NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 875 P 4.8028 0.0000 0.0000 62.9737 32.6711 175.2578 876 T 4.5250 8.8804 114.7754 58.8567 71.2643 167.6683 877 V 4.7145 8.2741 124.7486 61.3257 34.2725 175.6431 878 I 4.5663 8.9249 120.7008 59.1813 40.7975 174.4731 879 K 4.9228 8.5252 120.7888 54.6886 35.0201 175.8145 880 V 4.9987 8.7493 122.7609 61.4364 34.7188 174.4140 881 Q 4.8565 8.5182 124.7033 54.1739 33.9818 170.1255 882 N 4.2099 8.7398 126.2510 52.4637 37.8719 171.6536 *884 P 4.2623 0.0000 0.0000 62.0106 32.4120 177.6905 885 F 4.2999 8.7894 114.1793 59.5610 37.8493 176.0656 886 T 3.7927 6.6970 109.6286 61.0469 69.1059 175.2385 887 V 4.4143 7.3554 121.7696 61.7066 31.9945 175.9694 888 S 4.8402 8.3079 115.5873 56.1614 67.0599 175.0744 889 I 3.7288 8.2517 122.8049 64.7849 36.7065 178.3292 890 D 4.3922 8.0799 119.0157 57.5923 40.7831 178.5421 891 E 3.6534 8.3884 118.9660 59.3898 29.4124 179.6854 892 I 3.8508 7.6988 119.7310 64.2919 37.0200 178.3871 893 L 4.1899 8.1104 118.8842 57.9702 41.7844 178.9096 894 D 4.6519 8.9973 119.8463 57.5362 40.5922 178.4511 895 F 4.0685 8.3354 120.0122 61.1759 39.3598 176.2050 896 F 4.7294 8.1122 115.6893 56.4425 39.3666 174.7319 897 Y 4.2845 7.8668 121.5615 59.2155 38.7923 176.4781 898 G 3.7305 8.6426 115.5626 45.4548 0.0000 173.0171 899 Y 4.3979 8.4108 116.4710 57.0979 39.2401 175.9009 900 Q 3.7404 8.2168 118.0838 56.7411 26.1682 173.7997 901 V 3.1422 7.1557 113.8249 61.1289 32.1702 175.8101 902 I 3.8393 8.2440 124.8370 60.3382 37.1120 175.5659 903 P 4.3160 0.0000 0.0000 64.8311 31.2076 177.2118 904 G 4.0737 8.0441 106.7945 45.3297 0.0000 173.5804 905 S 4.5902 7.5819 112.6995 57.8365 63.8971 174.4599 906 V 3.9716 7.6220 121.9401 62.9993 32.0426 174.7925 907 C 5.0105 8.6255 121.3664 56.4271 33.1517 172.4403 908 L 4.8733 8.6018 120.6839 53.0222 43.7788 176.1761 909 K 4.5371 8.6075 122.5993 56.0290 33.9067 175.5067 910 Y 5.0086 8.3451 119.7665 56.1934 42.1241 175.7138 911 N 4.7398 8.6766 120.4143 52.1292 38.9922 175.1511 912 E 4.0577 8.6742 115.0173 59.1097 29.7778 177.4965 913 K 4.2695 8.1233 117.7871 56.0037 32.3347 175.7457 914 G 3.4744 7.8359 108.9169 44.9522 0.0000 171.1660 *916 P 3.7593 0.0000 0.0000 63.0377 32.6790 177.8481 917 T 4.0504 8.3085 111.0780 62.0798 69.3266 175.7406 918 G 3.8972 8.2976 111.0833 45.2706 0.0000 172.2871 919 E 5.0690 7.5274 117.3528 54.7890 33.0872 175.0116 920 A 4.8097 8.5754 123.1377 51.9550 24.0717 175.3218 *922 V 3.9558 8.4384 112.9052 63.3201 33.2743 175.5498 923 A 5.2387 8.4968 126.9187 50.1729 22.7449 174.9585 924 F 4.8965 8.7083 116.7260 55.4099 42.9732 176.1978 925 E 4.1751 8.4497 119.3915 58.9423 30.0793 177.4868 926 S 4.7942 7.9943 111.8650 55.3676 66.5990 175.0029 927 R 4.0364 8.4710 121.8182 59.1767 29.8425 178.1829 928 D 4.3384 8.0980 118.2202 57.5894 40.7544 178.6298 929 E 3.9337 8.2480 118.7318 59.1348 29.4562 179.1615 930 A 2.7834 7.7005 120.5004 55.1225 18.4385 179.7113 931 T 3.7311 7.9800 114.0715 66.7451 68.4689 176.6644 932 A 3.9868 8.0053 122.2601 55.0597 18.3456 179.4106 933 A 3.4588 8.0458 119.5710 55.2755 17.9955 179.9635 934 V 3.5644 7.7130 116.5987 66.1560 31.3121 178.3869 935 I 3.7372 7.6044 118.4310 64.6698 37.1294 177.9467 936 D 4.5012 8.1459 118.1003 56.1291 41.0837 177.7842 937 L 4.2845 7.8952 117.9401 53.3308 42.5424 175.9664 938 N 4.5822 7.1488 117.3131 55.1025 39.2459 174.5571 939 D 4.6852 9.1670 124.0545 54.6474 39.6028 174.6195 940 R 4.3143 7.9553 119.3170 55.0367 30.9611 174.0438 941 P 5.2263 0.0000 0.0000 61.8812 33.1965 175.5313 942 I 4.4609 8.1772 119.6059 60.2755 40.7204 175.2467 943 G 3.6216 8.5641 116.3953 47.0766 0.0000 173.9174 944 S 4.5170 8.6958 119.0335 58.4055 63.6589 174.0456 945 R 4.7055 7.8856 120.6562 54.4932 33.1953 175.0881 946 K 4.6561 8.4874 122.2194 55.4968 33.0133 176.9306 947 V 3.8622 8.5899 126.3426 62.7449 33.0567 174.7177 948 K 5.0194 8.9509 127.1074 54.8541 33.9760 175.2027 949 L 5.4007 9.4940 125.4971 53.1037 44.5779 176.2617 950 S 4.6636 8.8319 118.0998 56.3265 66.3981 174.2946 951 G 4.3237 9.0059 112.1514 45.4969 0.0000 170.9872 952 P 4.7674 0.0000 0.0000 62.3185 31.9541 176.4905 953 S 4.2590 8.4683 115.6803 58.5184 62.6615 173.4283 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 875 P 0.00 4.80 0.00 2.09 2.14 0.00 3.68 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 1.89 1.98 0.00 876 T 8.88 4.52 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 1.24 0.00 0.00 877 V 8.27 4.71 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 1.05 0.00 0.00 0.93 0.00 0.00 878 I 8.92 4.57 2.09 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.92 0.99 0.00 0.00 879 K 8.53 4.92 0.00 1.78 1.74 0.00 1.61 0.00 0.00 1.58 0.00 0.00 2.82 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.37 1.37 7.81 880 V 8.75 5.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.00 0.00 1.15 0.00 0.00 881 Q 8.52 4.86 0.00 1.99 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 5.63 0.00 0.00 0.00 0.00 0.00 2.26 2.13 0.00 882 N 8.74 4.21 0.00 2.82 2.97 0.00 0.00 6.98 7.69 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 *884 P 0.00 4.26 0.00 2.11 2.14 0.00 3.64 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 1.83 1.86 0.00 885 F 8.79 4.30 0.00 3.12 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 0.00 886 T 6.70 3.79 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.23 0.00 0.00 887 V 7.36 4.41 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 0.70 0.00 0.00 0.91 0.00 0.00 888 S 8.31 4.84 0.00 4.03 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 0.00 889 I 8.25 3.73 1.90 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.98 0.94 0.00 0.00 890 D 8.08 4.39 0.00 2.70 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 0.00 891 E 8.39 3.65 0.00 2.14 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 2.32 2.35 0.00 892 I 7.70 3.85 2.11 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.08 1.16 0.00 0.00 893 L 8.11 4.19 0.00 1.82 1.85 1.01 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 894 D 9.00 4.65 0.00 2.83 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 0.00 895 F 8.34 4.07 0.00 2.88 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 0.00 896 F 8.11 4.73 0.00 3.45 3.33 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 0.00 897 Y 7.87 4.28 0.00 3.05 2.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 898 G 8.64 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 0.00 0.00 0.00 899 Y 8.41 4.40 0.00 3.43 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 0.00 900 Q 8.22 3.74 0.00 2.49 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.07 7.09 0.00 0.00 0.00 0.00 0.00 2.44 2.38 0.00 901 V 7.16 3.14 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 0.69 0.00 0.00 0.07 0.00 0.00 902 I 8.24 3.84 1.72 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 1.24 0.85 0.00 0.00 903 P 0.00 4.32 0.00 2.15 2.20 0.00 3.43 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 1.98 2.08 0.00 904 G 8.04 4.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 905 S 7.58 4.59 0.00 3.76 3.87 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 0.00 906 V 7.62 3.97 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 0.83 0.00 0.00 0.91 0.00 0.00 907 C 8.63 5.01 0.00 3.01 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 0.00 908 L 8.60 4.87 0.00 1.62 1.33 0.96 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 909 K 8.61 4.54 0.00 1.64 1.69 0.00 1.59 0.00 0.00 1.64 0.00 0.00 2.85 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.44 1.40 7.81 910 Y 8.35 5.01 0.00 2.77 2.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 911 N 8.68 4.74 0.00 2.97 3.02 0.00 0.00 5.99 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 0.00 912 E 8.67 4.06 0.00 2.11 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 0.00 2.28 2.28 0.00 913 K 8.12 4.27 0.00 1.93 1.87 0.00 1.77 0.00 0.00 1.71 0.00 0.00 2.98 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.44 1.38 7.81 914 G 7.84 3.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *916 P 0.00 3.76 0.00 2.05 1.76 0.00 3.85 0.00 0.00 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 2.12 0.00 917 T 8.31 4.05 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 1.21 0.00 0.00 918 G 8.30 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 0.00 0.00 0.00 919 E 7.53 5.07 0.00 1.89 1.79 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 2.18 2.19 0.00 920 A 8.58 4.81 1.19 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 0.00 0.00 *922 V 8.44 3.96 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 0.05 0.00 0.00 0.81 0.00 0.00 923 A 8.50 5.24 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 0.00 924 F 8.71 4.90 0.00 2.93 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 0.00 925 E 8.45 4.18 0.00 2.12 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 2.37 2.43 0.00 926 S 7.99 4.79 0.00 4.07 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 0.00 927 R 8.47 4.04 0.00 1.91 1.96 0.00 3.23 0.00 0.00 3.30 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.58 0.00 928 D 8.10 4.34 0.00 2.75 2.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 929 E 8.25 3.93 0.00 2.09 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 2.35 2.33 0.00 930 A 7.70 2.78 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 0.00 931 T 7.98 3.73 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 1.19 0.00 0.00 932 A 8.01 3.99 1.45 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 0.00 0.00 0.00 0.00 0.00 0.00 933 A 8.05 3.46 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 0.00 934 V 7.71 3.56 2.17 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 1.03 0.00 0.00 0.95 0.00 0.00 935 I 7.60 3.74 1.99 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 1.52 0.79 0.91 0.00 0.00 936 D 8.15 4.50 0.00 2.51 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 0.00 937 L 7.90 4.28 0.00 1.59 1.04 0.12 0.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 938 N 7.15 4.58 0.00 2.92 2.74 0.00 0.00 7.23 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 0.00 939 D 9.17 4.69 0.00 2.87 2.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 940 R 7.96 4.31 0.00 2.05 1.83 0.00 2.92 0.00 0.00 3.15 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.56 0.00 941 P 0.00 5.23 0.00 2.35 2.05 0.00 3.75 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.99 0.00 942 I 8.18 4.46 1.69 0.00 0.00 0.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.57 0.81 0.00 0.00 943 G 8.56 3.62 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 0.00 944 S 8.70 4.52 0.00 3.98 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 0.00 945 R 7.89 4.71 0.00 1.72 1.88 0.00 3.11 0.00 0.00 3.21 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.55 0.00 946 K 8.49 4.66 0.00 1.64 1.91 0.00 1.75 0.00 0.00 1.63 0.00 0.00 2.87 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.42 1.43 7.81 947 V 8.59 3.86 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 0.70 0.00 0.00 0.50 0.00 0.00 948 K 8.95 5.02 0.00 1.69 1.71 0.00 1.70 0.00 0.00 1.71 0.00 0.00 2.81 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.36 1.54 7.81 949 L 9.49 5.40 0.00 1.53 1.69 1.23 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 950 S 8.83 4.66 0.00 3.76 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 0.00 951 G 9.01 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 0.00 952 P 0.00 4.77 0.00 2.10 2.09 0.00 3.31 0.00 0.00 3.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.80 0.00 953 S 8.47 4.26 0.00 3.81 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.