NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 755 R 4.3083 8.2544 120.8588 56.0630 31.3733 175.0534 756 M 3.5785 8.4241 124.4958 57.4611 32.2293 174.5474 757 Y 4.7360 6.7135 113.4530 56.1456 42.7549 174.1911 758 D 4.7783 9.0938 120.9909 54.5020 40.8057 177.3368 759 V 4.4701 7.5352 117.9771 59.1200 33.9796 174.8486 760 T 3.8142 8.4619 114.8272 60.2594 69.7475 172.8297 761 P 4.5220 0.0000 0.0000 60.6033 32.9016 173.3446 762 P 4.2615 0.0000 0.0000 64.4807 31.4879 177.2571 763 G 4.0357 9.8825 111.1080 44.0094 0.0000 172.6434 764 V 4.8286 7.3800 118.8474 61.0375 34.2323 174.9836 765 V 4.5807 8.8857 126.7304 61.4848 35.5510 173.1117 766 M 4.3379 8.4737 124.6433 54.3363 32.8596 175.5425 767 G 4.2139 8.8716 110.7058 44.6890 0.0000 172.0619 768 L 5.2020 8.0455 120.5116 52.7684 43.5765 176.0272 769 A 4.8520 9.1644 126.4601 50.0280 21.6761 175.9439 770 W 5.0675 10.5981 133.9272 56.8453 31.1126 175.8965 771 T 4.6773 9.1719 117.1431 59.5993 69.5751 176.2193 772 A 3.9842 8.5582 125.6178 54.7428 18.4706 178.4189 773 M 4.7365 8.8794 110.8854 53.7040 32.6731 174.1667 774 G 4.1441 6.5425 111.5980 45.2418 0.0000 175.4737 775 G 4.6234 8.4131 112.8423 44.3994 0.0000 171.2247 776 S 4.8295 8.9115 115.4251 56.8487 66.6827 172.8459 777 T 4.8694 8.5495 121.8000 62.3389 69.3876 173.9953 778 L 4.8932 8.6753 126.9445 52.9777 44.9288 175.8162 779 F 4.9643 8.9413 121.0782 56.1758 40.0010 175.8321 780 V 4.2512 8.7073 125.0604 62.7676 32.9321 174.7211 781 E 5.5418 9.1394 124.2930 54.6978 33.9396 174.2875 782 T 5.2868 8.3988 110.8728 60.8060 72.9313 172.1971 783 S 4.6863 9.0939 115.9706 56.9531 66.4192 173.3524 784 L 4.6145 8.6144 123.9529 54.7067 42.0707 177.2265 785 R 4.6791 8.5494 115.9798 55.5850 30.6592 175.3078 786 R 4.7040 7.5702 116.0362 54.6103 34.0121 173.3879 787 P 4.4159 0.0000 0.0000 65.0543 32.0148 175.9975 788 Q 4.3041 7.5041 116.2777 55.2710 31.3967 172.6105 *796 K 4.1178 8.4683 124.3092 57.0613 33.3417 175.0860 *797 D 4.9902 8.3883 119.1391 52.3281 43.2847 172.7021 798 G 4.6573 8.5547 109.0624 44.9439 0.0000 172.0871 799 S 4.9300 8.5677 112.8122 57.1030 66.8424 173.1362 800 L 4.9864 8.1259 121.9861 53.2954 44.6152 174.7619 801 E 4.5593 9.4742 127.7619 54.3931 31.8555 174.4325 802 V 4.8707 8.2916 126.4349 61.3549 33.9642 174.7078 803 T 4.5212 8.8709 117.7443 60.0120 71.7844 174.1584 804 G 3.6256 10.2976 108.4722 44.5261 0.0000 173.4498 805 Q 3.4717 7.9465 119.5683 56.9131 27.2561 173.3793 806 L 4.2788 7.8527 115.1318 54.0513 42.9884 178.3707 807 G 3.9697 8.1854 107.8433 43.7105 0.0000 173.9957 808 E 3.9597 8.7164 118.4687 59.6545 29.4116 179.9019 809 V 3.5747 7.6364 117.3854 66.4310 31.7478 177.9510 810 M 4.1640 7.9750 117.7948 57.9936 31.8818 178.6964 811 K 3.9447 8.3975 119.4275 59.3692 32.2084 178.9496 812 E 3.9394 8.0782 119.1388 59.0773 29.2483 178.3896 813 S 4.0337 7.9046 112.6292 61.6734 62.3048 175.9008 814 A 4.0358 8.1372 123.1313 55.4666 17.9483 179.7627 815 R 3.9773 7.7990 115.7280 59.5472 30.1515 179.2736 816 I 3.7350 8.3743 119.5978 64.4701 37.0717 178.3839 817 A 4.0582 8.2183 121.5509 55.2136 18.3053 179.0595 818 Y 4.2061 8.4526 118.3843 61.2674 38.9716 178.4830 819 T 3.7302 8.3927 117.0699 66.4438 68.4696 176.5508 820 F 4.1811 8.4762 122.4081 61.1686 39.4230 176.7041 821 A 3.7872 8.1751 120.5511 55.4081 18.0254 179.3587 822 R 3.7373 7.6227 115.6801 59.8661 29.9371 179.1679 823 A 3.9274 7.7642 119.7034 54.6914 18.1882 179.5898 824 F 3.4851 7.8417 119.7386 61.3439 39.4962 177.2310 825 L 3.8711 8.0688 120.0121 58.3769 41.6669 178.6170 826 M 4.0808 7.8191 117.9181 57.8018 31.8574 177.5428 827 Q 3.9834 6.9999 118.5864 58.3409 29.7830 176.7120 828 H 4.1858 7.7900 118.3923 57.8068 31.1398 175.3546 829 A 4.5084 8.2678 123.8362 49.3517 19.2358 174.2153 830 P 4.5684 0.0000 0.0000 64.4090 32.0152 178.2236 831 A 3.9442 7.8888 120.1726 54.4716 18.4808 176.6588 832 N 4.6047 8.1892 115.6286 53.0411 38.4403 174.6802 833 D 4.7282 8.5313 125.5968 53.7297 40.0245 177.1560 834 Y 3.9568 8.4954 123.0331 61.2035 38.5525 178.1196 835 L 4.1778 7.9871 118.3672 57.7739 41.9400 179.1233 836 V 3.6800 7.8309 117.2146 65.3999 31.7940 176.3063 837 T 4.3726 7.5990 108.1155 62.8791 71.1737 175.6418 838 S 4.4816 7.7603 117.2026 58.2419 64.8188 173.4930 839 H 5.1765 8.5901 120.0116 54.8281 30.0046 174.1581 840 I 5.1233 8.9088 124.4412 59.5787 41.3860 174.1111 841 H 5.2580 9.1569 123.5772 54.3634 32.9189 171.9349 842 L 5.2066 9.4102 128.5055 53.5292 44.8267 174.1357 843 H 5.3775 9.6673 126.2473 54.4343 32.4456 172.7667 844 V 4.3654 7.8628 125.8924 60.3301 32.2044 173.6509 845 P 4.3529 0.0000 0.0000 62.4587 31.9141 176.6229 846 E 4.2759 8.4877 120.3007 55.8332 30.4328 176.6337 847 G 4.1886 8.4549 117.8619 46.4516 0.0000 173.4104 848 A 4.5800 7.6768 122.9648 50.6866 19.4359 177.2003 849 T 3.9574 8.2452 112.1749 61.1377 69.0904 173.3694 850 P 4.3554 0.0000 0.0000 64.6228 31.2480 178.1447 851 K 4.2332 7.1965 116.6438 58.6624 33.5301 177.6811 852 D 4.7403 8.0211 117.4784 55.3440 41.3960 177.6670 853 G 3.8613 8.1675 105.5132 48.7004 0.0000 173.5313 854 P 4.4704 0.0000 0.0000 63.7317 31.3949 178.4365 855 S 4.4347 8.1704 112.3306 60.1378 62.9897 175.4529 856 A 4.2747 8.0206 124.1607 53.3331 18.1351 179.4169 857 G 3.5484 7.9344 105.2294 47.8156 0.0000 175.5350 858 C 4.1173 8.3345 118.0936 61.5041 29.3723 176.1891 859 T 3.8870 7.8732 117.5955 66.2163 68.0721 176.5286 860 I 3.7070 7.9245 121.6912 64.3214 37.1809 178.2665 861 V 3.5688 7.5871 118.8893 66.5722 31.1823 178.0557 862 T 4.1436 8.3094 116.0377 66.0537 68.3502 176.0404 863 A 4.0735 8.1412 122.6856 55.5996 18.3533 179.7685 864 L 4.0436 8.1389 117.0019 57.9796 41.7230 179.8622 865 L 4.0419 8.6574 119.3094 57.8196 41.5929 179.4908 866 S 4.0111 8.7368 113.6159 61.2136 62.2248 175.9396 867 L 3.8854 8.0143 122.8928 58.1486 41.6566 178.8648 868 A 2.7481 7.7787 119.2590 53.9821 18.3630 178.4115 869 M 4.2577 7.7874 115.0142 53.8909 32.9541 175.9853 870 G 3.9157 7.5328 107.2280 46.2789 0.0000 174.5704 871 R 4.5511 8.3829 117.3118 53.5219 33.9592 174.1700 872 P 4.6035 0.0000 0.0000 62.0002 32.5653 175.9649 873 V 3.6138 7.9164 119.2149 62.1086 32.4256 175.5405 874 R 3.9621 7.7820 125.0497 56.9312 30.2425 176.3388 875 Q 4.0695 8.6230 123.5630 56.5122 30.1285 176.1273 876 N 4.4707 8.7473 117.4847 53.9531 36.4218 172.9901 877 L 4.7035 7.1879 120.1152 54.2038 43.0855 175.7532 878 A 5.1502 8.8145 126.5426 49.6518 23.1375 174.3131 879 M 5.0732 8.0451 114.2580 55.4814 34.5244 173.3505 880 T 4.7677 8.4766 113.2225 60.1322 71.1596 171.9578 881 G 4.0414 8.6964 120.7386 44.4265 0.0000 172.3516 882 E 4.4717 7.9191 126.9446 56.0244 30.3695 175.6251 883 V 4.6836 7.9251 123.4011 60.7196 34.1958 175.6449 884 S 4.4034 8.5710 122.1302 57.6540 63.6977 175.1049 885 L 4.1911 8.2929 120.2409 57.0694 41.4540 178.2275 886 T 4.3551 7.8367 107.0205 61.6017 69.5426 175.4455 887 G 2.9665 7.6307 111.7142 44.2853 0.0000 173.1210 888 K 4.3141 7.8229 122.3401 56.6441 33.3052 175.6165 889 I 4.6455 8.5369 129.0874 60.3799 37.6200 175.2561 890 L 4.8353 8.4111 127.7716 52.0373 44.1328 174.5574 891 P 4.7434 0.0000 0.0000 63.3736 31.9157 175.6772 892 V 4.4642 8.8363 115.1721 59.2327 34.8790 175.2228 893 G 3.7468 8.5709 110.5626 45.5763 0.0000 173.5123 894 G 2.7802 6.9491 103.7106 47.1098 0.0000 176.1539 895 I 3.5805 7.5836 121.7214 64.5025 37.0658 177.1860 896 K 3.6146 7.9916 118.5218 60.3616 31.6855 177.7638 897 E 3.9043 7.7685 117.2240 59.6248 29.7278 179.6819 898 K 3.9386 8.6196 118.7627 59.6462 32.0099 179.4571 899 T 4.0332 7.7894 115.9789 66.0896 68.4944 177.1756 900 I 3.5896 7.8563 121.6511 64.3534 36.8590 178.3076 901 A 3.9478 8.1790 121.3800 54.9446 18.1167 179.0827 902 A 3.9423 8.0486 119.3127 55.5781 18.3711 179.7478 903 K 3.7851 8.1603 117.3517 59.6536 32.0916 178.7132 904 R 3.8755 8.3730 117.9700 58.9044 29.8465 177.1383 905 A 4.6946 7.3501 117.1485 50.9573 19.4636 176.5818 906 G 3.7438 8.1686 105.8910 46.8205 0.0000 174.3197 907 V 3.8593 7.8416 120.2014 62.5795 31.9651 175.5477 908 T 4.3763 8.4163 121.0228 62.6715 69.1221 173.2837 909 C 5.1304 7.9566 120.9631 58.4219 34.9495 172.5061 910 I 4.9139 8.7842 120.2526 58.9698 40.6527 174.5277 911 V 4.6149 8.1563 124.0268 61.2566 33.4835 174.4385 912 L 4.8319 8.3654 127.3181 51.9831 45.9244 174.5439 913 P 4.7749 0.0000 0.0000 62.1977 32.4112 177.8824 914 A 4.0641 8.6449 125.0655 55.4148 18.4381 179.1151 915 E 4.2865 8.1506 112.2761 57.3253 29.7590 177.2124 916 N 5.0998 8.2487 118.0163 51.9895 38.9258 176.1813 917 K 2.6010 7.5223 123.5034 59.4261 32.3321 178.8618 918 K 4.2600 7.8477 117.0600 58.6858 31.7726 178.9349 919 D 4.3721 7.9133 119.5562 57.0407 40.3405 178.2325 920 F 4.0688 8.2403 121.2817 61.5343 39.2407 176.9762 921 Y 4.3876 7.6180 115.1605 61.2200 37.7410 177.9868 922 D 4.4898 7.9191 118.3706 56.0361 41.1922 177.2870 923 L 4.0558 6.7130 118.0709 53.8087 42.3198 176.7570 924 A 4.0159 8.5043 123.6844 52.4832 19.0409 178.7851 925 A 3.9970 8.7508 124.4183 55.2019 18.7395 179.8705 926 F 4.3227 8.2075 116.9436 61.1841 39.8039 176.3822 927 I 3.1635 7.2933 121.0139 63.6731 37.1532 176.7302 928 T 4.1665 7.5859 113.1717 61.9979 67.9786 173.8464 929 E 4.6117 7.8669 119.6192 56.1783 31.3817 176.4626 930 G 3.9147 8.3067 108.5349 45.6336 0.0000 173.3721 931 L 4.5993 7.2539 118.7593 52.8478 43.4056 175.7912 932 E 4.1875 8.8454 126.1426 55.5815 30.5095 175.1038 933 V 4.4520 8.1026 126.9562 61.2511 33.9002 174.3344 934 H 4.6079 8.2566 123.4804 53.8818 32.0968 172.4290 935 F 5.0891 8.5662 122.2876 56.4525 39.9590 175.6637 936 V 5.3314 8.7784 116.9939 59.0120 34.8819 176.2384 937 E 4.5229 9.2766 121.4730 57.0564 32.0143 175.3470 938 H 5.2906 7.9431 117.4756 53.2684 33.3879 173.0101 939 Y 4.0566 8.7834 124.7726 60.8786 38.4506 178.5952 940 R 4.1573 8.6304 119.1528 59.5985 29.9873 178.1629 941 E 4.0049 8.1870 118.2063 59.2668 29.3425 179.4305 942 I 3.5115 7.1710 119.4299 64.0239 37.2701 177.6590 943 F 4.0423 7.3658 121.8100 61.8229 38.8831 177.1122 944 D 4.4851 8.2686 118.1160 57.2671 40.3461 178.9048 945 I 3.5842 7.2218 119.7257 64.1893 37.4335 178.0199 946 A 3.7269 7.8576 121.7068 53.6393 19.1934 177.3055 947 F 4.9895 7.5239 114.4523 55.1049 39.4141 173.8107 948 P 4.4383 0.0000 0.0000 65.0531 31.7401 177.9613 949 D 4.6000 7.9311 114.6017 55.1615 41.2404 176.4801 950 E 4.3064 7.9989 119.4308 55.6561 30.1613 176.5732 951 Q 4.1389 8.5475 121.6365 55.8873 29.7954 175.9448 952 A 4.2567 8.1518 125.8917 52.4218 19.3810 177.3637 953 E 4.3612 8.9235 119.0864 56.5628 30.2196 175.3593 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 755 R 8.25 4.31 0.00 1.86 1.95 0.00 3.68 0.00 0.00 3.89 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 1.85 0.00 756 M 8.42 3.58 0.00 0.51 1.51 0.00 0.00 0.00 0.00 0.00 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 1.74 0.00 757 Y 6.71 4.74 0.00 2.93 2.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 758 D 9.09 4.78 0.00 2.83 2.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 759 V 7.54 4.47 2.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.84 0.00 0.00 0.92 0.00 0.00 760 T 8.46 3.81 4.31 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 1.36 0.00 0.00 761 P 0.00 4.52 0.00 2.13 2.09 0.00 2.74 0.00 0.00 3.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.57 0.00 762 P 0.00 4.26 0.00 2.04 2.09 0.00 3.64 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.08 0.00 763 G 9.88 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 0.00 0.00 0.00 764 V 7.38 4.83 2.14 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 1.06 0.00 0.00 0.96 0.00 0.00 765 V 8.89 4.58 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 0.89 0.00 0.00 0.93 0.00 0.00 766 M 8.47 4.34 0.00 0.93 1.67 0.00 0.00 0.00 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.41 2.30 0.00 767 G 8.87 4.21 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 0.00 768 L 8.05 5.20 0.00 1.43 1.57 0.86 0.86 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 0.00 769 A 9.16 4.85 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 770 W 10.60 5.07 0.00 3.39 3.14 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 0.00 771 T 9.17 4.68 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 1.29 0.00 0.00 772 A 8.56 3.98 1.26 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 0.00 0.00 773 M 8.88 4.74 0.00 2.22 2.15 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 2.52 2.47 0.00 774 G 6.54 4.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 775 G 8.41 4.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 776 S 8.91 4.83 0.00 3.92 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 0.00 777 T 8.55 4.87 4.27 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 1.05 0.00 0.00 778 L 8.68 4.89 0.00 1.62 1.58 0.98 0.95 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 0.00 779 F 8.94 4.96 0.00 2.96 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 0.00 780 V 8.71 4.25 2.23 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 1.06 0.00 0.00 0.94 0.00 0.00 781 E 9.14 5.54 0.00 2.00 1.86 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 2.41 2.28 0.00 782 T 8.40 5.29 4.33 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 1.29 0.00 0.00 783 S 9.09 4.69 0.00 3.90 3.71 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 0.00 784 L 8.61 4.61 0.00 1.65 1.63 0.95 0.95 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 0.00 785 R 8.55 4.68 0.00 1.92 1.99 0.00 3.15 0.00 0.00 3.25 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.58 0.00 786 R 7.57 4.70 0.00 1.78 1.82 0.00 3.16 0.00 0.00 3.23 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.55 0.00 787 P 0.00 4.42 0.00 2.18 2.18 0.00 3.80 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 1.99 1.95 0.00 788 Q 7.50 4.30 0.00 1.95 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.61 0.00 0.00 0.00 0.00 0.00 2.18 2.36 0.00 *796 K 8.47 4.12 0.00 1.76 1.77 0.00 1.60 0.00 0.00 1.73 0.00 0.00 2.92 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.32 1.49 7.81 *797 D 8.39 4.99 0.00 2.41 2.37 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 0.00 798 G 8.55 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 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 0.44 0.00 0.00 0.70 0.00 0.00 874 R 7.78 3.96 0.00 1.81 1.63 0.00 3.22 0.00 0.00 3.09 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.55 0.00 875 Q 8.62 4.07 0.00 2.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.03 0.00 0.00 0.00 0.00 0.00 2.42 2.32 0.00 876 N 8.75 4.47 0.00 2.88 2.95 0.00 0.00 6.61 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 0.00 877 L 7.19 4.70 0.00 1.34 1.50 0.81 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 0.00 0.00 0.00 0.00 878 A 8.81 5.15 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 879 M 8.05 5.07 0.00 1.95 2.04 0.00 0.00 0.00 0.00 0.00 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.30 0.00 880 T 8.48 4.77 4.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 881 G 8.70 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 0.00 0.00 0.00 882 E 7.92 4.47 0.00 2.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.24 0.00 883 V 7.93 4.68 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 0.41 0.00 0.00 0.90 0.00 0.00 884 S 8.57 4.40 0.00 3.99 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 885 L 8.29 4.19 0.00 1.69 1.84 0.95 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 886 T 7.84 4.36 4.33 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 1.26 0.00 0.00 887 G 7.63 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 0.00 0.00 0.00 888 K 7.82 4.31 0.00 1.86 1.65 0.00 1.63 0.00 0.00 1.64 0.00 0.00 2.89 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.42 1.44 7.81 889 I 8.54 4.65 1.87 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 1.15 0.96 0.91 0.00 0.00 890 L 8.41 4.84 0.00 1.65 1.56 0.96 0.86 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 0.00 891 P 0.00 4.74 0.00 2.08 2.06 0.00 3.71 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.01 0.00 892 V 8.84 4.46 2.14 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 0.79 0.00 0.00 0.96 0.00 0.00 893 G 8.57 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 894 G 6.95 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 0.00 0.00 0.00 895 I 7.58 3.58 1.79 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 1.42 0.79 0.99 0.00 0.00 896 K 7.99 3.61 0.00 1.71 1.63 0.00 1.69 0.00 0.00 1.78 0.00 0.00 2.94 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.46 1.52 7.81 897 E 7.77 3.90 0.00 1.96 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 2.49 2.47 0.00 898 K 8.62 3.94 0.00 1.74 1.82 0.00 1.60 0.00 0.00 1.72 0.00 0.00 3.29 0.00 0.00 3.21 0.00 0.00 0.00 0.00 1.47 1.53 7.81 899 T 7.79 4.03 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 1.27 0.00 0.00 900 I 7.86 3.59 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 1.36 0.89 0.89 0.00 0.00 901 A 8.18 3.95 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 0.00 902 A 8.05 3.94 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 0.00 903 K 8.16 3.79 0.00 1.89 1.82 0.00 1.60 0.00 0.00 1.38 0.00 0.00 2.83 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.35 1.39 7.81 904 R 8.37 3.88 0.00 1.92 2.19 0.00 3.31 0.00 0.00 3.25 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.70 0.00 905 A 7.35 4.69 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 0.00 906 G 8.17 3.74 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 0.00 0.00 0.00 907 V 7.84 3.86 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 0.75 0.00 0.00 0.90 0.00 0.00 908 T 8.42 4.38 4.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 909 C 7.96 5.13 0.00 2.98 2.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 910 I 8.78 4.91 1.73 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 0.93 0.43 0.83 0.00 0.00 911 V 8.16 4.61 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 0.83 0.00 0.00 0.77 0.00 0.00 912 L 8.37 4.83 0.00 1.19 1.49 0.78 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 913 P 0.00 4.77 0.00 2.33 2.04 0.00 3.74 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 2.07 0.00 914 A 8.64 4.06 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 0.00 915 E 8.15 4.29 0.00 1.97 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 2.30 2.32 0.00 916 N 8.25 5.10 0.00 2.98 2.84 0.00 0.00 6.76 7.36 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 0.00 917 K 7.52 2.60 0.00 1.74 1.54 0.00 1.43 0.00 0.00 1.55 0.00 0.00 2.81 0.00 0.00 2.86 0.00 0.00 0.00 0.00 0.50 0.21 7.81 918 K 7.85 4.26 0.00 1.84 1.86 0.00 1.74 0.00 0.00 1.83 0.00 0.00 2.96 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.64 1.56 7.81 919 D 7.91 4.37 0.00 2.82 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 0.00 920 F 8.24 4.07 0.00 3.14 3.01 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 0.00 921 Y 7.62 4.39 0.00 3.05 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 0.00 922 D 7.92 4.49 0.00 2.79 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 0.00 923 L 6.71 4.06 0.00 1.36 1.44 0.67 0.70 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 0.00 924 A 8.50 4.02 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 0.00 925 A 8.75 4.00 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 0.00 926 F 8.21 4.32 0.00 2.96 3.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 927 I 7.29 3.16 1.80 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 0.95 0.50 0.73 0.00 0.00 928 T 7.59 4.17 4.18 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 1.15 0.00 0.00 929 E 7.87 4.61 0.00 2.10 1.86 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 2.26 2.25 0.00 930 G 8.31 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 931 L 7.25 4.60 0.00 1.85 1.62 0.95 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 932 E 8.85 4.19 0.00 2.02 1.86 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 2.13 2.18 0.00 933 V 8.10 4.45 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.71 0.00 0.00 0.48 0.00 0.00 934 H 8.26 4.61 0.00 2.95 3.02 0.00 5.85 0.00 0.00 0.00 0.00 6.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 935 F 8.57 5.09 0.00 2.93 2.96 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 0.00 936 V 8.78 5.33 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 0.86 0.00 0.00 0.97 0.00 0.00 937 E 9.28 4.52 0.00 1.95 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 0.00 2.34 2.31 0.00 938 H 7.94 5.29 0.00 3.14 3.12 0.00 5.68 0.00 0.00 0.00 0.00 6.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 939 Y 8.78 4.06 0.00 2.96 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 0.00 940 R 8.63 4.16 0.00 2.31 2.09 0.00 3.70 0.00 0.00 3.47 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.94 0.00 941 E 8.19 4.00 0.00 2.15 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.39 0.00 942 I 7.17 3.51 1.30 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 1.37 0.40 0.75 0.00 0.00 943 F 7.37 4.04 0.00 2.67 3.16 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 0.00 0.00 0.00 0.00 944 D 8.27 4.49 0.00 2.79 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 0.00 945 I 7.22 3.58 1.63 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 1.12 0.36 0.65 0.00 0.00 946 A 7.86 3.73 0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 947 F 7.52 4.99 0.00 2.38 2.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 948 P 0.00 4.44 0.00 2.02 2.10 0.00 3.68 0.00 0.00 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 2.01 0.00 949 D 7.93 4.60 0.00 2.69 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 0.00 950 E 8.00 4.31 0.00 2.21 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.17 0.00 951 Q 8.55 4.14 0.00 2.07 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 7.05 0.00 0.00 0.00 0.00 0.00 2.36 2.38 0.00 952 A 8.15 4.26 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 0.00 953 E 8.92 4.36 0.00 2.00 2.22 0.00 0.00 0.00 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 * Residues marked with a * may have inaccurate shift predictions.