NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 756 M 4.3723 8.3049 120.3859 55.0191 34.1080 174.7921 757 Y 4.4070 7.0890 113.6346 56.3633 42.0794 172.5716 758 D 4.6676 8.6997 121.0964 55.0505 43.5477 176.6004 759 V 4.3415 7.4875 118.1551 59.4379 33.0705 175.1320 760 T 3.6924 8.4104 116.1723 60.4732 69.1403 172.7814 761 P 4.5642 0.0000 0.0000 60.9868 32.7055 173.5235 762 P 4.2795 0.0000 0.0000 63.9328 31.7518 176.8581 763 G 3.9742 9.0648 108.9626 46.3417 0.0000 172.5931 764 V 4.8205 7.3661 117.5471 60.6662 33.8862 175.1024 765 V 4.4741 8.7159 127.1870 61.0826 35.2189 173.9505 766 M 3.8449 8.8796 127.7311 55.4323 33.3083 175.4287 767 G 4.5084 8.7841 114.0573 44.1810 0.0000 171.2857 768 L 5.2837 8.2958 118.2211 52.6838 45.0107 176.3775 769 A 4.9566 8.9990 123.8356 49.8884 23.0971 175.0201 770 W 5.2045 9.6960 131.3402 56.2869 32.1206 175.8949 771 T 4.7383 9.2430 117.9429 58.9411 70.4059 174.8858 772 A 4.0035 8.3556 123.5956 55.0025 18.5935 178.5868 773 M 4.3331 7.9386 114.2744 57.2100 33.7049 176.3206 774 G 4.0896 7.5466 107.4971 45.8882 0.0000 171.8084 775 G 4.3943 8.8586 109.4906 45.4924 0.0000 173.3070 776 S 4.9509 8.9845 118.1266 56.7033 67.9832 172.8227 777 T 4.7727 8.4941 115.6718 60.3998 68.7726 172.8570 778 L 4.6929 8.1383 129.4994 53.8323 43.1440 175.6811 779 F 4.8988 8.8189 122.4510 56.4684 39.6554 175.4859 780 V 4.0403 8.5900 125.8146 62.7613 32.6230 174.6512 781 E 5.4257 9.3749 127.6676 54.7179 32.7752 175.0045 782 T 5.3406 9.1627 113.6117 60.0619 71.8239 173.0513 783 S 4.7394 9.0946 118.8123 57.0224 67.1535 172.8668 784 L 4.6339 8.5206 120.1274 53.6760 42.9591 176.7912 *798 G 3.6889 8.4256 109.6638 45.9141 0.0000 172.0066 799 S 4.9014 8.3404 114.8634 56.3064 67.2460 172.3354 800 L 4.9600 8.3133 121.2655 53.1108 44.6082 174.9436 801 E 4.8481 8.8785 126.3831 54.2301 32.9469 174.6055 802 V 5.2982 8.4480 125.4571 60.1774 34.1002 174.7442 803 T 4.6811 9.0731 114.7767 60.8752 72.2316 175.2678 804 G 3.9336 9.4104 109.6216 45.6152 0.0000 173.1799 805 Q 3.2745 7.7963 116.3498 57.0612 27.3329 172.7241 806 L 4.3363 7.4901 116.3273 54.6891 44.3176 176.7883 807 G 4.0247 8.1551 108.3006 44.5509 0.0000 174.4037 808 E 3.9081 8.6724 117.9800 59.1757 29.1375 179.9615 809 V 3.5779 7.7520 118.0615 66.3279 31.6227 177.7598 810 M 4.0819 8.3386 118.6049 58.3305 31.7770 178.7849 811 K 3.9669 7.9824 118.1270 59.7077 32.1644 179.0527 812 E 4.0369 8.5283 118.9403 59.1660 29.5337 179.2101 813 S 4.0694 7.9363 112.6830 61.3139 62.3524 176.1025 814 A 4.0456 8.5270 123.8766 55.3469 18.0501 179.8872 815 R 3.6612 8.2174 116.5414 59.2246 30.0321 179.3695 816 I 3.7801 8.2336 120.0771 64.0631 37.0894 178.1957 817 A 4.0315 8.4106 122.0601 55.3345 18.2138 178.7055 818 Y 4.3610 8.9260 119.2707 61.7025 38.9174 178.8811 819 T 3.7554 8.3302 116.5792 66.3077 68.5730 176.7314 820 F 4.1986 8.5888 122.7508 61.1342 39.4880 177.0553 821 A 3.6346 8.4781 120.7753 54.9762 18.2018 179.6046 822 R 3.7210 7.9361 116.4258 59.6044 30.1654 179.2700 823 A 3.9282 7.6832 119.9111 54.9531 18.2569 179.4503 824 F 3.5889 7.7943 119.3123 60.9347 39.2473 177.1238 825 L 4.0125 7.6952 119.8810 57.8968 41.9610 178.4274 826 M 3.9292 7.9110 118.7689 58.7079 31.7330 178.6112 827 Q 3.8360 7.7328 117.9899 58.9666 29.2458 177.3086 828 H 4.1475 7.9171 118.6409 57.7269 31.2981 175.7682 829 A 4.5424 7.8300 125.2530 48.7068 18.7142 174.1274 830 P 4.0451 0.0000 0.0000 64.2570 32.0096 177.9604 831 A 4.0413 8.0182 120.0844 54.5623 18.4609 177.0892 832 N 4.7304 8.8433 115.7969 52.6896 39.8687 174.3456 833 D 4.8224 8.5301 123.2843 53.1837 41.0759 177.2588 834 Y 4.0194 9.6101 123.6006 61.1261 39.0085 178.1426 835 L 4.1180 8.3629 117.5543 58.0316 41.7413 179.1569 836 V 3.6795 7.8177 115.6381 65.0970 31.8238 176.2978 837 T 4.3782 7.7562 115.0573 64.9418 70.6291 174.7517 838 S 4.1238 8.3217 116.8100 58.8246 64.3508 173.8623 839 H 5.1251 8.5611 119.7398 54.7962 27.8870 174.7914 840 I 4.3845 8.4802 124.0198 60.7158 39.3873 173.9271 841 H 5.2620 9.7936 125.5365 54.3414 32.5542 172.1439 842 L 5.0173 9.4052 128.9255 53.4449 44.5021 174.1880 843 H 5.3632 9.3833 126.3733 54.3662 32.2020 172.2913 844 V 4.5091 8.1206 126.0299 60.2205 33.5159 173.3654 845 P 4.3447 0.0000 0.0000 62.3902 31.9284 176.2671 846 E 4.1893 8.5970 121.5456 55.6989 30.3402 177.2167 847 G 4.5564 8.8040 120.5619 46.7055 0.0000 173.1144 848 A 4.2564 7.5719 123.0179 52.0258 19.1407 177.2890 849 T 3.9830 8.2416 112.6606 60.7412 69.7749 173.7714 850 P 4.1831 0.0000 0.0000 66.3071 31.0397 178.8019 851 K 3.9662 7.9627 116.7442 58.5211 31.9467 177.6284 852 D 4.8289 7.8850 116.1686 54.6988 41.1913 178.1216 853 G 3.6436 8.1027 106.5021 48.2703 0.0000 173.9887 854 P 4.8186 0.0000 0.0000 63.7734 31.3888 178.3179 855 S 4.4814 7.9333 112.7878 60.3240 62.9478 175.7017 856 A 4.0813 7.9647 124.9319 53.7322 18.1349 179.2013 857 G 3.8474 8.4445 105.9135 48.2986 0.0000 175.6309 858 C 4.4544 8.6023 117.0286 60.9092 29.8530 176.0570 859 T 4.0112 7.8372 118.3324 66.4900 67.6096 176.6613 860 I 3.8100 8.2380 122.5784 64.1781 37.2004 178.8829 861 V 3.6498 7.7702 119.7101 65.1315 31.2086 178.5713 862 T 4.4378 8.2413 117.2371 65.8312 68.3143 176.4351 863 A 4.0509 8.0428 122.2925 55.0793 18.3460 179.7125 864 L 4.0205 7.6947 116.6841 57.9586 41.6725 179.8430 865 L 3.9645 7.9219 118.6585 57.8101 41.6866 179.1588 866 S 4.3704 8.7254 114.8331 60.7025 62.1421 175.9595 867 L 3.7841 8.4533 122.8426 58.1521 41.6836 178.4468 868 A 3.1473 7.8260 119.7986 55.1672 18.3482 178.6362 869 M 4.2952 7.8918 113.4969 54.0725 32.3518 176.4267 870 G 3.8829 8.2834 107.5138 46.2116 0.0000 173.4771 871 R 4.5054 7.8268 119.5694 53.0989 31.7407 173.4371 872 P 4.5057 0.0000 0.0000 62.6787 32.0020 176.6754 873 V 3.6687 7.9290 113.9778 60.6115 32.5610 176.0609 874 R 3.8586 7.4649 122.5649 56.9150 30.2554 176.3115 875 Q 3.9850 8.5595 126.7830 56.6130 30.2674 174.6404 876 N 4.2660 8.8645 120.2376 54.5042 37.3067 172.5922 877 L 5.0638 7.9399 116.4826 52.6109 44.7561 175.1318 878 A 5.3040 8.6267 125.9009 49.3657 22.6646 174.6782 879 M 5.2557 8.2679 116.2160 54.3903 35.1299 173.5110 880 T 4.6124 8.6533 113.0657 59.9897 71.2393 172.4497 881 G 4.2526 8.6816 121.7785 44.4984 0.0000 171.8779 882 E 4.5067 8.1098 125.8382 55.8122 30.3147 175.7932 883 V 4.7464 8.1583 125.2961 59.7162 33.6533 175.4564 884 S 4.5289 8.0049 117.7042 56.8213 64.4700 173.8200 885 L 4.1089 8.6893 124.3143 58.6742 41.5997 178.5664 886 T 4.2130 7.6942 105.5271 61.8839 69.5347 174.8326 887 G 2.9871 7.7828 109.0953 44.1497 0.0000 173.4834 888 K 4.1654 8.0064 121.6327 57.3270 33.2342 175.0753 889 I 4.7138 8.3115 127.6714 60.1379 37.8287 175.1152 890 L 4.8638 9.2627 128.7413 52.1513 44.0224 174.6759 891 P 4.6364 0.0000 0.0000 63.1309 32.3702 175.4046 892 V 4.5146 8.8127 113.9006 59.8710 35.4668 174.3748 893 G 3.9537 8.4227 109.6492 44.7449 0.0000 172.8042 894 G 2.8759 7.3558 104.1174 47.3098 0.0000 176.5282 895 I 3.5764 7.4553 122.0055 63.7797 37.1596 177.7108 896 K 3.8243 7.6355 119.9064 59.5565 31.9685 178.6366 897 E 3.9091 7.7577 118.3630 59.3950 29.4723 179.3691 898 K 4.0128 8.2292 118.7297 59.4403 32.2212 179.5276 899 T 4.0717 7.8500 116.1264 66.1530 68.3772 177.1874 900 I 3.7081 8.0713 122.0929 64.1709 37.1359 178.2305 901 A 3.9463 8.1294 121.3705 55.2340 18.2058 179.3510 902 A 3.9267 8.0215 119.2390 55.2128 18.2930 179.8974 903 K 3.8727 7.9806 117.5919 59.9037 32.1789 179.3721 904 R 3.9871 8.0033 116.7887 59.0706 30.0846 178.2472 905 A 4.3075 8.0826 117.9285 51.8813 18.6112 177.2651 906 G 3.8031 8.4680 105.6267 46.4222 0.0000 174.6707 907 V 4.7934 8.1805 118.0959 62.2552 32.4058 175.5217 908 T 4.6639 8.4751 117.9858 62.6803 71.2232 172.7295 909 C 5.2557 7.8800 121.2361 57.3339 34.5847 172.4370 910 I 4.7532 8.7398 125.6647 59.1184 41.5473 173.7660 911 V 4.6578 8.4379 128.2561 61.0849 34.1203 174.2463 912 L 5.0340 8.6002 126.5725 52.2944 46.5909 174.3340 913 P 4.9130 0.0000 0.0000 62.3166 32.1910 177.6418 914 A 4.1220 8.7735 125.2514 55.0666 18.4205 178.6861 915 E 4.3605 8.1303 112.7353 57.0303 29.8971 176.1300 916 N 5.1286 7.8765 116.2175 52.7552 39.0171 177.4604 917 K 3.5624 8.0304 120.3060 59.3045 32.2119 178.8773 918 K 3.9165 8.1195 118.6254 60.6675 32.1333 178.4129 919 D 4.9064 7.6716 120.8032 56.2737 40.6506 178.5938 920 F 4.0576 8.1131 121.2059 61.5385 39.3748 176.6595 921 Y 4.4576 7.6837 113.3244 59.8194 38.2070 177.1396 922 D 4.5492 8.2806 120.1767 55.0628 41.0386 176.3922 923 L 4.3254 6.9050 119.1536 53.5265 42.4855 177.0477 924 A 4.0485 8.4704 121.8354 52.7917 20.0479 178.9349 925 A 3.9423 8.5754 123.6155 55.0688 18.3549 179.8699 926 F 3.8451 8.3650 118.0093 61.8668 39.2818 177.1492 927 I 3.9465 7.7723 117.9421 64.1371 37.4206 177.5499 928 T 4.2152 7.4591 110.0388 62.5052 69.4242 175.1216 929 E 4.3642 7.8441 121.4760 57.3062 30.0129 176.3425 930 G 3.9949 9.0450 110.9883 44.9832 0.0000 173.1489 931 L 4.3903 7.5626 121.9434 53.6615 43.2343 176.0018 932 E 4.1437 9.2041 128.8272 55.8043 30.2295 175.0019 933 V 4.3750 7.9762 127.0636 61.0863 33.7677 174.2717 934 H 4.7121 8.4235 124.3434 53.7982 32.0045 172.6735 935 F 5.2112 8.6721 121.1943 56.0183 40.6894 175.3277 936 V 4.5262 8.8526 117.2587 59.8155 34.7447 176.2212 937 E 4.5455 8.9763 120.1106 57.2237 32.8089 175.8328 938 H 5.2360 8.2405 116.4296 53.2649 33.4931 173.0033 939 Y 4.0352 8.4456 126.2631 61.0126 38.6152 178.8183 940 R 4.3657 8.8225 116.3561 59.9164 28.6631 178.3554 941 E 3.9881 8.1765 118.6598 59.0880 29.5440 179.2298 942 I 3.4655 7.5992 113.1765 63.9141 37.1745 177.8320 943 F 3.9303 7.3822 120.8034 60.9869 39.4824 176.1829 944 D 4.7019 8.1956 117.8872 57.7758 40.4999 178.7382 945 I 3.5426 7.0621 117.7718 64.6132 36.9528 178.0277 946 A 3.9504 7.6113 120.2970 53.0667 18.8583 176.9023 947 F 4.8918 7.3471 115.2865 55.1174 40.5468 172.8937 948 P 4.4563 0.0000 0.0000 62.5822 31.0786 176.5518 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 756 M 8.30 4.37 0.00 2.15 2.21 0.00 0.00 0.00 0.00 0.00 0.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 2.02 0.00 757 Y 7.09 4.41 0.00 2.13 2.49 0.00 0.00 0.00 0.00 0.00 0.00 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 8.70 4.67 0.00 2.62 2.66 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 0.00 759 V 7.49 4.34 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.86 0.00 0.00 0.93 0.00 0.00 760 T 8.41 3.69 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 1.12 0.00 0.00 761 P 0.00 4.56 0.00 2.23 2.27 0.00 3.12 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 1.92 2.06 0.00 762 P 0.00 4.28 0.00 2.05 2.01 0.00 3.76 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.08 0.00 763 G 9.06 3.97 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 0.00 764 V 7.37 4.82 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 0.08 0.00 0.00 0.67 0.00 0.00 765 V 8.72 4.47 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 0.85 0.00 0.00 0.95 0.00 0.00 766 M 8.88 3.84 0.00 2.21 1.94 0.00 0.00 0.00 0.00 0.00 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 2.15 0.00 767 G 8.78 4.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.30 5.28 0.00 1.46 1.51 0.88 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 769 A 9.00 4.96 1.22 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 0.00 0.00 0.00 770 W 9.70 5.20 0.00 3.32 3.20 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 0.00 0.00 0.00 0.00 771 T 9.24 4.74 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 1.25 0.00 0.00 772 A 8.36 4.00 1.24 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 0.00 0.00 0.00 773 M 7.94 4.33 0.00 2.03 2.14 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 2.56 2.47 0.00 774 G 7.55 4.09 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 0.00 0.00 0.00 775 G 8.86 4.39 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 0.00 776 S 8.98 4.95 0.00 3.77 3.73 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 0.00 777 T 8.49 4.77 4.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 778 L 8.14 4.69 0.00 1.79 1.72 0.89 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 779 F 8.82 4.90 0.00 3.19 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 0.00 780 V 8.59 4.04 2.11 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 0.95 0.00 0.00 0.93 0.00 0.00 781 E 9.37 5.43 0.00 2.05 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.57 0.00 782 T 9.16 5.34 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 1.23 0.00 0.00 783 S 9.09 4.74 0.00 3.94 4.03 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 0.00 0.00 0.00 784 L 8.52 4.63 0.00 1.60 1.64 1.14 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 *798 G 8.43 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 799 S 8.34 4.90 0.00 3.88 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 0.00 800 L 8.31 4.96 0.00 0.27 1.02 0.55 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.49 0.00 0.00 0.00 0.00 0.00 0.00 801 E 8.88 4.85 0.00 2.06 1.75 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 2.21 2.22 0.00 802 V 8.45 5.30 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 0.77 0.00 0.00 0.91 0.00 0.00 803 T 9.07 4.68 4.35 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 1.30 0.00 0.00 804 G 9.41 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 0.00 0.00 0.00 805 Q 7.80 3.27 0.00 2.28 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.10 6.87 0.00 0.00 0.00 0.00 0.00 2.35 2.36 0.00 806 L 7.49 4.34 0.00 1.65 1.68 0.91 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 807 G 8.16 4.02 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 0.00 0.00 0.00 0.00 0.00 0.00 808 E 8.67 3.91 0.00 1.99 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 2.41 2.33 0.00 809 V 7.75 3.58 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 1.08 0.00 0.00 0.93 0.00 0.00 810 M 8.34 4.08 0.00 2.05 2.20 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 2.61 2.72 0.00 811 K 7.98 3.97 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 1.22 0.00 0.00 820 F 8.59 4.20 0.00 3.04 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 0.00 821 A 8.48 3.63 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 0.00 822 R 7.94 3.72 0.00 1.81 1.84 0.00 2.81 0.00 0.00 2.95 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 1.32 0.00 823 A 7.68 3.93 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 0.00 824 F 7.79 3.59 0.00 2.13 2.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 825 L 7.70 4.01 0.00 1.98 1.78 0.94 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 826 M 7.91 3.93 0.00 2.04 2.17 0.00 0.00 0.00 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.77 2.50 0.00 827 Q 7.73 3.84 0.00 1.96 1.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.97 0.00 0.00 0.00 0.00 0.00 2.24 2.35 0.00 828 H 7.92 4.15 0.00 2.35 3.05 0.00 5.75 0.00 0.00 0.00 0.00 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 829 A 7.83 4.54 1.23 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 0.00 830 P 0.00 4.05 0.00 2.00 2.10 0.00 3.66 0.00 0.00 5.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 2.09 0.00 831 A 8.02 4.04 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 0.00 832 N 8.84 4.73 0.00 2.61 2.74 0.00 0.00 7.11 8.35 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 0.00 833 D 8.53 4.82 0.00 2.92 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 0.00 834 Y 9.61 4.02 0.00 3.11 2.98 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 0.00 835 L 8.36 4.12 0.00 1.72 1.73 1.18 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 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 2.10 0.00 0.00 0.00 0.00 0.00 0.00 886 T 7.69 4.21 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 1.26 0.00 0.00 887 G 7.78 2.99 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 0.00 0.00 0.00 0.00 0.00 0.00 888 K 8.01 4.17 0.00 1.87 1.67 0.00 1.73 0.00 0.00 1.83 0.00 0.00 3.08 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.51 1.55 7.81 889 I 8.31 4.71 1.87 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 1.18 0.98 0.92 0.00 0.00 890 L 9.26 4.86 0.00 1.68 1.56 0.91 0.84 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 0.00 891 P 0.00 4.64 0.00 2.09 2.07 0.00 3.72 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 2.19 0.00 892 V 8.81 4.51 2.13 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 0.73 0.00 0.00 0.93 0.00 0.00 893 G 8.42 3.95 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 0.00 0.00 0.00 0.00 0.00 0.00 894 G 7.36 2.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 895 I 7.46 3.58 1.78 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 1.43 1.06 0.97 0.00 0.00 896 K 7.64 3.82 0.00 1.70 1.64 0.00 1.66 0.00 0.00 1.76 0.00 0.00 2.92 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.43 1.45 7.81 897 E 7.76 3.91 0.00 1.82 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 2.52 2.46 0.00 898 K 8.23 4.01 0.00 1.93 1.82 0.00 1.74 0.00 0.00 1.62 0.00 0.00 3.11 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.45 1.51 7.81 899 T 7.85 4.07 4.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 900 I 8.07 3.71 2.06 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 1.46 0.70 0.92 0.00 0.00 901 A 8.13 3.95 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 0.00 902 A 8.02 3.93 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 0.00 903 K 7.98 3.87 0.00 1.88 1.92 0.00 1.77 0.00 0.00 1.68 0.00 0.00 2.75 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.44 1.45 7.81 904 R 8.00 3.99 0.00 1.84 2.01 0.00 3.23 0.00 0.00 3.25 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.86 0.00 905 A 8.08 4.31 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 0.00 906 G 8.47 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 907 V 8.18 4.79 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 1.03 0.00 0.00 0.96 0.00 0.00 908 T 8.48 4.66 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 1.18 0.00 0.00 909 C 7.88 5.26 0.00 2.95 2.66 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 0.00 910 I 8.74 4.75 1.79 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 0.95 1.48 0.63 0.00 0.00 911 V 8.44 4.66 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 0.79 0.00 0.00 0.80 0.00 0.00 912 L 8.60 5.03 0.00 1.29 1.50 0.82 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 913 P 0.00 4.91 0.00 2.11 1.98 0.00 3.76 0.00 0.00 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 2.10 0.00 914 A 8.77 4.12 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 8.13 4.36 0.00 1.98 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 2.28 2.33 0.00 916 N 7.88 5.13 0.00 3.15 2.88 0.00 0.00 7.19 7.38 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 0.00 917 K 8.03 3.56 0.00 1.74 1.65 0.00 1.44 0.00 0.00 1.62 0.00 0.00 2.65 0.00 0.00 2.61 0.00 0.00 0.00 0.00 0.30 0.51 7.81 918 K 8.12 3.92 0.00 2.04 2.12 0.00 1.40 0.00 0.00 1.82 0.00 0.00 3.02 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.50 1.62 7.81 919 D 7.67 4.91 0.00 3.05 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 0.00 920 F 8.11 4.06 0.00 3.21 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 0.00 921 Y 7.68 4.46 0.00 3.07 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 0.00 922 D 8.28 4.55 0.00 2.67 2.69 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 0.00 923 L 6.90 4.33 0.00 1.38 1.42 0.63 0.67 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 0.00 924 A 8.47 4.05 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 925 A 8.58 3.94 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 0.00 926 F 8.37 3.85 0.00 3.02 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 0.00 927 I 7.77 3.95 1.90 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 1.77 0.74 0.84 0.00 0.00 928 T 7.46 4.22 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 0.42 0.00 0.00 929 E 7.84 4.36 0.00 2.00 1.90 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 2.37 2.41 0.00 930 G 9.04 3.99 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 0.00 0.00 0.00 0.00 0.00 0.00 931 L 7.56 4.39 0.00 1.93 1.72 0.95 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 932 E 9.20 4.14 0.00 2.00 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 0.00 2.08 2.17 0.00 933 V 7.98 4.38 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 -0.75 0.00 0.00 0.59 0.00 0.00 934 H 8.42 4.71 0.00 2.92 2.99 0.00 5.82 0.00 0.00 0.00 0.00 6.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 935 F 8.67 5.21 0.00 2.93 2.98 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 0.00 936 V 8.85 4.53 2.07 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 0.69 0.00 0.00 0.94 0.00 0.00 937 E 8.98 4.55 0.00 2.06 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.30 0.00 938 H 8.24 5.24 0.00 3.17 3.12 0.00 5.61 0.00 0.00 0.00 0.00 6.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 939 Y 8.45 4.04 0.00 2.93 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 0.00 940 R 8.82 4.37 0.00 2.41 2.59 0.00 3.12 0.00 0.00 3.40 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.89 0.00 941 E 8.18 3.99 0.00 2.14 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 2.37 2.46 0.00 942 I 7.60 3.47 1.61 0.00 0.00 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.58 -0.36 0.76 0.00 0.00 943 F 7.38 3.93 0.00 2.89 3.40 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 0.00 944 D 8.20 4.70 0.00 2.96 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 0.00 945 I 7.06 3.54 1.83 0.00 0.00 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.26 0.75 0.00 0.00 946 A 7.61 3.95 0.50 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 0.00 0.00 0.00 0.00 0.00 0.00 947 F 7.35 4.89 0.00 2.40 2.54 0.00 0.00 0.00 0.00 0.00 0.00 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 4.46 0.00 2.05 1.97 0.00 3.71 0.00 0.00 3.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.03 0.00 * Residues marked with a * may have inaccurate shift predictions.