NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 826 E 4.5397 8.3448 119.6103 56.2968 31.3888 176.0632 827 D 4.0454 8.0958 119.7890 54.6341 41.7996 175.0457 828 W 4.8620 7.6467 115.5505 54.0309 33.6344 174.4629 829 C 4.1631 8.5386 119.6195 59.7120 31.1758 174.7103 830 A 4.0757 8.2184 130.1229 54.3424 17.8664 177.8637 831 V 4.2463 7.5076 114.5401 64.4709 32.6407 176.4626 832 C 4.3545 8.0340 114.6584 58.3608 30.5316 173.2377 833 Q 3.7727 8.0486 118.3488 57.3469 26.1839 172.5069 834 N 5.2255 8.0079 112.7125 51.4169 43.1469 174.8972 835 G 4.4016 8.4224 108.3716 44.2351 0.0000 171.6425 836 G 3.9824 8.6217 104.4717 44.4481 0.0000 173.3764 837 E 4.3274 8.8832 123.1919 55.7625 30.1966 175.6896 838 L 5.1588 8.2742 123.1550 52.8339 45.4366 175.9897 839 L 4.5630 9.4941 123.5090 54.2238 43.2866 175.3824 840 C 5.1412 8.5602 120.8355 57.9841 30.0795 173.2957 841 C 4.7803 9.0328 125.3432 59.6133 31.6766 173.3357 842 E 4.4633 9.1280 124.2155 56.8859 29.5175 177.0996 843 K 4.5300 7.9922 117.1744 56.1834 34.1146 175.1505 844 C 4.9896 7.6454 111.9419 55.4541 32.8967 172.9163 845 P 4.3520 0.0000 0.0000 64.5648 31.4068 177.0698 846 K 4.1760 7.5347 119.2809 56.5064 33.2647 176.5890 847 V 5.0358 7.7845 115.0591 60.0528 36.1336 174.4502 848 F 5.2455 9.2056 120.6171 56.1853 43.9324 174.0274 849 H 4.4643 8.8562 117.7509 55.5107 29.8404 176.4656 850 L 3.5606 8.5922 121.1945 57.9213 41.4508 179.2954 851 S 4.5677 7.7048 108.4082 57.9948 63.6035 174.2998 852 C 4.2152 7.7666 119.0983 61.8807 28.6222 173.9005 853 H 4.1027 7.8589 117.9835 55.4902 30.1159 174.3994 854 V 4.2773 6.8635 121.9115 58.7782 33.7108 173.8831 855 P 4.4039 0.0000 0.0000 62.2391 32.1403 176.1582 856 T 4.1417 8.1741 115.9919 63.6676 69.0169 173.5501 857 L 4.6442 7.9740 125.3894 53.1876 43.6497 177.0536 858 T 4.1074 8.5215 112.3139 63.3982 69.5483 174.3285 859 N 5.0059 7.4050 116.7233 50.8242 42.7341 173.8649 860 F 4.0019 8.5646 118.9722 56.3023 39.6480 174.2279 861 P 4.4532 0.0000 0.0000 63.1037 31.9098 176.3546 862 S 4.2839 8.7927 115.3141 61.0379 62.8349 174.9658 863 G 3.9585 7.7095 106.5855 44.7046 0.0000 172.1738 864 E 4.3634 8.5699 119.7287 55.9084 30.6580 176.5175 865 W 5.0584 8.8649 133.8097 55.5666 34.3106 173.6434 866 I 4.6567 7.2942 125.3971 58.9039 40.3863 174.8110 867 C 3.4461 7.9615 123.2855 57.2659 30.6163 174.4823 868 T 3.7959 8.2668 116.7122 66.7431 67.7884 176.5307 869 F 4.4199 7.7066 118.7028 60.5431 39.1462 176.7827 870 C 4.4236 7.9890 114.5082 60.5009 28.5776 174.3633 871 R 3.9714 7.6310 121.7201 55.6530 30.0366 175.6021 872 D 4.3844 8.6255 125.1637 54.8018 41.7423 176.4365 873 L 4.1269 8.5505 126.2513 58.1498 42.1119 178.8878 874 S 4.2385 8.1944 113.1309 61.0522 62.8923 175.3107 875 K 4.4326 8.9429 122.4434 52.9031 32.6110 173.2643 876 P 4.2298 0.0000 0.0000 62.9206 31.7952 176.9112 877 E 4.1493 8.5867 121.7435 58.3521 29.9085 177.2794 878 V 4.4327 7.0924 110.1997 59.4828 35.4032 173.5756 879 E 4.3257 8.4342 123.1389 54.6137 31.2169 174.9890 880 Y 4.8265 7.9137 123.5944 57.2877 39.3015 176.0593 881 D 4.4356 9.0835 123.1308 56.7255 39.4071 178.4996 882 C 4.0261 7.9384 113.6049 60.0770 29.3915 173.9278 883 D 4.7386 8.0278 117.8616 53.9691 41.7057 176.3125 884 A 4.6100 7.7865 122.0833 49.6631 19.6067 175.6671 885 P 4.4069 0.0000 0.0000 62.7913 31.9361 175.9986 886 S 4.6525 8.0270 115.1393 57.0354 66.1076 174.5723 887 H 4.3970 7.7474 116.8635 54.2440 26.5738 174.4031 *892 K 4.0028 7.7865 126.8567 56.4627 33.7726 175.8968 893 K 3.7293 8.6434 117.7247 56.9626 31.8140 177.2070 894 T 3.9841 8.4822 121.4381 63.7510 68.7027 174.3619 895 E 4.3558 8.8116 126.2281 56.1189 30.7630 175.7458 896 G 4.0583 8.6382 106.5381 45.9488 0.0000 173.6192 897 L 4.4689 7.7788 119.5239 53.2333 44.5599 174.6943 898 V 4.1417 8.4924 126.1982 61.5239 32.2467 174.7989 899 K 4.6735 8.2570 125.7670 53.9939 35.1228 175.9456 900 L 4.2691 8.3120 120.5579 54.7934 42.3904 178.2252 901 T 4.1976 8.3090 112.3033 61.0291 70.9578 173.7610 902 P 4.2868 0.0000 0.0000 65.8828 31.2902 179.0817 903 I 3.7277 7.7062 118.0711 64.6325 37.1706 178.1310 904 D 4.5839 8.1826 119.3318 56.9404 40.5615 178.8597 905 K 4.0283 8.2162 120.5758 59.6538 32.2778 179.1991 906 R 4.2193 8.0302 119.6469 58.5519 29.8315 179.2609 907 K 3.9653 8.1863 118.6026 59.6206 31.9918 178.9854 908 C 3.8038 8.1075 118.9324 62.2209 30.7918 175.4356 909 E 3.9250 8.2435 120.5310 59.2551 28.9047 179.2743 910 R 3.8024 7.9843 118.8712 59.0616 30.1576 178.3986 911 L 4.1689 8.2215 119.0553 57.8620 41.6256 179.4994 912 L 4.3293 8.3229 118.9275 58.0117 41.6878 179.3916 913 L 4.1156 8.0250 120.2047 58.0573 41.6507 178.9631 914 F 4.6457 8.4874 117.2268 60.8522 39.2512 177.3284 915 L 4.5675 8.4732 118.5993 58.2712 41.1701 179.1439 916 Y 4.1694 8.9156 117.1335 61.1885 37.6279 177.9776 917 C 4.5685 8.4904 115.4171 60.2065 29.1762 173.4447 918 H 4.4400 8.0317 122.2426 55.2599 30.3236 175.3590 919 E 3.9578 8.7965 127.3086 59.8645 29.4712 178.1781 920 M 4.3815 8.2766 114.9052 56.4778 32.2426 176.8105 921 S 4.7836 8.3329 114.1481 58.8714 64.0245 175.8089 922 L 3.8383 7.7437 123.9583 58.4325 41.6509 178.9355 923 A 3.8052 7.6811 118.1722 53.8453 18.4843 177.6438 924 F 4.8485 7.8548 113.6845 57.2588 40.2114 177.6671 925 Q 3.7159 8.0116 121.7390 58.1126 28.6617 175.6883 926 D 5.5896 7.4497 113.7191 50.0561 44.5328 173.5261 927 P 4.2926 0.0000 0.0000 62.7707 31.7455 176.9515 928 V 3.4400 8.0809 121.4728 61.9924 32.1067 174.0925 929 P 4.3109 0.0000 0.0000 62.8781 31.6117 177.4658 930 L 4.1757 8.4999 122.2275 57.2801 41.6615 177.9744 931 T 4.1879 7.7094 107.0179 61.7932 69.6010 174.7589 932 V 3.7581 7.8249 124.3849 61.8220 31.5000 173.3794 933 P 4.4049 0.0000 0.0000 64.5282 31.6208 176.3710 934 D 4.5779 9.1905 120.7533 54.8418 39.2147 174.8832 935 Y 3.3843 8.0072 121.3264 61.0006 38.6215 177.5962 936 Y 4.1411 8.1021 113.4163 58.8385 38.3619 176.4503 937 K 4.2391 7.8590 121.2469 58.7683 33.0727 177.8816 938 I 3.7630 7.7103 118.4512 64.2153 37.1405 176.8434 939 I 3.8908 7.2821 125.5133 60.1865 35.8684 176.1517 940 K 4.1824 8.4192 126.0772 58.3113 32.5452 177.6712 941 N 5.0063 7.5850 114.9627 50.1964 38.6525 171.9590 942 P 4.4502 0.0000 0.0000 62.9538 32.5917 175.8217 943 M 4.7627 8.1844 119.2885 53.6509 35.1083 173.7272 944 D 4.7108 8.1501 123.0896 51.0272 43.7872 176.2968 945 L 3.8923 8.5687 120.3377 58.0036 41.5088 180.1448 946 S 4.3908 8.3235 115.4537 61.3041 62.7735 176.7947 947 T 3.9430 8.0002 118.8837 66.3717 68.2604 176.6818 948 I 3.8492 7.5761 122.7398 63.6089 37.0709 178.2513 949 K 3.9361 8.3836 120.8021 59.5264 31.9468 178.7701 950 K 3.9741 8.1877 119.7782 59.5969 31.9168 179.0692 951 R 3.8870 8.0220 117.6051 58.9795 29.9288 178.5169 952 L 4.3605 8.0294 119.6696 58.0703 42.2901 178.1828 953 Q 4.1649 7.7884 116.5081 56.3225 29.5635 175.8669 954 E 4.0907 7.1474 118.1114 56.9498 30.2264 176.6051 955 D 4.2783 8.8941 123.4647 57.4611 41.4723 177.4108 956 Y 4.5299 7.3962 114.7918 56.3323 37.1401 175.8942 957 S 4.1343 7.6231 114.6913 58.6784 63.4837 173.7077 958 M 4.2178 8.2414 122.6845 56.2029 31.5863 175.5709 959 Y 4.8088 7.7451 119.4039 57.7247 38.2422 176.0155 960 S 4.7741 9.8968 121.6144 58.5215 64.4601 174.4585 961 K 4.6201 7.8516 117.2003 53.6286 35.4132 174.6100 962 P 2.9700 0.0000 0.0000 65.7654 31.1376 178.6542 963 E 3.7561 7.7696 116.1594 59.1240 29.3084 179.1878 964 D 4.3414 8.0883 119.9135 57.3149 40.9674 178.6521 965 F 3.7145 7.2253 114.5000 59.3137 38.0086 177.6088 966 V 4.1345 7.5343 118.8997 66.0591 31.3054 177.7979 967 A 4.0564 7.9717 120.2196 55.2996 18.2042 179.4013 968 D 4.2984 7.7206 116.7084 57.3659 40.4406 178.9679 969 F 3.6533 8.0712 118.3508 60.5485 38.7780 178.0323 970 R 4.1308 8.2226 117.5097 58.8631 29.7391 178.8702 971 L 3.9236 7.8089 120.5904 57.9210 42.0128 178.9136 972 I 3.5241 7.0766 119.3287 64.5507 36.9970 178.4909 973 F 4.3385 6.9645 117.8251 60.2177 38.6336 177.6940 974 Q 3.9831 8.4743 119.7381 59.3691 28.9544 178.0270 975 N 4.3420 8.5346 117.9090 56.4549 38.5650 176.8259 976 C 4.3246 8.2592 119.8352 62.7563 31.4733 175.6353 977 A 4.1364 7.9718 121.0585 54.9518 18.0363 178.9241 978 E 4.0297 8.3498 117.5006 58.9982 29.7665 178.1881 979 F 4.2914 8.2276 119.4757 59.4078 40.2879 175.8320 980 N 4.6238 7.6449 114.6675 52.0497 39.7348 174.6008 981 E 4.0217 8.4682 122.5584 55.1791 30.4405 174.4489 982 P 4.3408 0.0000 0.0000 64.4650 31.8359 175.0643 983 D 5.0032 8.9954 118.3658 54.2777 39.8483 174.1918 984 S 4.5740 7.6477 112.5931 56.5534 65.6418 174.2181 985 E 3.8792 8.5465 121.2981 59.6612 29.3975 178.7547 986 V 3.6468 7.8461 117.4627 65.8461 31.6641 177.6349 987 A 4.1492 8.0985 120.4999 55.4103 18.3987 179.4474 988 N 4.3839 8.3789 114.8189 56.2310 38.5480 177.5959 989 A 4.2507 8.3067 122.6242 55.0585 18.4351 179.9327 990 G 3.5067 8.5584 104.3252 47.9215 0.0000 175.9643 991 I 3.6135 7.7298 122.2765 64.0837 37.1813 178.7265 992 K 3.9695 8.0926 119.2017 59.4208 31.8486 179.2640 993 L 3.9968 8.0887 120.6893 57.9734 41.9692 178.6532 994 E 2.5500 7.7717 119.4751 58.8109 29.4143 178.6022 995 N 4.3151 8.0537 116.5927 56.1896 38.5556 176.8947 996 Y 4.1811 8.0820 121.1801 60.5492 38.8542 177.5725 997 F 3.9670 8.5840 122.0317 61.4766 39.6275 176.9392 998 E 3.6166 8.2668 118.0333 59.2987 29.0432 179.2978 999 E 3.8522 7.8261 118.2070 59.1620 29.4679 179.3167 1000 L 3.5894 7.3761 118.9330 57.5937 41.6420 179.3689 1001 L 3.8415 7.3995 118.8854 57.9456 41.3109 179.8822 1002 K 4.1065 7.5150 116.5668 59.4086 31.9654 178.7534 1003 N 4.4532 7.4615 116.1373 55.6774 38.6414 176.9849 1004 L 4.1082 7.7808 119.3883 55.8069 43.2978 176.8087 1005 Y 4.7827 8.0674 115.4366 55.6324 38.2971 173.5415 1006 P 4.4241 0.0000 0.0000 62.9072 31.6157 177.1993 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 826 E 8.34 4.54 0.00 1.90 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 2.38 2.28 0.00 827 D 8.10 4.05 0.00 1.79 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 0.00 828 W 7.65 4.86 0.00 3.39 2.93 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 0.00 829 C 8.54 4.16 0.00 2.95 3.03 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 0.00 830 A 8.22 4.08 1.05 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 0.00 0.00 0.00 0.00 0.00 831 V 7.51 4.25 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 1.11 0.00 0.00 1.25 0.00 0.00 832 C 8.03 4.35 0.00 3.18 3.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 833 Q 8.05 3.77 0.00 2.18 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.74 0.00 0.00 0.00 0.00 0.00 2.53 2.34 0.00 834 N 8.01 5.23 0.00 2.79 2.76 0.00 0.00 6.86 7.66 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 0.00 835 G 8.42 4.40 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 0.00 836 G 8.62 3.98 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 0.00 0.00 0.00 837 E 8.88 4.33 0.00 2.16 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 0.00 2.32 2.32 0.00 838 L 8.27 5.16 0.00 1.46 1.51 0.87 0.82 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 0.00 839 L 9.49 4.56 0.00 1.30 0.80 0.17 -0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 0.00 0.00 0.00 0.00 840 C 8.56 5.14 0.00 2.92 2.93 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 0.00 841 C 9.03 4.78 0.00 3.39 3.27 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 0.00 842 E 9.13 4.46 0.00 2.11 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 0.00 2.63 2.58 0.00 843 K 7.99 4.53 0.00 1.71 1.83 0.00 1.67 0.00 0.00 1.75 0.00 0.00 3.03 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.33 1.36 7.81 844 C 7.65 4.99 0.00 3.08 3.05 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 0.00 0.00 0.00 845 P 0.00 4.35 0.00 2.21 2.14 0.00 3.62 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.11 0.00 846 K 7.53 4.18 0.00 2.09 1.34 0.00 1.92 0.00 0.00 2.01 0.00 0.00 2.67 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.42 1.46 7.81 847 V 7.78 5.04 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 0.90 0.00 0.00 0.85 0.00 0.00 848 F 9.21 5.25 0.00 2.76 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 0.00 849 H 8.86 4.46 0.00 3.18 3.20 0.00 5.84 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 850 L 8.59 3.56 0.00 1.47 1.72 0.54 -0.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 851 S 7.70 4.57 0.00 3.91 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 0.00 852 C 7.77 4.22 0.00 3.36 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 0.00 853 H 7.86 4.10 0.00 2.70 2.94 0.00 5.87 0.00 0.00 0.00 0.00 6.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 854 V 6.86 4.28 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 0.57 0.00 0.00 0.92 0.00 0.00 855 P 0.00 4.40 0.00 2.21 2.26 0.00 3.82 0.00 0.00 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.25 0.00 856 T 8.17 4.14 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 1.16 0.00 0.00 857 L 7.97 4.64 0.00 1.27 1.32 0.33 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 858 T 8.52 4.11 4.20 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 1.17 0.00 0.00 859 N 7.41 5.01 0.00 2.54 2.71 0.00 0.00 7.06 7.33 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 0.00 860 F 8.56 4.00 0.00 3.01 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 0.00 861 P 0.00 4.45 0.00 2.33 2.16 0.00 3.78 0.00 0.00 3.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 1.74 0.00 862 S 8.79 4.28 0.00 3.89 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 0.00 863 G 7.71 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 0.00 0.00 0.00 864 E 8.57 4.36 0.00 2.05 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 2.38 2.50 0.00 865 W 8.86 5.06 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 0.00 866 I 7.29 4.66 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 1.17 0.92 0.69 0.00 0.00 867 C 7.96 3.45 0.00 2.96 3.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 868 T 8.27 3.80 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 0.92 0.00 0.00 869 F 7.71 4.42 0.00 3.04 2.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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0.00 1.21 0.00 0.00 948 I 7.58 3.85 1.83 0.00 0.00 -0.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.96 0.61 0.00 0.00 949 K 8.38 3.94 0.00 2.04 2.11 0.00 1.51 0.00 0.00 1.55 0.00 0.00 2.80 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.43 1.44 7.81 950 K 8.19 3.97 0.00 2.05 1.77 0.00 1.69 0.00 0.00 1.70 0.00 0.00 3.09 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.43 1.62 7.81 951 R 8.02 3.89 0.00 1.82 1.22 0.00 3.28 0.00 0.00 2.84 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.76 0.00 952 L 8.03 4.36 0.00 1.98 1.98 1.06 0.63 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 0.00 953 Q 7.79 4.16 0.00 2.08 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.60 0.00 0.00 0.00 0.00 0.00 2.36 2.43 0.00 954 E 7.15 4.09 0.00 2.16 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.39 0.00 955 D 8.89 4.28 0.00 2.55 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 0.00 0.00 0.00 956 Y 7.40 4.53 0.00 2.97 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 0.00 957 S 7.62 4.13 0.00 4.00 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 0.00 958 M 8.24 4.22 0.00 2.09 2.10 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.24 0.00 959 Y 7.75 4.81 0.00 3.20 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 0.00 960 S 9.90 4.77 0.00 3.97 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 0.00 961 K 7.85 4.62 0.00 1.80 1.84 0.00 1.49 0.00 0.00 1.80 0.00 0.00 2.83 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.51 1.36 7.81 962 P 0.00 2.97 0.00 1.60 1.44 0.00 3.46 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.35 0.00 963 E 7.77 3.76 0.00 1.91 1.89 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 2.29 2.28 0.00 964 D 8.09 4.34 0.00 2.85 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 0.00 965 F 7.23 3.71 0.00 2.71 1.89 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 0.00 966 V 7.53 4.13 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 1.18 0.00 0.00 0.94 0.00 0.00 967 A 7.97 4.06 1.41 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 0.00 0.00 0.00 968 D 7.72 4.30 0.00 2.95 2.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 969 F 8.07 3.65 0.00 2.93 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 0.00 0.00 0.00 970 R 8.22 4.13 0.00 1.93 2.08 0.00 3.27 0.00 0.00 3.22 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 1.95 0.00 971 L 7.81 3.92 0.00 1.86 1.80 0.96 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 972 I 7.08 3.52 1.15 0.00 0.00 0.55 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 0.30 0.45 0.00 0.00 973 F 6.96 4.34 0.00 3.06 3.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 974 Q 8.47 3.98 0.00 2.24 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.80 0.00 0.00 0.00 0.00 0.00 2.38 2.43 0.00 975 N 8.53 4.34 0.00 2.99 2.93 0.00 0.00 6.72 7.23 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 0.00 976 C 8.26 4.32 0.00 3.37 3.27 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 0.00 977 A 7.97 4.14 1.41 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 0.00 0.00 0.00 978 E 8.35 4.03 0.00 2.06 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 2.32 2.38 0.00 979 F 8.23 4.29 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 0.00 980 N 7.64 4.62 0.00 3.04 2.82 0.00 0.00 7.02 7.74 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 0.00 981 E 8.47 4.02 0.00 1.98 1.80 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 2.35 2.38 0.00 982 P 0.00 4.34 0.00 2.08 2.01 0.00 3.87 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 2.03 2.11 0.00 983 D 9.00 5.00 0.00 2.79 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 0.00 984 S 7.65 4.57 0.00 4.16 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 0.00 985 E 8.55 3.88 0.00 2.07 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 2.39 2.39 0.00 986 V 7.85 3.65 2.30 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 1.03 0.00 0.00 0.91 0.00 0.00 987 A 8.10 4.15 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 988 N 8.38 4.38 0.00 2.82 2.91 0.00 0.00 6.94 8.30 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 0.00 989 A 8.31 4.25 1.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 990 G 8.56 3.51 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 0.00 991 I 7.73 3.61 2.02 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 1.86 1.05 0.89 0.00 0.00 992 K 8.09 3.97 0.00 1.99 1.88 0.00 1.71 0.00 0.00 1.60 0.00 0.00 2.92 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.47 1.66 7.81 993 L 8.09 4.00 0.00 1.96 1.79 1.07 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 994 E 7.77 2.55 0.00 1.16 1.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 1.79 0.00 995 N 8.05 4.32 0.00 2.91 2.84 0.00 0.00 6.67 7.11 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 0.00 996 Y 8.08 4.18 0.00 3.04 3.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 997 F 8.58 3.97 0.00 3.25 3.22 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 0.00 998 E 8.27 3.62 0.00 2.09 1.89 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 2.61 2.48 0.00 999 E 7.83 3.85 0.00 2.01 1.85 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 2.45 2.49 0.00 1000 L 7.38 3.59 0.00 1.39 1.30 0.51 -0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 1001 L 7.40 3.84 0.00 1.43 1.54 0.69 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.58 0.00 0.00 0.00 0.00 0.00 0.00 1002 K 7.51 4.11 0.00 1.83 1.81 0.00 1.62 0.00 0.00 1.65 0.00 0.00 2.97 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.41 1.59 7.81 1003 N 7.46 4.45 0.00 2.61 2.75 0.00 0.00 7.04 7.73 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 1004 L 7.78 4.11 0.00 1.43 1.21 0.88 0.54 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 1005 Y 8.07 4.78 0.00 2.95 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 1006 P 0.00 4.42 0.00 2.16 2.12 0.00 3.76 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.92 0.00 * Residues marked with a * may have inaccurate shift predictions.