.77 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 0.62 0.00 0.00 0.18 0.00 0.00 913 I 7.35 3.63 1.40 0.00 0.00 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.36 -0.10 0.00 0.00 914 A 7.66 3.93 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 0.00 915 A 8.35 4.14 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 0.00 916 Q 8.36 4.53 0.00 2.23 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.09 6.67 0.00 0.00 0.00 0.00 0.00 2.41 2.77 0.00 917 L 8.15 3.90 0.00 1.89 1.72 1.03 0.93 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 0.00 918 P 0.00 4.21 0.00 2.16 2.10 0.00 3.61 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 2.12 2.15 0.00 919 K 8.03 3.89 0.00 1.83 1.94 0.00 1.76 0.00 0.00 1.88 0.00 0.00 3.23 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.47 1.53 7.81 920 I 7.72 3.55 1.84 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.40 0.81 0.00 0.00 921 L 7.80 4.00 0.00 1.79 1.75 0.94 0.80 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 0.00 922 A 7.86 4.28 1.34 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 0.00 0.00 923 G 8.10 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 0.00 0.00 0.00 924 M 7.89 4.51 0.00 2.01 2.22 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.79 0.00 925 V 7.37 4.53 1.84 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 0.22 0.00 0.00 0.73 0.00 0.00 926 K 8.86 4.41 0.00 1.79 1.82 0.00 1.62 0.00 0.00 1.64 0.00 0.00 2.83 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.32 1.36 7.81 927 P 0.00 4.73 0.00 1.76 1.59 0.00 3.65 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 1.92 2.01 0.00 928 L 8.56 4.42 0.00 1.62 1.52 1.17 0.81 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 0.00 929 L 8.36 4.92 0.00 1.58 1.57 0.91 0.92 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 0.00 930 F 9.47 4.45 0.00 2.72 2.76 0.00 0.00 0.00 0.00 0.00 0.00 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 8.63 4.61 0.00 3.15 3.11 0.00 5.69 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.