NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 875 P 5.0476 0.0000 0.0000 63.2475 32.5427 174.5242 876 T 4.3672 8.2578 121.0154 59.4534 68.4373 167.6459 877 V 4.6037 8.3101 129.6913 62.2939 33.5203 174.2466 878 I 4.8149 9.2614 121.4625 59.0238 40.9590 174.2225 879 K 4.7565 8.6994 123.5949 54.7549 34.4049 174.9131 880 V 4.9168 8.9320 126.8435 61.3340 34.5661 174.2966 881 Q 4.9503 8.9382 125.5972 54.2606 33.7858 171.0467 882 N 4.1210 8.0379 125.0794 52.6652 39.1475 171.6468 *884 P 4.2133 0.0000 0.0000 62.8042 32.4827 177.7838 885 F 3.8684 8.3704 123.0917 61.8773 40.2525 176.3408 886 T 4.1183 7.8875 112.3819 61.8971 67.1502 174.8323 887 V 3.8726 7.5962 120.2108 62.0270 31.9555 176.1413 888 S 4.7723 8.2926 116.7713 56.5447 66.6429 175.4706 889 I 3.7501 8.0908 122.2948 64.6449 36.7929 178.4317 890 D 4.3932 8.0757 119.3120 57.4127 40.6171 178.5098 891 E 4.0539 8.1557 118.7101 59.2566 29.5240 179.5490 892 I 3.7262 7.5773 119.5493 64.4511 37.0336 178.3669 893 L 4.2369 8.1247 118.8857 58.0362 41.7361 178.8569 894 D 4.5538 8.4529 117.9818 57.0683 40.9459 177.9113 895 F 4.1031 8.3930 120.8231 60.8031 39.4633 176.0609 896 F 5.0342 7.9929 115.4370 56.3440 38.9364 174.6882 897 Y 4.6077 7.6640 121.4211 59.1278 38.8193 176.3066 898 G 3.6053 8.4528 114.2641 45.2115 0.0000 172.5705 899 Y 4.6449 7.5540 115.8309 56.2729 41.6082 176.2860 900 Q 4.4528 8.6446 122.2374 54.6824 27.4879 176.3320 901 V 3.3306 7.4728 117.9428 60.9913 32.7845 176.9285 902 I 3.8006 8.4445 126.2966 60.3306 37.0979 174.9792 903 P 4.2326 0.0000 0.0000 65.2679 30.8372 177.1663 904 G 4.0995 7.9816 105.9105 45.2036 0.0000 173.6321 905 S 4.5200 7.7155 112.9649 57.4625 63.6818 174.4650 906 V 3.7502 7.5691 122.0990 62.9041 31.5971 174.6706 907 C 4.8854 8.4306 120.5699 56.2715 32.3051 172.3827 908 L 4.7061 8.4153 122.6100 53.2159 43.1034 176.2893 909 K 4.4156 8.6139 122.9896 56.2070 33.5785 175.5986 910 Y 4.8899 8.3991 120.4096 56.0828 41.8443 175.3153 911 N 4.7975 8.7109 120.3646 51.4097 39.1455 175.5882 912 E 4.1761 8.6808 115.5959 59.2585 29.3824 178.1199 913 K 4.1001 7.9786 116.7471 56.9579 32.6579 176.1450 914 G 3.5370 8.1902 107.9248 44.9369 0.0000 170.8985 *916 P 3.5515 0.0000 0.0000 63.0125 32.6729 177.6575 917 T 4.2135 8.1688 111.1062 61.3946 68.5143 175.7139 918 G 3.8886 8.1595 111.0004 45.3868 0.0000 172.3392 919 E 5.0736 7.5928 118.3208 54.4526 32.7470 174.5897 920 A 4.5807 8.5584 125.2360 51.2385 24.3212 175.6492 *922 V 4.0143 8.4748 114.2151 63.7619 33.3582 174.8785 923 A 5.2547 7.9520 125.8408 50.2009 23.1290 174.8001 924 F 5.0838 8.6067 116.0626 55.4164 43.0673 176.1930 925 E 4.2330 9.1945 120.7661 59.4176 29.8440 177.7146 926 S 4.6957 7.9312 111.5446 55.4122 66.3982 174.7041 927 R 3.8559 8.6136 120.7415 59.7599 29.6753 178.4442 928 D 4.3859 8.0121 118.3204 57.1091 40.9428 178.3368 929 E 3.9978 7.9049 119.1934 58.9102 29.4170 178.8961 930 A 2.6813 7.9307 121.0166 55.2503 18.3622 179.8865 931 T 3.6966 7.8070 113.8039 66.7111 68.4232 176.9346 932 A 3.9893 7.8336 122.0705 54.7672 18.3642 179.5944 933 A 3.0713 7.5427 119.2977 54.9635 18.2898 179.9452 934 V 3.5232 7.7142 116.8587 66.1999 31.3960 178.1918 935 I 3.6589 7.6891 118.2496 64.7413 37.1126 177.9468 936 D 4.5313 8.6668 118.7303 56.1402 41.0556 177.3260 937 L 4.3498 8.2115 118.0188 54.3865 42.6739 176.0801 938 N 4.5417 7.5803 117.8737 55.0158 39.2369 174.9188 939 D 4.8400 9.0211 123.5810 54.6966 40.6508 175.1369 940 R 4.1464 7.9884 118.5742 55.7543 30.6783 173.7276 941 P 5.3638 0.0000 0.0000 61.6443 33.1890 174.1330 942 I 4.4449 8.2508 118.9692 62.2275 40.7456 177.1667 943 G 3.6831 8.4268 105.9268 45.9192 0.0000 173.6354 944 S 4.6371 9.3637 112.3917 57.7433 63.5938 171.9786 945 R 4.8158 7.6403 118.3726 54.2501 32.6027 174.9306 946 K 4.7877 8.5682 122.9455 56.0590 34.1771 176.2768 947 V 4.1517 9.0850 124.7387 62.1428 33.3214 174.5195 948 K 4.9534 8.7234 127.0383 55.0044 33.8194 175.4040 949 L 5.3454 9.1844 125.2839 53.3629 44.4466 175.9028 950 S 4.5366 8.8053 116.8697 58.0027 68.1244 174.6014 951 G 3.9656 8.6609 107.6115 43.7751 0.0000 171.0457 952 P 4.5590 0.0000 0.0000 63.1591 32.3938 176.1725 953 S 4.2681 7.8609 109.6930 58.7109 63.7966 168.7913 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 5.05 0.00 2.10 2.19 0.00 3.31 0.00 0.00 4.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 1.82 0.00 876 T 8.26 4.37 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 1.30 0.00 0.00 877 V 8.31 4.60 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 0.95 0.00 0.00 0.93 0.00 0.00 878 I 9.26 4.81 2.11 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.94 0.99 0.00 0.00 879 K 8.70 4.76 0.00 1.87 1.70 0.00 1.57 0.00 0.00 1.58 0.00 0.00 2.81 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.36 1.36 7.81 880 V 8.93 4.92 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 0.87 0.00 0.00 1.11 0.00 0.00 881 Q 8.94 4.95 0.00 1.92 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 5.91 0.00 0.00 0.00 0.00 0.00 2.41 2.26 0.00 882 N 8.04 4.12 0.00 2.98 2.92 0.00 0.00 7.17 7.57 0.00 0.00 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 4.21 0.00 2.32 2.22 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 1.96 1.96 0.00 885 F 8.37 3.87 0.00 2.96 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 0.00 886 T 7.89 4.12 4.34 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 1.24 0.00 0.00 887 V 7.60 3.87 2.16 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 0.72 0.00 0.00 0.88 0.00 0.00 888 S 8.29 4.77 0.00 4.02 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 0.00 889 I 8.09 3.75 1.88 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 1.65 0.97 0.93 0.00 0.00 890 D 8.08 4.39 0.00 2.77 2.72 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 0.00 891 E 8.16 4.05 0.00 2.22 2.01 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 2.34 2.36 0.00 892 I 7.58 3.73 2.08 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 1.48 1.22 1.13 0.00 0.00 893 L 8.12 4.24 0.00 1.85 1.86 0.96 1.09 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 0.00 894 D 8.45 4.55 0.00 2.82 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 0.00 895 F 8.39 4.10 0.00 2.95 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 0.00 896 F 7.99 5.03 0.00 3.63 3.29 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 0.00 897 Y 7.66 4.61 0.00 3.00 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 0.00 898 G 8.45 3.61 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 0.00 0.00 0.00 0.00 0.00 0.00 899 Y 7.55 4.64 0.00 3.32 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 0.00 900 Q 8.64 4.45 0.00 2.26 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 7.00 0.00 0.00 0.00 0.00 0.00 2.35 2.30 0.00 901 V 7.47 3.33 1.66 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 0.78 0.00 0.00 0.58 0.00 0.00 902 I 8.44 3.80 1.76 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 1.60 0.44 0.87 0.00 0.00 903 P 0.00 4.23 0.00 2.17 2.23 0.00 3.70 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 2.00 0.00 904 G 7.98 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 0.00 0.00 0.00 905 S 7.72 4.52 0.00 3.92 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 0.00 906 V 7.57 3.75 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 0.84 0.00 0.00 0.92 0.00 0.00 907 C 8.43 4.89 0.00 3.11 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 0.00 908 L 8.42 4.71 0.00 1.58 1.34 0.88 0.92 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 0.00 909 K 8.61 4.42 0.00 1.63 1.68 0.00 1.58 0.00 0.00 1.64 0.00 0.00 2.82 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.43 1.38 7.81 910 Y 8.40 4.89 0.00 2.83 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 0.00 911 N 8.71 4.80 0.00 2.98 3.01 0.00 0.00 5.91 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 8.68 4.18 0.00 2.11 2.16 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 2.30 2.37 0.00 913 K 7.98 4.10 0.00 2.06 1.94 0.00 1.76 0.00 0.00 1.73 0.00 0.00 3.01 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.50 1.56 7.81 914 G 8.19 3.54 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 0.00 0.00 0.00 *916 P 0.00 3.55 0.00 1.87 1.68 0.00 3.80 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 1.60 0.00 917 T 8.17 4.21 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 1.20 0.00 0.00 918 G 8.16 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 0.00 919 E 7.59 5.07 0.00 1.85 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 2.19 2.19 0.00 920 A 8.56 4.58 1.14 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 *922 V 8.47 4.01 1.78 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 0.43 0.00 0.00 0.95 0.00 0.00 923 A 7.95 5.25 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 8.61 5.08 0.00 2.99 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 0.00 925 E 9.19 4.23 0.00 1.90 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 0.00 2.67 2.46 0.00 926 S 7.93 4.70 0.00 3.95 3.92 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 0.00 927 R 8.61 3.86 0.00 1.90 1.97 0.00 3.18 0.00 0.00 3.33 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.71 0.00 928 D 8.01 4.39 0.00 2.72 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 0.00 929 E 7.90 4.00 0.00 2.19 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 0.00 2.36 2.55 0.00 930 A 7.93 2.68 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 0.00 931 T 7.81 3.70 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 1.18 0.00 0.00 932 A 7.83 3.99 1.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.54 3.07 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 934 V 7.71 3.52 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 1.08 0.00 0.00 0.99 0.00 0.00 935 I 7.69 3.66 2.03 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 1.51 0.86 0.91 0.00 0.00 936 D 8.67 4.53 0.00 2.60 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 0.00 937 L 8.21 4.35 0.00 1.86 1.57 0.51 -0.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 938 N 7.58 4.54 0.00 2.80 2.75 0.00 0.00 7.24 9.28 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 0.00 939 D 9.02 4.84 0.00 2.91 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 0.00 940 R 7.99 4.15 0.00 2.31 1.95 0.00 3.25 0.00 0.00 3.25 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 1.51 0.00 941 P 0.00 5.36 0.00 2.20 2.06 0.00 3.77 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 1.94 1.99 0.00 942 I 8.25 4.44 1.79 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 1.26 0.64 0.88 0.00 0.00 943 G 8.43 3.68 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 0.00 0.00 0.00 944 S 9.36 4.64 0.00 3.83 3.84 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 0.00 945 R 7.64 4.82 0.00 1.77 1.96 0.00 3.18 0.00 0.00 3.48 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.59 0.00 946 K 8.57 4.79 0.00 2.00 1.82 0.00 1.68 0.00 0.00 1.64 0.00 0.00 2.89 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.37 1.44 7.81 947 V 9.08 4.15 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 0.71 0.00 0.00 948 K 8.72 4.95 0.00 1.80 1.71 0.00 1.56 0.00 0.00 1.64 0.00 0.00 2.89 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.38 1.45 7.81 949 L 9.18 5.35 0.00 1.54 1.65 1.25 0.89 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 0.00 950 S 8.81 4.54 0.00 3.76 3.70 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 0.00 951 G 8.66 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 0.00 952 P 0.00 4.56 0.00 2.19 2.09 0.00 3.79 0.00 0.00 3.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.91 0.00 953 S 7.86 4.27 0.00 4.02 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 * Residues marked with a * may have inaccurate shift predictions.