NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 662 D 4.6393 8.2227 120.4544 53.4289 41.7890 174.1706 663 K 4.3908 8.2933 120.4279 54.9711 34.4544 173.8358 664 I 4.2074 8.7200 130.6666 60.2529 38.7141 174.1325 665 E 5.1905 8.7017 128.7392 54.5569 31.4340 175.0346 666 T 4.7788 8.8800 116.0420 60.1089 72.8296 172.3830 667 N 4.8847 8.6585 120.4053 52.4119 40.1689 174.7213 668 V 4.1482 8.7164 123.5407 61.1725 33.8266 174.0127 669 Y 4.8027 8.4402 126.6055 57.8632 38.6427 174.9437 670 C 4.9648 9.4468 122.1693 57.8809 31.9226 173.4312 671 N 4.9265 8.6732 120.0840 52.7162 39.7652 174.9085 672 L 4.4057 8.3314 121.8554 54.5809 42.8476 177.6816 673 T 4.3160 8.1014 111.9856 60.4503 71.3214 173.8461 674 P 4.2267 0.0000 0.0000 65.9414 31.1666 178.5734 675 E 3.9242 8.0917 117.3161 59.3140 29.5984 178.5548 676 Q 4.0141 7.8584 118.0181 58.9352 28.8006 178.7016 677 A 4.1578 8.1426 121.3571 55.1751 18.3663 179.4553 678 A 3.9451 7.9661 119.0382 55.6234 18.5083 179.4603 679 M 4.0124 8.2878 117.4603 58.9598 32.1191 178.2721 680 Y 3.9494 8.9137 120.4469 60.7992 38.9254 178.5674 681 K 4.1370 8.7598 119.4566 59.2994 32.2052 178.9221 682 A 4.8508 8.6885 123.0975 54.8300 17.7675 179.3407 683 E 3.8270 8.2591 117.4472 59.4161 29.5083 179.2216 684 V 3.6428 7.5841 117.9369 65.9333 31.5188 177.5531 685 E 4.0582 8.4088 118.6373 59.3999 29.1302 178.9098 686 N 4.1051 8.0278 116.4565 56.4691 38.9699 176.9150 687 L 3.9454 7.5077 120.4026 58.0783 42.0895 178.8975 688 F 4.3572 7.5289 115.4514 59.9396 38.9289 177.1547 689 N 4.6351 8.3300 115.6749 55.0856 38.2093 175.3423 690 N 4.9699 7.7959 115.4198 52.6359 39.9124 176.0710 691 I 3.5438 7.8000 120.3520 64.2203 38.2226 177.6631 692 D 4.5582 8.0375 118.1561 56.5515 41.1477 177.7675 693 S 4.1805 7.6265 113.6972 60.7111 62.9337 174.6779 694 V 4.3181 6.8491 113.2848 59.6437 33.3035 173.9622 695 T 4.5278 8.0685 109.4615 60.7833 71.8736 173.6489 696 G 4.1514 8.7350 108.3997 47.6963 0.0000 174.8935 697 I 3.6290 8.0650 117.9264 64.3881 37.4594 177.7285 698 K 4.0401 7.5364 117.5132 58.4954 32.0271 178.9972 699 R 4.0367 9.1050 120.7660 58.6653 30.2003 177.9467 700 K 4.2023 7.9433 119.0046 59.8017 31.8437 178.5967 701 G 3.6257 8.3375 105.4264 47.3296 0.0000 175.4398 702 M 4.0046 8.7629 122.0093 58.5831 32.3076 178.2001 703 I 3.5753 7.5326 119.3472 64.4588 37.3888 177.9155 704 L 3.8926 7.8243 119.6593 58.2463 41.4916 179.8415 705 S 4.0510 7.6996 111.6111 61.6383 62.2609 176.3885 706 T 3.8024 7.5684 118.5900 66.3578 68.1367 176.6093 707 L 3.8586 8.3169 121.3208 57.7170 41.7345 179.3255 708 L 4.0032 7.9702 120.0427 58.3402 42.0040 179.3089 709 K 4.2448 7.9849 119.4953 58.6362 31.9197 179.4746 710 L 3.8052 8.0479 119.8076 57.5779 41.2626 179.5858 711 K 4.2052 7.9206 117.6598 59.3766 31.8686 179.2155 712 Q 3.9721 7.8902 118.1247 58.7304 28.5505 178.4745 713 I 3.7824 7.9445 120.9513 64.6406 37.2175 178.4520 714 V 3.8629 7.8915 110.6365 63.0218 31.6763 176.9979 715 D 4.7954 7.5512 119.5123 55.7156 41.6383 176.9473 716 H 4.4741 8.2563 114.1621 53.5786 34.3357 172.8547 717 P 4.3275 0.0000 0.0000 65.8245 31.1514 178.2002 718 A 4.8953 8.2372 121.0115 53.9585 18.0191 179.1051 719 L 3.9657 7.8497 117.0269 56.7806 41.6841 178.3341 720 L 4.5240 7.8137 116.8929 54.7025 43.2816 177.0833 721 K 4.3949 7.9687 115.1404 54.8795 33.6512 178.2061 722 G 3.5920 9.1375 109.0721 47.3644 0.0000 171.8657 723 G 3.9092 8.6125 106.2314 43.9016 0.0000 171.8462 724 E 3.9074 8.5167 119.3892 56.8857 30.3625 178.6499 725 Q 4.3981 8.4329 127.8131 54.5187 27.9864 174.6136 726 S 4.7460 7.3486 114.9112 56.3524 66.1571 176.3900 727 V 3.7016 8.2871 120.5656 66.0555 31.4311 178.0723 728 R 3.9361 8.0533 118.3268 59.2377 29.8262 176.8802 729 R 4.2595 7.4427 112.9822 56.4064 30.5044 176.5570 730 S 4.7787 8.1621 113.5788 55.5084 65.4459 174.2024 731 G 4.1712 8.7254 117.5765 47.4378 0.0000 175.3039 732 K 3.9195 7.9470 120.2976 59.3756 32.0062 179.1736 733 M 4.3435 8.3830 119.0104 58.4283 31.7526 178.7106 734 I 3.7210 7.9903 119.9916 64.7911 37.3748 178.8171 735 R 4.0211 7.9719 118.3076 59.3226 29.7714 179.3123 736 T 3.9746 8.4736 116.2375 66.9819 68.4801 176.6242 737 M 4.1629 8.4464 120.7694 58.2361 31.7795 178.7200 738 E 3.9887 7.9875 118.8108 59.4303 29.6047 179.3796 739 I 3.7065 7.9214 119.8030 64.4336 37.0920 178.4831 740 I 3.7666 8.0106 120.6925 64.3309 36.9939 177.8901 741 E 3.9969 8.1694 120.0466 59.4350 29.0752 178.5555 742 E 3.9314 8.0300 118.7270 59.2480 29.6428 178.6126 743 A 4.1279 8.4302 121.2217 55.1452 18.3631 179.6104 744 L 3.8758 8.7572 118.2031 58.0722 41.4943 179.1472 745 D 4.2991 7.9173 117.6196 57.6017 40.8974 178.2474 746 E 4.3949 7.7363 115.1415 55.8566 29.6257 176.9669 747 G 3.8551 8.6226 107.8933 46.3133 0.0000 173.6850 748 D 4.5602 8.1173 119.3049 53.7621 41.6914 176.1874 749 K 4.4614 8.5119 121.7072 55.3478 34.3110 175.4198 750 I 5.0276 8.7342 125.2988 59.4285 40.1611 174.2198 751 A 4.9439 8.8964 128.5118 50.0721 21.7140 175.1676 752 I 5.0164 8.8285 123.3377 59.5068 40.4401 174.5817 753 F 5.2138 9.4818 125.9789 56.0437 41.5714 174.6819 754 T 5.4062 8.8451 116.9038 60.7652 70.9186 174.2508 755 Q 5.1000 9.4636 123.2318 56.2206 29.4890 176.1501 756 F 5.1092 7.7730 118.9581 55.6530 41.6263 176.3431 757 V 3.8711 8.4845 124.4303 65.7885 31.4840 177.8331 758 D 4.3670 8.1444 118.1779 57.3286 40.6091 178.2747 759 M 4.0634 8.0776 118.7027 58.3471 32.3982 178.0630 760 G 3.6494 8.4227 106.3069 47.9364 0.0000 175.7667 761 K 3.3561 7.7983 120.5973 58.8103 32.0356 179.5837 762 I 3.5110 7.4623 120.0460 64.3008 37.0450 178.3480 763 I 3.4520 7.6654 120.9292 64.3324 36.9910 178.3328 764 R 3.6412 7.5255 119.1060 59.4846 29.8846 178.1054 765 N 4.1924 8.2362 116.5000 56.3893 38.4648 177.4391 766 I 3.6091 8.0989 121.2296 64.5454 37.1948 178.6406 767 I 3.5314 7.5772 120.5343 64.2893 36.7931 178.4240 768 E 3.9828 7.9301 119.3929 59.1871 29.0227 179.3152 769 K 3.9428 7.7286 118.8381 59.3451 32.3658 178.4418 770 E 4.1853 8.2627 118.0812 57.9365 29.6207 177.3616 771 L 4.5025 7.8407 115.7593 53.3283 44.1088 175.6230 772 N 4.2128 8.1060 116.2546 54.3359 37.3879 172.9834 773 T 4.6661 7.0218 110.9355 59.9597 71.2809 172.4610 774 E 4.1898 8.7764 128.1965 56.2909 30.0982 176.7477 775 V 4.5159 8.6508 127.2413 59.6737 32.1321 172.5842 776 P 4.5094 0.0000 0.0000 62.5305 32.7470 175.0437 777 F 5.5972 8.8061 124.0054 56.5794 41.8061 173.4738 778 L 4.5262 9.0063 129.3290 53.4133 43.9906 174.6833 779 Y 5.0503 6.8440 122.4919 54.5643 41.3488 175.9867 780 G 3.9191 9.1764 109.8449 49.1582 0.0000 174.9954 781 E 4.1250 8.3294 117.1440 57.6999 29.7526 177.4794 782 L 3.9289 6.9073 119.1373 54.1383 42.2932 177.5551 783 S 4.4090 9.0750 116.6400 57.6879 65.3414 175.4717 784 K 3.7923 8.5151 122.5462 59.8214 31.8507 179.4053 785 K 3.9438 7.9632 119.1058 59.4578 32.1412 178.6056 786 E 3.9063 7.9218 118.4501 59.3926 29.3521 179.1742 787 R 3.7549 8.0824 118.2525 59.5166 30.2020 178.5414 788 D 4.4427 8.1835 118.2799 57.9300 40.9015 179.1247 789 D 4.4319 7.9816 119.0136 57.3518 40.7650 178.9383 790 I 3.7951 7.7419 120.3625 64.2304 37.1582 178.5044 791 I 3.7271 8.1405 121.1235 64.4165 36.9365 178.2833 792 S 4.1055 8.5681 114.2999 61.2733 62.1216 176.0106 793 K 3.8890 7.9975 122.1004 59.6592 31.7337 178.5230 794 F 4.1966 8.2023 119.4034 61.4893 39.4102 176.8503 795 Q 4.1068 8.5901 118.4475 57.6989 28.6059 177.4282 796 N 4.8724 8.4699 115.4161 51.9774 40.4327 174.1825 797 N 4.7272 7.8411 120.6141 51.1234 39.6109 173.9307 798 P 4.2867 0.0000 0.0000 65.5285 31.6814 177.8254 799 S 4.1298 8.5770 114.8469 60.2682 62.8835 174.1900 800 V 4.0922 7.4937 120.5544 62.0362 31.0833 175.2891 801 K 4.5199 8.7520 125.8633 56.3474 33.3586 175.8085 802 F 6.0035 8.2309 117.3189 56.0926 43.6137 173.7174 803 I 4.6053 8.1899 119.9884 59.9548 41.4542 173.1462 804 V 4.7044 8.6759 129.3190 61.0701 34.0598 174.1113 805 L 5.0280 8.7514 127.4120 52.9204 44.9013 175.2155 806 S 5.0465 9.4572 120.0057 57.0378 63.9586 172.8662 807 V 4.5232 8.5926 127.2325 60.3851 34.7870 174.8168 808 K 4.0968 8.8624 128.0194 56.2628 32.6501 175.7580 809 A 4.3572 8.4984 128.8065 54.1551 18.6160 177.7749 810 G 3.8771 9.0860 111.1093 45.1691 0.0000 174.1236 811 G 4.2399 8.0745 109.2254 45.0518 0.0000 173.8170 812 F 4.6935 9.1034 115.5020 56.0395 40.6661 177.2908 813 G 4.0567 8.4939 109.4556 45.1959 0.0000 172.4557 814 I 4.6223 8.3066 117.6113 59.3062 40.2655 174.6517 815 N 4.7046 8.7948 122.4989 52.9288 39.3185 174.9868 816 L 4.7517 8.3091 126.7359 52.5030 41.7235 176.9272 817 T 3.9760 8.3706 113.3977 64.0248 68.6511 176.0648 818 S 4.3030 8.2412 117.0054 59.3969 63.5019 173.7928 819 A 4.6182 8.2549 124.5145 52.3887 18.6974 176.8851 820 N 4.9371 9.1499 118.9613 53.3699 41.2733 174.7895 821 R 5.0968 7.8338 118.8088 54.4894 34.0885 173.7313 822 V 5.0159 9.1543 125.6285 61.2086 35.0647 173.8870 823 I 4.9466 9.0193 128.7528 60.0830 39.8451 174.4659 824 H 5.2980 9.5324 126.1075 54.4637 28.8141 175.6812 825 F 4.2838 9.5811 128.0555 60.8917 39.9318 174.3708 826 D 4.7998 8.2406 115.2123 52.0609 42.2528 175.8984 827 R 2.9370 7.9976 120.4861 54.9931 28.0815 175.2560 828 W 4.5131 7.6904 119.0040 56.8059 29.9950 176.7391 829 W 4.3048 6.1724 117.6323 55.1113 29.0545 175.8067 830 N 4.2845 8.3980 121.1257 52.9916 38.8841 174.2572 831 P 4.4412 0.0000 0.0000 65.3282 31.5894 177.3496 832 A 4.1341 8.0666 119.7406 53.5558 18.6031 177.6007 833 V 3.8151 7.6753 117.2728 62.1788 31.9595 175.5390 834 E 4.2550 8.2860 125.7841 55.6029 33.0459 174.5837 *849 N 4.6722 8.7132 122.3621 53.0777 41.0253 174.2295 850 V 4.0401 7.2740 118.6936 62.7038 32.9173 174.7784 851 I 4.6996 8.7524 129.3636 59.9465 39.0868 174.6969 852 V 4.7925 8.9685 127.2179 61.3701 34.1910 173.7489 853 H 5.4708 9.4238 125.1936 53.9619 31.9172 173.2319 854 K 4.9687 8.8374 122.1383 54.5460 34.5477 175.3414 855 L 4.6109 8.7806 126.3906 54.3910 42.5862 176.5889 856 I 4.5290 8.6252 124.7776 59.3816 40.6996 174.8990 857 S 4.8000 9.3408 124.4143 57.6892 63.7431 174.1699 858 V 3.4856 8.5611 125.7897 64.7429 31.6212 176.0970 859 G 3.8339 9.7582 115.0621 46.0669 0.0000 172.6412 860 T 4.8496 7.2373 110.6271 58.7875 71.4238 174.9143 861 L 4.3773 8.6923 122.7616 58.4260 40.0468 179.1951 862 E 3.9592 8.1533 119.1567 59.3606 29.4369 178.8877 863 E 4.0367 8.0621 119.0130 59.1581 29.7085 178.7899 864 K 4.0063 8.1234 117.9838 59.8451 32.2018 179.1393 865 I 3.9691 8.1594 120.1502 64.5207 36.7815 177.9955 866 D 4.3608 7.8892 117.6819 57.3501 41.1790 178.2421 867 Q 4.0270 8.1654 118.4734 58.9077 28.9015 178.2395 868 L 4.4712 8.4101 120.3780 58.3284 41.7715 179.6968 869 L 3.9064 8.1717 118.3596 57.8572 41.2784 179.5914 870 A 3.9402 7.4369 119.9371 54.7669 18.5724 178.8912 871 F 4.5537 8.0248 114.3604 58.8207 39.2831 177.3574 872 K 3.8093 7.9472 118.4815 60.0219 31.7698 177.6863 873 R 3.9852 7.8824 119.1736 59.2442 31.8303 177.7985 874 S 4.1276 8.3733 112.1749 59.3112 62.6757 175.5923 875 L 3.3647 9.4332 122.7473 58.8247 41.1925 179.3665 876 F 4.4265 8.1771 121.3435 59.2347 39.8808 177.6614 877 K 4.7568 9.2442 122.7717 59.7755 31.8298 177.3093 878 D 4.6159 7.9967 115.7684 55.0356 41.1026 176.8422 879 I 3.8997 7.9061 121.6349 60.5753 37.0255 176.7272 880 I 3.9592 7.6003 121.6864 61.3862 37.0634 175.9818 881 S 4.6750 7.8599 119.4682 58.6222 64.5141 176.3056 882 S 4.8365 7.9922 116.3602 57.3603 65.6365 177.2357 883 G 4.2348 8.0708 111.7138 47.5017 0.0000 174.2764 884 D 4.6073 8.2375 119.6285 53.5875 41.5160 178.6031 885 S 4.0070 8.5939 115.6100 61.1622 63.0102 175.8471 886 W 4.4792 8.4338 118.0731 60.2160 27.2970 178.0597 887 I 3.1922 6.0237 120.0416 64.0351 36.1618 178.3949 888 T 3.8703 7.6644 109.4723 64.0572 68.7932 175.8284 889 E 4.2609 7.7718 119.7143 56.4405 30.0553 176.8484 890 L 4.2591 6.8291 119.3992 54.0883 42.5530 177.6281 891 S 4.3919 10.1748 117.0375 58.5022 64.8663 175.2936 892 T 3.9066 8.4996 119.1188 67.1892 68.0321 176.0995 893 E 3.8617 8.1647 119.5096 59.4437 29.9070 178.3128 894 E 4.0971 8.4704 118.6783 59.6289 29.6838 178.9304 895 L 3.9867 8.4389 120.4753 58.5560 41.9983 179.1524 896 R 4.0535 8.2564 118.5707 59.2812 29.7099 178.6801 897 K 4.0296 7.9379 117.7358 59.1784 31.9751 179.3459 898 V 3.7869 7.8107 118.3585 65.8165 31.5179 177.5124 899 I 4.2285 7.5333 109.9304 60.8957 38.5230 175.7287 900 E 4.2209 7.7726 122.2658 55.6795 30.0578 176.1111 901 L 4.1368 8.7108 128.0141 55.2896 43.2513 177.0759 902 S 4.8104 8.4930 119.0850 57.5847 62.7869 174.2721 903 V 3.9416 7.3788 123.1303 63.7255 31.5900 174.6004 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 662 D 8.22 4.64 0.00 2.73 2.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 663 K 8.29 4.39 0.00 1.77 1.67 0.00 1.64 0.00 0.00 1.69 0.00 0.00 2.93 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.27 1.56 7.81 664 I 8.72 4.21 1.84 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.46 0.89 0.00 0.00 665 E 8.70 5.19 0.00 1.87 1.74 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 2.11 2.17 0.00 666 T 8.88 4.78 4.25 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 1.21 0.00 0.00 667 N 8.66 4.88 0.00 2.42 1.93 0.00 0.00 6.70 7.68 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 0.00 668 V 8.72 4.15 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.00 0.00 0.91 0.00 0.00 669 Y 8.44 4.80 0.00 2.95 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 0.00 670 C 9.45 4.96 0.00 2.75 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 0.00 671 N 8.67 4.93 0.00 2.65 2.72 0.00 0.00 7.17 6.74 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 0.00 672 L 8.33 4.41 0.00 1.59 1.58 0.74 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 673 T 8.10 4.32 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 674 P 0.00 4.23 0.00 2.18 2.17 0.00 3.60 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 2.12 2.16 0.00 675 E 8.09 3.92 0.00 2.04 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 2.39 2.41 0.00 676 Q 7.86 4.01 0.00 2.34 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.56 0.00 0.00 0.00 0.00 0.00 2.55 2.40 0.00 677 A 8.14 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 0.00 678 A 7.97 3.95 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 0.00 679 M 8.29 4.01 0.00 2.08 2.39 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.75 2.58 0.00 680 Y 8.91 3.95 0.00 3.09 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 0.00 681 K 8.76 4.14 0.00 2.01 1.91 0.00 1.79 0.00 0.00 1.69 0.00 0.00 2.99 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.57 1.71 7.81 682 A 8.69 4.85 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 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0.00 0.00 691 I 7.80 3.54 1.84 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.23 1.12 0.00 0.00 692 D 8.04 4.56 0.00 2.73 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 0.00 693 S 7.63 4.18 0.00 3.80 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 0.00 694 V 6.85 4.32 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.72 0.00 0.00 0.95 0.00 0.00 695 T 8.07 4.53 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 696 G 8.73 4.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 697 I 8.06 3.63 1.86 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.55 0.90 0.00 0.00 698 K 7.54 4.04 0.00 1.74 1.85 0.00 1.68 0.00 0.00 1.62 0.00 0.00 3.05 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.46 1.42 7.81 699 R 9.10 4.04 0.00 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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 0.00 708 L 7.97 4.00 0.00 1.87 1.87 1.13 0.32 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 0.00 709 K 7.98 4.24 0.00 1.76 1.75 0.00 1.78 0.00 0.00 1.68 0.00 0.00 2.89 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.38 1.40 7.81 710 L 8.05 3.81 0.00 1.71 1.49 0.69 -0.10 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 0.00 711 K 7.92 4.21 0.00 2.18 2.21 0.00 1.80 0.00 0.00 1.72 0.00 0.00 2.97 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.55 1.66 7.81 712 Q 7.89 3.97 0.00 2.07 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.80 0.00 0.00 0.00 0.00 0.00 1.16 1.96 0.00 713 I 7.94 3.78 2.06 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 1.30 0.86 1.08 0.00 0.00 714 V 7.89 3.86 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.00 0.00 1.23 0.00 0.00 715 D 7.55 4.80 0.00 3.18 3.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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0.00 0.00 790 I 7.74 3.80 1.95 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 1.52 0.71 0.89 0.00 0.00 791 I 8.14 3.73 2.01 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.64 0.96 0.00 0.00 792 S 8.57 4.11 0.00 3.85 4.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 793 K 8.00 3.89 0.00 2.02 2.07 0.00 1.72 0.00 0.00 1.60 0.00 0.00 2.94 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.52 1.50 7.81 794 F 8.20 4.20 0.00 3.01 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 0.00 795 Q 8.59 4.11 0.00 2.13 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.55 0.00 0.00 0.00 0.00 0.00 2.70 2.50 0.00 796 N 8.47 4.87 0.00 2.70 2.82 0.00 0.00 6.92 7.63 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 0.00 797 N 7.84 4.73 0.00 2.71 2.81 0.00 0.00 6.77 7.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 798 P 0.00 4.29 0.00 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0.00 2.01 0.00 0.00 0.00 0.00 0.00 0.00 862 E 8.15 3.96 0.00 2.11 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 2.37 2.40 0.00 863 E 8.06 4.04 0.00 2.09 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 0.00 2.40 2.52 0.00 864 K 8.12 4.01 0.00 2.13 1.95 0.00 1.69 0.00 0.00 1.88 0.00 0.00 3.08 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.87 1.68 7.81 865 I 8.16 3.97 2.01 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.73 1.03 0.00 0.00 866 D 7.89 4.36 0.00 2.90 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 0.00 867 Q 8.17 4.03 0.00 2.50 2.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.52 0.00 0.00 0.00 0.00 0.00 2.47 2.60 0.00 868 L 8.41 4.47 0.00 1.67 1.47 1.19 0.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 869 L 8.17 3.91 0.00 1.75 1.71 0.93 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 870 A 7.44 3.94 1.01 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 0.00 871 F 8.02 4.55 0.00 3.37 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 0.00 872 K 7.95 3.81 0.00 1.94 1.72 0.00 1.53 0.00 0.00 1.59 0.00 0.00 2.87 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.42 1.49 7.81 873 R 7.88 3.99 0.00 1.83 2.00 0.00 3.24 0.00 0.00 3.21 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.68 0.00 874 S 8.37 4.13 0.00 3.90 3.57 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 0.00 875 L 9.43 3.36 0.00 0.71 0.32 -0.08 0.69 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 0.00 876 F 8.18 4.43 0.00 3.05 2.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 877 K 9.24 4.76 0.00 1.74 1.89 0.00 1.64 0.00 0.00 1.54 0.00 0.00 3.20 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.60 1.77 7.81 878 D 8.00 4.62 0.00 2.71 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 0.00 879 I 7.91 3.90 1.57 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 0.46 -0.15 0.69 0.00 0.00 880 I 7.60 3.96 1.89 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 1.47 0.65 0.93 0.00 0.00 881 S 7.86 4.67 0.00 4.09 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 0.00 882 S 7.99 4.84 0.00 3.94 3.85 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 0.00 883 G 8.07 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 0.00 0.00 0.00 0.00 884 D 8.24 4.61 0.00 2.54 2.26 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 0.00 885 S 8.59 4.01 0.00 3.85 4.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 886 W 8.43 4.48 0.00 3.65 3.30 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 0.00 887 I 6.02 3.19 1.41 0.00 0.00 0.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 -0.36 0.51 0.00 0.00 888 T 7.66 3.87 4.17 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 1.14 0.00 0.00 889 E 7.77 4.26 0.00 2.25 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 2.35 2.36 0.00 890 L 6.83 4.26 0.00 1.62 1.64 0.95 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 891 S 10.17 4.39 0.00 4.08 4.12 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 0.00 892 T 8.50 3.91 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 1.37 0.00 0.00 893 E 8.16 3.86 0.00 1.95 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 2.36 0.00 894 E 8.47 4.10 0.00 2.37 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 2.36 2.35 0.00 895 L 8.44 3.99 0.00 1.82 2.07 0.90 0.80 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 0.00 896 R 8.26 4.05 0.00 1.56 1.85 0.00 2.68 0.00 0.00 2.90 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.72 0.00 897 K 7.94 4.03 0.00 1.92 1.89 0.00 1.78 0.00 0.00 1.61 0.00 0.00 2.95 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.70 1.60 7.81 898 V 7.81 3.79 2.25 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 1.11 0.00 0.00 1.00 0.00 0.00 899 I 7.53 4.23 1.91 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 1.80 0.98 0.91 0.00 0.00 900 E 7.77 4.22 0.00 2.03 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 0.00 2.35 2.30 0.00 901 L 8.71 4.14 0.00 1.59 1.56 0.26 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 902 S 8.49 4.81 0.00 3.96 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 0.00 903 V 7.38 3.94 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 0.79 0.00 0.00 0.87 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.