NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 880 Q 4.3415 8.3293 118.8426 56.1046 29.9633 173.7540 881 S 4.8229 8.2960 112.7929 56.3378 65.3432 172.1493 882 Y 4.4913 9.6972 122.6616 56.9273 40.6973 176.9303 883 D 4.8867 8.5476 118.4278 54.8174 42.6207 176.6683 884 C 4.5624 7.7886 118.8873 58.4420 32.9433 172.8459 885 V 4.1589 8.8246 126.0963 60.6999 34.3198 174.2119 886 C 4.7889 8.8157 130.3147 59.4162 31.9516 172.0506 887 V 4.6105 8.7052 127.5091 62.0629 33.0345 174.3390 888 M 5.4116 9.1653 127.0870 53.9964 35.6441 173.8089 889 F 5.2364 8.9442 122.8504 56.1589 42.6380 175.0035 890 A 5.1806 9.2032 123.2441 50.3989 20.3555 175.6117 891 S 5.0049 8.4536 116.1275 57.4698 66.4237 173.8528 892 I 4.4533 8.2090 121.3511 58.8026 38.0144 174.6659 893 P 4.3580 0.0000 0.0000 65.4535 31.5515 178.4882 894 D 4.8197 8.3922 116.6922 56.1957 41.2011 177.7355 895 F 4.5000 8.5669 121.7379 60.4146 39.5233 177.0173 896 K 3.9651 7.9851 118.4806 59.3764 31.8096 177.9532 897 E 4.2397 8.0834 116.3493 59.1044 30.3798 177.9085 898 F 4.1694 7.5967 119.3413 59.4968 39.3190 174.2766 899 Y 4.0235 7.9179 120.2994 57.6523 38.6987 174.2652 900 T 4.2415 7.6036 123.8899 61.5061 71.1764 173.2730 901 E 4.1086 8.2285 126.6030 54.0495 29.3689 174.6144 902 S 4.7598 7.9732 118.7034 55.7040 66.3380 175.0970 903 D 5.3485 8.4090 118.6191 55.6004 40.9789 178.2336 904 V 3.8444 7.6804 119.0218 65.4294 31.9572 177.2921 905 N 4.6612 7.9840 116.9600 54.5017 37.4464 175.0502 906 K 3.7963 9.0518 113.5960 58.6320 30.5685 174.3447 907 E 3.5358 9.3427 112.3258 57.5914 26.3858 176.5903 908 G 3.9970 10.3036 106.6168 46.0376 0.0000 174.9810 909 L 4.0192 7.4109 122.4342 57.6541 41.8503 178.4612 910 E 3.9051 8.1580 117.8189 58.6835 30.2500 178.3422 911 C 5.0187 7.8027 115.3417 60.3505 30.0257 176.0522 912 L 4.2970 9.3937 121.4085 57.5750 40.9254 178.8429 913 R 3.7319 8.2463 118.1411 59.2336 29.9401 177.6127 914 L 4.2231 7.4659 116.2501 56.9485 42.4036 178.0992 915 L 3.8489 7.8916 119.9021 57.1915 41.8622 178.4858 916 N 4.1912 8.8261 118.0541 56.6070 38.7592 176.3549 917 E 4.0063 7.7989 119.4946 58.5547 29.4722 177.9864 918 I 3.5677 6.8517 118.1117 63.5533 37.8619 177.5105 919 I 3.4885 7.3856 120.0056 64.5314 36.7604 178.3326 920 A 4.0213 8.2595 121.5948 55.3574 18.0635 179.2462 921 D 4.4855 7.3083 114.6102 57.0522 41.2931 177.8347 922 F 4.4601 8.2097 117.7071 59.7293 39.3039 176.9698 923 D 4.9384 8.1769 119.4214 55.6305 40.5643 177.6841 924 D 4.5738 7.6331 116.4794 55.3604 40.7570 176.6443 925 L 4.5857 7.9792 121.4155 56.7622 42.6337 178.8293 926 L 4.1691 8.2608 116.7717 57.4382 41.6214 177.7578 927 S 4.8051 7.9878 113.6545 58.3299 62.3323 173.4699 928 K 4.6634 7.7887 120.3188 53.7455 35.2173 175.1986 929 P 4.1740 0.0000 0.0000 65.6528 31.4869 179.1676 930 K 3.6954 7.8029 115.6882 58.8306 32.0789 177.8357 931 F 5.2197 6.9566 117.5934 56.9854 39.5014 178.0365 932 S 4.2213 8.0528 117.7078 60.7052 62.9179 175.0621 933 G 3.8937 7.9302 107.4305 45.0441 0.0000 173.0455 934 V 3.7587 7.5296 121.0947 62.0274 32.2126 174.8167 935 E 4.5046 8.6093 128.8940 54.2715 32.2658 174.6882 936 K 4.2877 8.3843 128.1439 55.0767 31.8552 175.8687 937 I 3.8074 8.2164 128.6481 63.4503 37.6424 175.9967 938 K 4.2698 7.3110 118.4527 57.0356 36.9957 173.0918 939 T 4.6576 8.2890 110.5865 61.1069 71.3361 174.1127 940 I 4.0573 9.2596 129.6014 59.8666 37.5854 178.7482 941 G 3.9683 8.9145 116.6472 45.9203 0.0000 172.3024 942 S 4.5957 8.7148 112.9961 57.9749 65.2199 175.7907 943 T 4.7245 8.3111 117.9576 62.9055 71.7842 172.9898 944 Y 4.3522 8.8435 129.3755 57.6442 40.2588 174.0328 945 M 4.3961 8.4330 127.0187 53.7759 33.8605 174.3377 946 A 4.8171 8.2305 128.0201 50.2707 22.9387 174.8075 947 A 4.7803 8.3995 116.7184 51.5444 23.2780 175.7961 948 T 4.5217 8.5586 113.1535 60.5118 71.8445 174.9890 949 G 3.7927 8.8243 112.8008 46.1468 0.0000 173.9782 950 L 4.0293 7.8159 116.6559 54.0567 42.1408 177.0451 951 S 4.6579 7.9154 111.7395 57.7233 63.3459 173.3086 952 A 4.8280 7.4704 122.1695 50.4268 22.1980 176.6799 953 I 3.5776 8.5104 120.7691 64.4914 37.1737 176.3344 *964 R 4.2116 7.5292 115.4199 56.1310 31.0147 174.8342 965 Q 4.3811 8.6450 114.8932 58.0146 29.7160 175.6362 966 Y 4.5821 7.8832 114.7453 55.7975 38.3017 174.2794 967 M 4.5549 7.8739 121.2130 56.6844 34.7730 175.8938 968 H 4.4663 8.2158 115.3811 57.1066 28.5982 177.4278 969 I 3.7030 7.4617 123.2374 64.5608 37.2822 178.2705 970 G 3.7390 8.2613 106.3929 47.6346 0.0000 175.9790 971 T 4.0728 7.7728 117.8591 66.8316 68.7042 176.2053 972 M 3.9805 8.5564 120.4878 58.8506 32.0940 178.5103 973 V 3.5345 7.8122 117.9741 65.9325 31.6010 177.8794 974 E 4.0703 8.1479 117.7729 58.9765 29.1598 178.7601 975 F 3.4889 7.9729 119.9473 59.9065 39.5358 177.4911 976 A 3.8598 7.7850 120.7398 55.4366 18.1357 179.2802 977 Y 4.2159 8.4519 115.1834 60.7350 37.6622 178.9114 978 A 3.8994 7.4409 122.2469 55.0820 18.4031 179.4346 979 L 2.7009 7.0867 117.5386 57.4777 41.4382 180.0396 980 V 3.7159 7.4714 117.8903 65.9349 31.2517 178.0319 981 G 3.7003 7.7290 104.9327 47.9149 0.0000 175.7590 982 K 4.0136 7.7199 120.5294 59.1381 32.0061 179.0256 983 L 3.9622 8.7215 120.3387 58.6831 42.0884 178.5647 984 D 4.5161 8.4678 118.4525 57.0937 40.6407 178.5665 985 A 3.9996 7.6996 121.3407 55.2188 18.3919 179.6053 986 I 3.6094 7.9837 118.3899 64.4852 37.0509 178.2023 987 N 4.5373 7.8438 118.4979 55.7902 38.2809 177.1029 988 K 3.7419 7.4084 119.2458 58.9633 32.1347 176.4924 989 H 4.4743 7.8656 113.1652 55.2321 29.9575 174.0850 990 S 4.6785 8.3484 113.2849 56.8773 63.9178 174.4976 991 F 3.6767 7.5845 117.6345 58.6514 36.3450 174.7157 992 N 4.7946 7.4767 116.5866 52.1500 40.2112 175.4572 993 D 4.5872 7.3824 117.1734 52.6483 41.1948 173.7730 994 F 4.7449 9.5628 121.3967 55.5777 40.7921 175.7443 995 K 4.7078 8.5068 122.4954 54.5005 35.5144 175.3773 996 L 4.7144 8.2977 123.5502 53.6124 44.3137 174.7457 997 R 4.9276 8.6429 125.9734 54.5423 32.6760 174.5802 998 V 4.8503 8.2912 124.3995 61.3978 35.7287 174.6623 999 G 4.5678 8.7944 111.8401 44.8672 0.0000 171.1523 1000 I 5.2789 7.9045 123.8589 60.5670 39.0092 174.1476 1001 N 4.8814 8.4529 122.2260 53.8206 42.5592 171.8683 1002 H 5.5476 7.9553 115.4909 54.5285 31.8538 173.3975 1003 G 3.7514 8.3297 104.6728 44.4611 0.0000 169.7011 1004 P 5.5997 0.0000 0.0000 61.4679 32.6780 176.2907 1005 V 4.5364 8.5089 116.7873 59.4968 35.3460 175.3942 1006 I 4.8490 8.5326 127.0204 59.5730 35.0213 175.3796 1007 A 4.1222 8.4733 126.0818 51.5690 19.8942 177.9919 1008 G 4.2225 6.6092 103.4796 46.8563 0.0000 171.1236 1009 V 5.6752 8.1105 119.1268 60.8560 34.7433 174.6615 1010 I 4.4903 8.3719 120.7643 60.8021 41.2227 173.4808 1011 G 4.3158 9.0444 113.6550 44.9910 0.0000 173.7681 1012 A 4.3825 8.4568 122.7531 52.6770 19.3440 177.5274 1013 Q 4.1651 7.4216 113.8781 55.8055 30.0015 175.3683 1014 K 4.4167 7.4968 129.4767 53.7982 33.6250 174.4117 1015 P 5.4061 0.0000 0.0000 62.3548 32.3109 176.0836 1016 Q 4.6072 8.5548 120.0932 54.3465 33.1442 174.1610 1017 Y 5.0247 8.6723 124.3796 56.7582 39.0608 173.6835 1018 D 4.4217 8.1269 126.4711 51.8134 44.9896 174.7961 1019 I 4.0965 7.1787 118.7493 59.1054 38.0472 175.4193 1020 W 4.3906 8.2810 128.5788 55.8636 31.2480 174.7153 1021 G 4.4553 9.1956 106.5432 43.9592 0.0000 174.8564 1022 N 4.3717 8.9495 119.6354 56.6653 38.8300 177.2938 1023 T 3.8923 8.0768 116.9402 66.6016 68.4670 176.0071 1024 V 3.8035 7.7457 119.5380 64.9559 31.7607 177.3266 1025 N 4.1845 8.1035 116.7077 56.8826 38.7112 176.8105 1026 V 3.4806 7.7833 119.0052 65.9589 31.4562 177.4990 1027 A 4.0623 7.4086 119.7069 55.2027 18.2508 179.5103 1028 S 3.0681 7.4351 112.1501 61.1300 62.4853 176.9864 1029 R 4.1201 7.5419 122.9023 57.4980 29.5045 177.7918 1030 M 4.1116 8.1101 117.0647 55.4226 32.4218 176.0404 1031 D 4.7790 8.3558 118.9985 56.0059 42.7735 178.0965 1032 S 4.2414 8.0823 114.0862 60.5987 62.3784 175.2622 1033 T 4.7441 7.1264 111.6652 61.2113 69.0506 174.7150 1034 G 4.1223 8.0446 112.7860 45.0996 0.0000 173.3661 1035 V 4.3938 7.7088 117.4472 60.3545 34.2229 175.9011 1036 L 4.2576 8.2779 126.1548 56.3406 41.9236 177.2801 1037 D 4.5562 9.2047 121.4525 54.4715 39.6482 173.8852 1038 K 4.6023 7.5303 117.9449 54.3302 35.3783 174.6603 1039 I 4.4408 8.0041 120.5469 59.6544 40.5347 174.4155 1040 Q 5.2433 8.9441 128.9831 55.1961 30.0668 174.5340 1041 V 4.7834 8.7139 120.6671 59.7411 35.1087 177.1652 1042 T 4.3105 8.1756 113.5463 61.4313 71.4675 174.0807 1043 E 3.7855 8.7847 120.1222 59.6298 29.5945 178.7023 1044 E 3.9108 8.0613 116.7905 60.0726 29.7116 179.2006 1045 T 3.9727 7.7288 116.7411 65.9785 68.1960 176.5542 1046 S 3.9871 7.8730 114.6679 62.1123 62.6685 175.5140 1047 L 3.7919 8.0253 121.3399 57.3520 40.7066 179.3250 1048 I 3.6323 8.2478 119.1515 65.0407 37.5148 178.4067 1049 L 4.1021 7.9465 119.1453 57.7924 41.2774 179.7418 1050 Q 4.9366 8.7544 120.3032 58.5131 28.5381 178.0406 1051 T 4.1024 7.4102 106.6318 62.9207 68.7606 175.0605 1052 L 4.5580 7.5385 120.0963 54.0479 42.9781 176.5649 1053 G 4.0797 8.0921 108.3488 45.0990 0.0000 172.6241 1054 Y 5.2819 8.1242 117.8118 56.0829 40.7589 175.3749 1055 T 4.6959 8.6727 114.2675 61.4555 71.0594 173.3663 1056 C 5.4522 8.5961 120.0612 58.5449 32.0426 173.3076 1057 T 4.7263 8.8314 119.8577 61.6144 71.1659 173.1992 1058 C 3.6438 8.5551 126.4610 59.0907 31.2915 172.9520 1059 R 3.4883 7.5881 127.6128 57.7709 30.0893 176.0949 1060 G 3.9136 6.7357 108.3838 45.2029 0.0000 172.4952 1061 I 4.9053 7.7817 126.2352 59.3219 40.2521 174.4465 1062 I 4.5329 8.3648 125.2014 59.2755 41.4505 173.4732 1063 N 4.4566 8.8459 128.0514 53.2393 39.9345 174.3844 1064 V 3.9662 8.4373 128.5422 61.0765 31.0832 175.1363 1065 K 4.0614 7.9035 127.8089 57.3502 32.4957 175.4532 1066 G 4.3475 8.9939 116.0435 45.5954 0.0000 174.3636 1067 K 4.0560 7.8512 117.6570 55.8030 33.0389 177.0175 1068 G 3.7963 7.9296 107.1577 44.7562 0.0000 171.4379 1069 D 4.8519 8.4816 118.8100 54.4865 41.1939 176.2552 1070 L 4.8887 8.6536 122.7456 52.6629 46.1569 175.1201 1071 K 4.9683 8.5702 121.8421 55.4002 32.9612 175.5375 1072 T 5.0117 8.3249 116.3122 60.2746 72.6061 172.0356 1073 Y 4.6477 9.5209 119.6665 56.3974 43.1488 174.1220 1074 F 5.8132 9.6934 119.0888 55.9566 42.8613 175.3786 1075 V 4.2618 9.2684 124.1567 62.0194 31.6375 175.2744 1076 N 4.3149 8.6102 126.4925 54.1796 39.1180 175.7117 1077 T 4.4729 8.4061 118.9152 63.1500 68.6984 174.7883 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 880 Q 8.33 4.34 0.00 2.07 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.65 0.00 0.00 0.00 0.00 0.00 2.31 2.08 0.00 881 S 8.30 4.82 0.00 4.11 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 0.00 882 Y 9.70 4.49 0.00 3.10 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 0.00 883 D 8.55 4.89 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 0.00 884 C 7.79 4.56 0.00 2.77 2.62 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 0.00 885 V 8.82 4.16 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 0.73 0.00 0.00 0.81 0.00 0.00 886 C 8.82 4.79 0.00 2.99 2.91 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 0.00 887 V 8.71 4.61 2.19 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 1.07 0.00 0.00 1.01 0.00 0.00 888 M 9.17 5.41 0.00 2.14 1.91 0.00 0.00 0.00 0.00 0.00 2.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.63 0.00 889 F 8.94 5.24 0.00 3.05 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 0.00 890 A 9.20 5.18 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 0.00 891 S 8.45 5.00 0.00 3.98 4.10 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 0.00 892 I 8.21 4.45 1.85 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 1.23 0.76 1.16 0.00 0.00 893 P 0.00 4.36 0.00 2.25 2.17 0.00 3.71 0.00 0.00 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.18 0.00 894 D 8.39 4.82 0.00 3.16 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 0.00 895 F 8.57 4.50 0.00 3.23 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 0.00 896 K 7.99 3.97 0.00 1.89 1.97 0.00 1.91 0.00 0.00 1.81 0.00 0.00 3.19 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.56 1.58 7.81 897 E 8.08 4.24 0.00 2.18 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 2.36 2.44 0.00 898 F 7.60 4.17 0.00 3.07 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 0.00 899 Y 7.92 4.02 0.00 3.01 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 0.00 900 T 7.60 4.24 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.00 0.00 901 E 8.23 4.11 0.00 1.70 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 2.13 2.20 0.00 902 S 7.97 4.76 0.00 3.90 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 903 D 8.41 5.35 0.00 2.66 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 0.00 904 V 7.68 3.84 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 0.88 0.00 0.00 905 N 7.98 4.66 0.00 2.95 2.91 0.00 0.00 7.34 6.62 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 0.00 906 K 9.05 3.80 0.00 1.85 1.88 0.00 1.88 0.00 0.00 1.70 0.00 0.00 2.99 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.38 1.40 7.81 907 E 9.34 3.54 0.00 2.20 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 2.21 2.26 0.00 908 G 10.30 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 0.00 0.00 0.00 909 L 7.41 4.02 0.00 1.74 1.65 0.97 0.96 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 0.00 910 E 8.16 3.91 0.00 2.06 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 2.44 2.34 0.00 911 C 7.80 5.02 0.00 3.05 3.38 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 0.00 0.00 0.00 0.00 912 L 9.39 4.30 0.00 1.85 1.78 1.04 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 913 R 8.25 3.73 0.00 2.04 2.12 0.00 3.38 0.00 0.00 3.30 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.74 0.00 914 L 7.47 4.22 0.00 1.93 1.98 0.89 0.27 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 0.00 915 L 7.89 3.85 0.00 1.55 1.72 0.13 -0.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 0.00 0.00 0.00 0.00 916 N 8.83 4.19 0.00 2.95 2.77 0.00 0.00 6.65 7.80 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 0.00 917 E 7.80 4.01 0.00 2.30 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 0.00 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0.00 1.71 1.81 1.01 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 0.00 0.00 0.00 0.00 0.00 0.00 927 S 7.99 4.81 0.00 3.89 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 928 K 7.79 4.66 0.00 2.05 1.68 0.00 1.73 0.00 0.00 1.61 0.00 0.00 2.78 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.19 1.35 7.81 929 P 0.00 4.17 0.00 2.12 2.01 0.00 3.59 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 2.06 2.07 0.00 930 K 7.80 3.70 0.00 0.79 1.26 0.00 1.50 0.00 0.00 1.15 0.00 0.00 2.77 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.19 1.12 7.81 931 F 6.96 5.22 0.00 3.31 2.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 932 S 8.05 4.22 0.00 4.01 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 0.00 933 G 7.93 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 934 V 7.53 3.76 1.94 0.00 0.00 0.00 0.00 0.00 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0.00 0.00 0.00 951 S 7.92 4.66 0.00 3.94 3.90 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 0.00 952 A 7.47 4.83 1.20 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 0.00 0.00 953 I 8.51 3.58 1.88 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 0.43 0.89 0.00 0.00 *964 R 7.53 4.21 0.00 1.86 2.02 0.00 3.37 0.00 0.00 3.30 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.59 0.00 965 Q 8.64 4.38 0.00 2.41 2.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 7.32 0.00 0.00 0.00 0.00 0.00 2.40 2.68 0.00 966 Y 7.88 4.58 0.00 2.80 2.84 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 0.00 967 M 7.87 4.55 0.00 2.08 2.02 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 2.55 2.56 0.00 968 H 8.22 4.47 0.00 3.36 3.50 0.00 5.68 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 969 I 7.46 3.70 1.86 0.00 0.00 0.70 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 1.37 0.94 0.00 0.00 970 G 8.26 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 0.00 971 T 7.77 4.07 4.41 0.00 0.00 0.00 0.00 0.00 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 0.00 972 M 8.56 3.98 0.00 2.25 2.11 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.64 2.63 0.00 973 V 7.81 3.53 2.27 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 0.47 0.00 0.00 1.00 0.00 0.00 974 E 8.15 4.07 0.00 2.52 2.40 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 2.63 2.62 0.00 975 F 7.97 3.49 0.00 2.77 3.08 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 0.00 976 A 7.79 3.86 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 0.00 977 Y 8.45 4.22 0.00 3.15 2.95 0.00 0.00 0.00 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5.55 0.00 3.17 3.25 0.00 5.19 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1003 G 8.33 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 1004 P 0.00 5.60 0.00 2.15 2.14 0.00 3.37 0.00 0.00 4.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.88 0.00 1005 V 8.51 4.54 2.19 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 0.77 0.00 0.00 0.90 0.00 0.00 1006 I 8.53 4.85 2.06 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 1.26 0.64 1.04 0.00 0.00 1007 A 8.47 4.12 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 1008 G 6.61 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 0.00 0.00 0.00 0.00 1009 V 8.11 5.68 2.21 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 1.09 0.00 0.00 1.09 0.00 0.00 1010 I 8.37 4.49 2.47 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.23 1.21 0.00 0.00 1011 G 9.04 4.32 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 0.00 1012 A 8.46 4.38 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 1013 Q 7.42 4.17 0.00 2.06 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.84 0.00 0.00 0.00 0.00 0.00 2.31 2.28 0.00 1014 K 7.50 4.42 0.00 1.67 1.71 0.00 1.78 0.00 0.00 1.71 0.00 0.00 3.03 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.31 1.42 7.81 1015 P 0.00 5.41 0.00 2.02 2.03 0.00 3.74 0.00 0.00 4.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 1.99 0.00 1016 Q 8.55 4.61 0.00 1.95 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.98 0.00 0.00 0.00 0.00 0.00 2.34 2.45 0.00 1017 Y 8.67 5.02 0.00 2.86 2.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1018 D 8.13 4.42 0.00 2.21 1.54 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 1019 I 7.18 4.10 1.71 0.00 0.00 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 0.55 0.54 0.00 0.00 1020 W 8.28 4.39 0.00 3.46 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 1021 G 9.20 4.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1022 N 8.95 4.37 0.00 2.80 2.86 0.00 0.00 7.01 7.22 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 1023 T 8.08 3.89 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 1.31 0.00 0.00 1024 V 7.75 3.80 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 1.19 0.00 0.00 1.04 0.00 0.00 1025 N 8.10 4.18 0.00 2.82 3.02 0.00 0.00 6.87 7.71 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 1026 V 7.78 3.48 2.19 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 0.88 0.00 0.00 1.02 0.00 0.00 1027 A 7.41 4.06 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 1028 S 7.44 3.07 0.00 3.40 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 1029 R 7.54 4.12 0.00 1.82 1.99 0.00 3.24 0.00 0.00 3.23 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.64 0.00 1030 M 8.11 4.11 0.00 2.12 2.18 0.00 0.00 0.00 0.00 0.00 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.54 0.00 1031 D 8.36 4.78 0.00 2.83 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 1032 S 8.08 4.24 0.00 4.09 4.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1033 T 7.13 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 1.27 0.00 0.00 1034 G 8.04 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 0.00 0.00 0.00 1035 V 7.71 4.39 1.49 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 0.91 0.00 0.00 1.00 0.00 0.00 1036 L 8.28 4.26 0.00 1.65 1.58 0.94 1.12 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 1037 D 9.20 4.56 0.00 2.73 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 1038 K 7.53 4.60 0.00 1.36 1.14 0.00 1.46 0.00 0.00 1.53 0.00 0.00 2.89 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.32 1.10 7.81 1039 I 8.00 4.44 1.92 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 1.30 1.13 0.96 0.00 0.00 1040 Q 8.94 5.24 0.00 2.56 2.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.73 0.00 0.00 0.00 0.00 0.00 2.42 2.68 0.00 1041 V 8.71 4.78 2.15 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 0.87 0.00 0.00 1.10 0.00 0.00 1042 T 8.18 4.31 4.43 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 1.23 0.00 0.00 1043 E 8.78 3.79 0.00 2.17 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 2.38 2.38 0.00 1044 E 8.06 3.91 0.00 2.32 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 0.00 2.35 2.46 0.00 1045 T 7.73 3.97 4.36 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 1.30 0.00 0.00 1046 S 7.87 3.99 0.00 3.39 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 1047 L 8.03 3.79 0.00 1.84 1.54 0.86 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 1048 I 8.25 3.63 1.89 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 1.45 1.19 0.92 0.00 0.00 1049 L 7.95 4.10 0.00 2.04 1.92 1.05 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 1050 Q 8.75 4.94 0.00 2.22 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.91 0.00 0.00 0.00 0.00 0.00 2.67 2.23 0.00 1051 T 7.41 4.10 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 1052 L 7.54 4.56 0.00 1.45 1.43 0.91 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 1053 G 8.09 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 0.00 0.00 0.00 1054 Y 8.12 5.28 0.00 3.07 2.75 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 1055 T 8.67 4.70 4.32 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 1.28 0.00 0.00 1056 C 8.60 5.45 0.00 2.88 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 1057 T 8.83 4.73 4.37 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 1.24 0.00 0.00 1058 C 8.56 3.64 0.00 2.26 2.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1059 R 7.59 3.49 0.00 0.67 1.20 0.00 3.42 0.00 0.00 3.04 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.37 0.00 1060 G 6.74 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 1061 I 7.78 4.91 1.82 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.95 0.96 0.00 0.00 1062 I 8.36 4.53 1.84 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 1.11 1.69 0.90 0.00 0.00 1063 N 8.85 4.46 0.00 2.99 2.70 0.00 0.00 6.83 7.71 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 1064 V 8.44 3.97 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 0.86 0.00 0.00 0.96 0.00 0.00 1065 K 7.90 4.06 0.00 1.75 1.73 0.00 1.70 0.00 0.00 1.67 0.00 0.00 3.02 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.43 1.43 7.81 1066 G 8.99 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 0.00 0.00 0.00 0.00 1067 K 7.85 4.06 0.00 1.72 1.92 0.00 1.98 0.00 0.00 1.71 0.00 0.00 2.82 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.38 1.43 7.81 1068 G 7.93 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 1069 D 8.48 4.85 0.00 2.57 2.62 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 1070 L 8.65 4.89 0.00 1.59 1.53 0.92 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 1071 K 8.57 4.97 0.00 1.77 1.81 0.00 1.95 0.00 0.00 1.55 0.00 0.00 2.89 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.17 1.36 7.81 1072 T 8.32 5.01 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 1.20 0.00 0.00 1073 Y 9.52 4.65 0.00 2.95 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 1074 F 9.69 5.81 0.00 2.99 2.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1075 V 9.27 4.26 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 0.56 0.00 0.00 0.98 0.00 0.00 1076 N 8.61 4.31 0.00 2.88 2.86 0.00 0.00 7.08 7.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1077 T 8.41 4.47 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 1.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.