NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 901 N 4.4713 8.2827 118.1260 53.5007 39.8478 178.4458 902 Q 2.6942 8.6839 127.7855 58.6289 31.4059 175.0055 903 K 4.2784 8.1823 116.2833 58.8145 33.0451 178.3038 904 Q 4.4413 9.2927 120.4687 57.1326 28.9306 183.6001 905 I 4.0458 8.1934 118.9495 62.8303 36.7738 178.6340 906 A 4.1591 9.0013 131.1573 55.7478 19.3106 179.3522 907 N 4.3579 8.2033 115.4888 56.7660 38.7635 176.4247 908 Q 4.3048 9.4851 117.8312 56.9715 28.4569 177.3349 909 F 4.2953 7.8992 122.4863 60.3167 40.1918 178.3537 910 N 4.7705 8.4791 112.9581 53.6688 38.1448 175.8972 911 K 4.1671 8.9444 119.7439 57.7772 34.7617 178.3220 912 A 3.8583 7.3949 120.0389 55.6352 18.0041 179.7395 913 I 3.4903 7.1663 117.2900 64.4929 37.2478 178.4006 914 S 4.2659 7.9268 112.3351 61.0401 62.3868 175.9751 915 Q 4.0782 8.1920 121.1162 59.5031 28.6316 177.5417 916 I 3.5139 8.1025 119.6296 65.3626 36.8168 179.1274 917 Q 3.7769 8.7597 118.5032 58.5337 28.6009 179.9935 918 E 4.1156 8.2991 119.9204 59.1777 29.7077 179.0940 919 S 4.1133 8.4590 115.5992 61.6589 62.6251 176.8522 920 L 3.8406 7.7680 120.3471 57.8811 41.8410 179.2238 921 T 4.0223 7.4905 114.5026 66.8886 68.3265 176.7950 922 T 3.8627 8.1610 117.8278 66.9533 68.3950 176.6594 923 T 4.1692 8.1952 115.2885 65.2444 68.8366 174.7531 924 S 4.6518 7.6524 113.4808 58.5343 65.4644 174.4976 925 T 4.4051 8.8193 117.1028 63.3947 69.8613 174.9174 926 A 4.4686 7.8412 123.8116 53.9745 20.6375 178.7148 927 L 4.0117 8.2270 115.7448 58.3218 41.6322 180.3577 928 G 4.0255 8.0700 101.2643 46.1224 0.0000 173.9365 929 K 4.5247 8.9168 119.9773 55.7382 34.2726 177.6530 930 L 4.4143 8.0728 117.4501 54.6941 41.6901 176.8913 931 Q 4.4537 7.7041 119.4570 56.7697 31.1425 176.1950 932 D 4.5200 8.1043 115.0662 55.5630 41.7331 176.3226 933 V 4.2477 7.4019 116.2678 64.3634 33.3657 177.4117 934 V 3.6625 7.8031 118.3809 64.8537 30.1761 176.3580 935 N 4.8123 7.8389 115.7498 53.8022 39.4504 176.6866 936 Q 4.1014 8.3158 120.2392 59.0363 29.4178 177.1552 937 N 4.3780 8.2745 116.8216 56.3237 38.5859 177.3819 938 A 3.9408 7.4341 120.4668 55.6751 19.0334 178.6020 939 Q 3.7640 8.3515 116.5170 57.9663 28.6355 179.3163 940 A 3.8440 7.2930 120.1484 54.5459 19.5442 179.2478 941 L 4.0947 7.8130 118.7541 58.5956 42.1872 178.7931 942 N 4.2462 8.6691 116.4540 56.7037 38.3600 177.1048 943 T 3.8543 7.9322 113.0636 65.9854 67.4741 173.9512 944 L 4.0743 9.6549 123.7482 54.9837 41.5831 180.3418 945 V 3.1949 8.1440 120.7508 64.9182 33.2965 177.2810 946 K 3.9852 7.5268 117.5304 59.7121 31.9996 177.0965 947 Q 4.3304 8.0177 114.9816 56.3460 29.2289 176.3194 *1154 N 4.6611 7.7199 114.1243 53.0093 39.8397 174.3099 1155 A 4.4207 8.5453 123.5588 54.0523 18.2859 176.8600 1156 S 5.3259 7.9754 118.0917 59.3040 65.2715 177.3826 1157 V 4.1617 7.8582 118.1116 60.1303 33.1580 175.2435 1158 V 4.3642 7.8354 118.6261 61.1038 33.6820 174.1507 1159 N 4.9664 8.6925 124.3734 52.0382 41.0478 174.0804 1160 I 4.6714 7.9277 128.0578 59.5157 38.8106 176.5531 1161 Q 4.0597 8.3026 120.1651 57.8746 28.8011 177.1934 1162 E 3.9240 8.0756 120.2169 59.2810 29.7085 178.4945 1163 E 3.8812 8.0447 117.9910 59.5807 29.5421 179.0420 1164 I 3.7158 7.8080 117.3438 63.8324 37.6870 176.8725 1165 D 4.5865 7.9651 118.8855 56.1414 41.1615 178.2674 1166 R 3.8969 7.8754 119.3703 59.8276 30.1487 178.4523 1167 L 4.0076 7.8112 118.0635 57.8913 41.5135 179.1956 1168 N 4.3895 7.8423 115.7378 56.4148 38.9346 176.7181 1169 E 4.0846 8.1834 120.2346 58.7270 29.3883 178.1854 1170 V 4.0750 7.3399 115.0085 63.2672 31.5488 176.1235 1171 A 4.6727 7.2805 118.3065 52.4873 19.4405 177.5483 1172 K 4.4514 7.6580 117.6985 59.4871 35.6321 178.7771 1173 N 4.2670 8.1278 115.2622 55.7041 38.6133 176.6755 1174 L 4.2482 7.7687 116.4014 55.9258 42.2754 177.5285 1175 N 4.4591 8.7309 118.5179 56.6461 39.0238 176.1205 1176 E 4.4392 7.4563 117.6539 56.0704 29.2011 177.0352 1177 S 4.8688 7.8216 109.8507 58.2193 65.6281 175.5104 1178 L 4.8112 7.5178 122.6800 54.2549 40.9303 179.4187 1179 I 4.3251 8.0319 131.2276 62.1085 37.1121 173.2038 1180 D 4.4343 7.9822 119.0446 55.1440 43.9074 176.7665 1181 L 4.1235 8.2950 119.3063 55.4955 42.6624 175.9057 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 901 N 8.28 4.47 0.00 2.77 2.25 0.00 0.00 6.77 6.85 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 0.00 902 Q 8.68 2.69 0.00 2.27 2.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.04 6.92 0.00 0.00 0.00 0.00 0.00 2.38 2.49 0.00 903 K 8.18 4.28 0.00 1.77 1.86 0.00 1.79 0.00 0.00 1.75 0.00 0.00 3.11 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.45 1.50 7.81 904 Q 9.29 4.44 0.00 2.15 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.94 7.00 0.00 0.00 0.00 0.00 0.00 2.23 2.25 0.00 905 I 8.19 4.05 2.05 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 1.43 0.93 0.92 0.00 0.00 906 A 9.00 4.16 1.27 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 0.00 0.00 907 N 8.20 4.36 0.00 2.88 2.95 0.00 0.00 7.24 6.71 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 0.00 908 Q 9.49 4.30 0.00 2.31 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.41 0.00 0.00 0.00 0.00 0.00 2.40 2.66 0.00 909 F 7.90 4.30 0.00 3.14 3.35 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 0.00 910 N 8.48 4.77 0.00 3.01 2.89 0.00 0.00 6.88 8.05 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 0.00 911 K 8.94 4.17 0.00 1.79 1.74 0.00 1.71 0.00 0.00 1.75 0.00 0.00 2.91 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.33 1.42 7.81 912 A 7.39 3.86 1.08 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 0.00 913 I 7.17 3.49 1.64 0.00 0.00 -0.31 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 0.25 0.88 0.00 0.00 914 S 7.93 4.27 0.00 3.84 3.88 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 0.00 915 Q 8.19 4.08 0.00 2.35 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.44 0.00 0.00 0.00 0.00 0.00 2.42 2.50 0.00 916 I 8.10 3.51 1.95 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 1.76 0.73 0.87 0.00 0.00 917 Q 8.76 3.78 0.00 2.24 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.79 0.00 0.00 0.00 0.00 0.00 2.37 2.57 0.00 918 E 8.30 4.12 0.00 2.10 1.97 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 2.46 2.47 0.00 919 S 8.46 4.11 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 0.00 920 L 7.77 3.84 0.00 1.60 1.72 0.91 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 921 T 7.49 4.02 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 1.21 0.00 0.00 922 T 8.16 3.86 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 1.20 0.00 0.00 923 T 8.20 4.17 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 0.00 924 S 7.65 4.65 0.00 4.10 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 0.00 925 T 8.82 4.41 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 1.21 0.00 0.00 926 A 7.84 4.47 1.28 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 0.00 0.00 0.00 927 L 8.23 4.01 0.00 1.68 1.77 0.92 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 0.00 0.00 0.00 0.00 0.00 0.00 928 G 8.07 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 0.00 0.00 0.00 929 K 8.92 4.52 0.00 1.90 1.78 0.00 1.68 0.00 0.00 1.64 0.00 0.00 2.88 0.00 0.00 3.18 0.00 0.00 0.00 0.00 1.34 1.52 7.81 930 L 8.07 4.41 0.00 1.77 1.69 0.92 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 931 Q 7.70 4.45 0.00 2.02 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.95 6.95 0.00 0.00 0.00 0.00 0.00 2.30 2.53 0.00 932 D 8.10 4.52 0.00 2.88 2.67 0.00 0.00 0.00 0.00 0.00 0.00 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 V 7.40 4.25 2.32 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 1.00 0.00 0.00 0.96 0.00 0.00 934 V 7.80 3.66 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 0.94 0.00 0.00 1.01 0.00 0.00 935 N 7.84 4.81 0.00 2.95 2.81 0.00 0.00 6.45 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 936 Q 8.32 4.10 0.00 2.28 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.01 6.82 0.00 0.00 0.00 0.00 0.00 2.33 2.39 0.00 937 N 8.27 4.38 0.00 2.85 2.82 0.00 0.00 6.94 8.10 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 0.00 938 A 7.43 3.94 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 0.00 939 Q 8.35 3.76 0.00 2.28 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.42 0.00 0.00 0.00 0.00 0.00 2.36 2.53 0.00 940 A 7.29 3.84 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 941 L 7.81 4.09 0.00 1.80 1.87 0.92 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 942 N 8.67 4.25 0.00 2.88 2.85 0.00 0.00 6.71 7.06 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 0.00 943 T 7.93 3.85 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 1.32 0.00 0.00 944 L 9.65 4.07 0.00 1.69 1.73 0.92 0.83 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 0.00 945 V 8.14 3.19 2.22 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 0.84 0.00 0.00 0.94 0.00 0.00 946 K 7.53 3.99 0.00 1.98 1.85 0.00 1.84 0.00 0.00 1.70 0.00 0.00 3.11 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.46 1.52 7.81 947 Q 8.02 4.33 0.00 2.05 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.63 6.18 0.00 0.00 0.00 0.00 0.00 2.36 2.50 0.00 *1154 N 7.72 4.66 0.00 2.73 2.77 0.00 0.00 7.01 7.35 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 1155 A 8.55 4.42 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 1156 S 7.98 5.33 0.00 3.96 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 1157 V 7.86 4.16 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 0.68 0.00 0.00 0.93 0.00 0.00 1158 V 7.84 4.36 2.29 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 0.76 0.00 0.00 0.97 0.00 0.00 1159 N 8.69 4.97 0.00 2.66 2.64 0.00 0.00 6.82 7.94 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 1160 I 7.93 4.67 1.87 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 1.40 0.94 0.00 0.00 1161 Q 8.30 4.06 0.00 2.10 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.68 0.00 0.00 0.00 0.00 0.00 2.43 2.35 0.00 1162 E 8.08 3.92 0.00 2.03 1.94 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 2.38 2.40 0.00 1163 E 8.04 3.88 0.00 2.09 1.97 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 2.40 2.42 0.00 1164 I 7.81 3.72 1.93 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 0.74 1.02 0.00 0.00 1165 D 7.97 4.59 0.00 2.85 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 1166 R 7.88 3.90 0.00 2.23 1.97 0.00 3.10 0.00 0.00 3.17 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.69 0.00 1167 L 7.81 4.01 0.00 1.70 1.70 0.92 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 1168 N 7.84 4.39 0.00 3.07 2.85 0.00 0.00 7.19 7.53 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 1169 E 8.18 4.08 0.00 2.36 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 2.33 2.51 0.00 1170 V 7.34 4.08 2.23 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 0.81 0.00 0.00 0.99 0.00 0.00 1171 A 7.28 4.67 1.27 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 0.00 0.00 1172 K 7.66 4.45 0.00 2.01 1.76 0.00 1.68 0.00 0.00 1.65 0.00 0.00 2.88 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.35 1.39 7.81 1173 N 8.13 4.27 0.00 2.76 2.88 0.00 0.00 6.99 6.74 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 1174 L 7.77 4.25 0.00 1.64 1.72 0.94 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 1175 N 8.73 4.46 0.00 2.77 2.89 0.00 0.00 7.09 7.75 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 1176 E 7.46 4.44 0.00 2.12 1.93 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 2.33 2.43 0.00 1177 S 7.82 4.87 0.00 3.98 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 1178 L 7.52 4.81 0.00 1.66 0.90 0.95 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 1179 I 8.03 4.33 1.88 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 1.45 0.78 0.92 0.00 0.00 1180 D 7.98 4.43 0.00 2.57 2.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1181 L 8.29 4.12 0.00 1.57 1.49 0.92 0.80 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 * Residues marked with a * may have inaccurate shift predictions.