NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 875 P 4.5797 0.0000 0.0000 63.4331 31.8494 176.4448 876 T 4.4725 8.9631 110.9074 60.4658 71.5674 169.5742 877 V 4.8352 8.3400 119.9700 59.9520 34.4339 176.1077 878 I 4.7779 8.7119 116.8635 59.1012 40.9358 174.2870 879 K 4.8228 8.8782 123.6811 54.7197 34.8572 174.8037 880 V 4.9072 9.1533 126.0249 61.2909 34.3016 174.3488 881 Q 4.8368 8.8089 125.5254 55.1441 33.3726 170.9770 882 N 4.3108 8.2535 123.9692 52.8388 37.1655 171.8939 *884 P 4.2960 0.0000 0.0000 61.9139 32.6937 178.2862 885 F 4.3593 8.9041 119.5996 59.8520 39.0734 175.5718 886 T 4.5449 7.2937 108.1727 59.7496 69.3021 174.3040 887 V 4.6322 8.0360 125.1036 59.0098 34.7615 174.9010 888 S 4.7961 8.5099 116.8025 56.9511 66.2749 175.5118 889 I 3.7289 8.1640 123.4282 64.4122 36.8577 177.8696 890 D 4.4007 8.2154 118.5199 57.7431 40.9349 178.2390 891 E 4.0358 8.4673 118.9171 59.6136 29.2383 179.5354 892 I 3.8227 7.5425 118.4072 64.4790 37.5666 178.2399 893 L 4.4260 8.4523 120.1284 57.8432 41.4018 179.2984 894 D 4.4799 8.3908 119.0719 57.3905 40.5588 178.3783 895 F 4.0229 8.1902 120.1029 60.7460 39.4566 176.2117 896 F 4.8109 8.0047 114.7702 56.0817 39.0544 174.6457 897 Y 4.4697 7.5571 120.3775 59.8486 38.7480 176.7782 898 G 3.6579 8.7117 115.3360 45.0747 0.0000 172.6499 899 Y 4.5830 8.0608 116.6508 56.6322 38.7244 176.2607 900 Q 4.4775 9.3257 122.8913 54.7842 27.7587 173.7514 901 V 3.5721 7.8917 121.0168 62.1739 32.8441 175.2976 902 I 3.7487 8.6939 129.8632 60.7835 37.9653 174.0129 903 P 4.2123 0.0000 0.0000 64.4813 31.4820 176.7865 904 G 3.9127 8.8979 110.5001 45.8274 0.0000 173.8170 905 S 4.3466 7.6938 112.9312 58.0855 63.6024 174.4801 906 V 3.6630 7.5308 122.3649 62.8146 31.6749 174.6727 907 C 4.8053 8.3594 121.7755 55.9830 31.9136 173.0180 908 L 4.4941 8.5488 124.9428 54.4649 41.9000 176.7892 909 K 4.3664 8.6146 124.0971 56.2325 32.8902 176.0022 910 Y 4.5424 8.6074 121.8138 56.1538 40.8010 175.9324 911 N 4.7524 8.3820 119.9965 51.8176 39.7057 175.1281 912 E 3.9223 8.7496 116.5119 59.7456 29.4522 178.3177 913 K 4.1544 8.0547 115.2834 56.3264 32.6139 175.5771 914 G 3.5128 7.8713 109.0738 44.9141 0.0000 171.1857 *916 P 3.5749 0.0000 0.0000 63.1748 32.6150 177.3834 917 T 3.4608 7.1858 109.8711 60.4392 69.3579 174.4705 918 G 3.9656 7.8472 108.2617 46.4467 0.0000 172.3725 919 E 5.1533 7.4996 117.4680 54.4354 33.2710 174.5599 920 A 4.9039 8.5304 124.5136 51.7899 24.8451 175.3648 *922 V 3.8330 8.4566 113.4672 63.5209 33.2469 175.0658 923 A 5.0932 7.9951 128.3506 50.2268 21.6864 175.4826 924 F 5.1246 8.9453 119.1099 55.4883 42.5258 176.2668 925 E 4.1036 8.5418 120.1373 58.8916 29.9105 177.7337 926 S 4.8265 7.9639 111.8994 55.4993 66.4175 174.7537 927 R 4.0027 8.4634 122.5840 59.2669 29.9418 178.5872 928 D 4.3595 8.0595 118.2618 57.1998 40.7543 178.5022 929 E 3.8575 8.2904 118.9877 59.2111 29.5303 179.0297 930 A 2.8806 7.6735 120.6345 55.3583 18.4057 179.5446 931 T 3.7835 8.1155 114.2291 66.9348 68.0557 176.6308 932 A 3.9691 7.9079 121.8698 54.9897 18.4046 179.2571 933 A 3.5810 7.9332 119.5028 55.4166 18.5154 180.1386 934 V 3.5850 7.7607 116.4269 66.2199 31.3973 178.3946 935 I 3.8799 7.8431 118.9728 64.3912 37.0873 177.7817 936 D 4.5694 9.2579 119.1264 55.8934 41.1215 177.6975 937 L 4.3978 7.8191 117.7053 53.1803 42.4067 175.7390 938 N 4.5544 7.1917 117.7272 54.7970 39.3204 174.6102 939 D 4.7421 8.7895 123.2996 54.3960 41.2872 174.3987 940 R 4.2277 7.7988 117.4346 56.1121 30.7425 174.2196 941 P 5.7548 0.0000 0.0000 61.4411 33.1181 175.4992 942 I 4.5194 7.6630 119.0699 60.3639 40.7202 175.3237 943 G 3.8642 8.6808 115.0779 46.8836 0.0000 174.0315 944 S 4.6487 8.7153 120.4032 58.0375 63.6249 173.8249 945 R 4.6743 7.6916 120.3240 54.7168 32.5028 175.3718 946 K 4.6403 8.5351 122.8718 55.9076 33.0154 176.8475 947 V 4.1507 8.7193 125.7771 62.3209 33.3194 174.6333 948 K 5.0971 8.9900 126.1294 54.7059 34.3933 175.0743 949 L 5.3786 9.4270 125.7258 53.2291 43.9940 175.9358 950 S 4.5385 8.8898 116.1543 57.8991 67.1934 174.3314 951 G 4.2003 8.7116 107.1968 43.6899 0.0000 171.8575 952 P 4.8255 0.0000 0.0000 62.5030 31.4701 176.0578 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 4.58 0.00 2.10 2.19 0.00 3.73 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 1.90 1.98 0.00 876 T 8.96 4.47 4.29 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 1.27 0.00 0.00 877 V 8.34 4.84 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 0.91 0.00 0.00 0.94 0.00 0.00 878 I 8.71 4.78 2.14 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.81 1.10 0.00 0.00 879 K 8.88 4.82 0.00 1.85 1.70 0.00 1.56 0.00 0.00 1.57 0.00 0.00 2.82 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.35 1.35 7.81 880 V 9.15 4.91 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 0.85 0.00 0.00 1.13 0.00 0.00 881 Q 8.81 4.84 0.00 1.98 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 5.49 0.00 0.00 0.00 0.00 0.00 2.46 2.26 0.00 882 N 8.25 4.31 0.00 2.98 2.93 0.00 0.00 7.13 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 4.30 0.00 2.44 1.99 0.00 3.64 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.10 0.00 885 F 8.90 4.36 0.00 2.89 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 0.00 886 T 7.29 4.54 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 1.26 0.00 0.00 887 V 8.04 4.63 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 0.74 0.00 0.00 0.96 0.00 0.00 888 S 8.51 4.80 0.00 4.12 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 0.00 889 I 8.16 3.73 1.89 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 1.54 0.94 0.94 0.00 0.00 890 D 8.22 4.40 0.00 2.76 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 0.00 891 E 8.47 4.04 0.00 2.23 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 2.36 2.38 0.00 892 I 7.54 3.82 2.10 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 1.52 0.66 1.14 0.00 0.00 893 L 8.45 4.43 0.00 2.00 1.87 1.01 1.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 894 D 8.39 4.48 0.00 2.97 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 8.19 4.02 0.00 2.94 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 F 8.00 4.81 0.00 3.36 3.24 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 0.00 897 Y 7.56 4.47 0.00 3.06 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 0.00 898 G 8.71 3.66 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 0.00 0.00 0.00 899 Y 8.06 4.58 0.00 3.36 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 0.00 900 Q 9.33 4.48 0.00 2.18 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 7.00 0.00 0.00 0.00 0.00 0.00 2.37 2.32 0.00 901 V 7.89 3.57 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 0.53 0.00 0.00 0.69 0.00 0.00 902 I 8.69 3.75 1.85 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 1.30 0.62 0.86 0.00 0.00 903 P 0.00 4.21 0.00 2.02 2.03 0.00 3.72 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.12 0.00 904 G 8.90 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 0.00 905 S 7.69 4.35 0.00 3.91 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 0.00 906 V 7.53 3.66 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 0.83 0.00 0.00 0.88 0.00 0.00 907 C 8.36 4.81 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 8.55 4.49 0.00 1.58 1.45 0.91 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 909 K 8.61 4.37 0.00 1.65 1.68 0.00 1.64 0.00 0.00 1.67 0.00 0.00 2.88 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.45 1.39 7.81 910 Y 8.61 4.54 0.00 2.80 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 0.00 911 N 8.38 4.75 0.00 2.94 2.94 0.00 0.00 6.21 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 8.75 3.92 0.00 1.97 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 0.00 2.32 2.41 0.00 913 K 8.05 4.15 0.00 1.92 1.86 0.00 1.78 0.00 0.00 1.72 0.00 0.00 3.01 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.47 1.39 7.81 914 G 7.87 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 *916 P 0.00 3.57 0.00 1.80 1.80 0.00 3.70 0.00 0.00 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.91 0.00 917 T 7.19 3.46 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 1.04 0.00 0.00 918 G 7.85 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 0.00 919 E 7.50 5.15 0.00 1.79 1.76 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 2.24 2.34 0.00 920 A 8.53 4.90 1.13 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 0.00 0.00 *922 V 8.46 3.83 1.69 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 0.09 0.00 0.00 0.80 0.00 0.00 923 A 8.00 5.09 1.13 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 0.00 0.00 924 F 8.95 5.12 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 8.54 4.10 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 2.37 2.29 0.00 926 S 7.96 4.83 0.00 3.96 3.94 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 0.00 927 R 8.46 4.00 0.00 1.91 1.97 0.00 3.24 0.00 0.00 3.31 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.58 0.00 928 D 8.06 4.36 0.00 2.71 2.68 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 0.00 929 E 8.29 3.86 0.00 2.19 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 2.33 2.53 0.00 930 A 7.67 2.88 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 0.00 931 T 8.12 3.78 4.38 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 1.20 0.00 0.00 932 A 7.91 3.97 1.47 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 0.00 933 A 7.93 3.58 1.10 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 0.00 934 V 7.76 3.59 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 1.05 0.00 0.00 1.00 0.00 0.00 935 I 7.84 3.88 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 1.53 0.75 0.92 0.00 0.00 936 D 9.26 4.57 0.00 2.71 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 0.00 937 L 7.82 4.40 0.00 1.64 1.21 0.25 0.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 0.00 0.00 0.00 0.00 938 N 7.19 4.55 0.00 2.97 2.74 0.00 0.00 7.13 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 8.79 4.74 0.00 2.90 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 0.00 940 R 7.80 4.23 0.00 2.07 1.80 0.00 2.77 0.00 0.00 3.05 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.59 0.00 941 P 0.00 5.75 0.00 2.39 2.07 0.00 3.35 0.00 0.00 4.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.96 0.00 942 I 7.66 4.52 1.74 0.00 0.00 0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.65 0.85 0.00 0.00 943 G 8.68 3.86 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 0.00 0.00 0.00 944 S 8.72 4.65 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 0.00 945 R 7.69 4.67 0.00 1.83 2.05 0.00 3.07 0.00 0.00 3.28 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.56 0.00 946 K 8.54 4.64 0.00 1.65 2.03 0.00 1.88 0.00 0.00 1.64 0.00 0.00 2.90 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.44 1.44 7.81 947 V 8.72 4.15 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 0.64 0.00 0.00 0.70 0.00 0.00 948 K 8.99 5.10 0.00 1.71 1.70 0.00 1.69 0.00 0.00 1.66 0.00 0.00 2.81 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.36 1.54 7.81 949 L 9.43 5.38 0.00 1.52 1.67 0.99 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 950 S 8.89 4.54 0.00 3.89 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 0.00 951 G 8.71 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 0.00 0.00 0.00 0.00 952 P 0.00 4.83 0.00 2.22 2.22 0.00 3.42 0.00 0.00 4.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.94 0.00 * Residues marked with a * may have inaccurate shift predictions.