NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 7 E 4.3125 8.2876 121.4717 56.0019 31.8626 177.1469 8 K 3.9925 7.9496 117.1046 58.2139 32.4702 174.4339 9 E 4.3631 8.8899 119.6081 57.1188 30.2483 178.7155 10 L 4.4463 7.5343 119.6606 56.1006 42.5211 178.3835 11 F 4.1215 8.2303 117.6718 59.7597 38.7384 177.8308 12 E 4.1401 8.0577 116.4611 56.6391 29.3343 178.5762 *14 L 4.3622 7.8019 116.9109 54.4817 43.8899 178.4009 15 D 4.3094 8.3906 117.7164 57.6959 40.9829 178.1086 16 E 3.9590 7.8694 119.0522 59.4507 29.4971 178.5831 17 D 4.5145 7.9198 119.8306 56.6851 41.0264 178.7349 18 V 3.5556 8.0058 118.9696 65.8039 31.5104 178.2627 19 R 3.8950 8.0147 117.9687 59.3188 29.9686 178.6229 20 E 3.9302 8.3490 119.2415 58.9604 29.5192 178.5034 21 L 3.9030 8.1322 120.6164 58.1404 42.1624 178.6389 22 L 3.8283 7.7575 118.7834 58.2527 41.5503 179.6666 23 S 4.0992 8.0390 114.5572 61.7354 62.7282 177.0623 24 L 3.9701 7.8976 121.3463 57.8959 41.3769 179.4209 25 I 3.6972 7.8677 119.8686 64.7629 37.0146 178.2275 26 H 4.2740 8.1705 116.8300 59.0370 28.5121 177.7749 27 E 4.0100 8.4864 120.6039 59.5368 29.3157 179.5311 28 I 3.7079 8.4622 120.2146 63.9826 37.0871 178.3412 29 K 3.8938 8.2629 120.6061 59.6681 32.0131 178.6102 30 I 3.6804 7.7155 119.9601 64.7944 37.0179 177.9755 31 D 4.3686 8.3863 119.6001 57.4147 40.3873 179.2220 32 R 3.8941 7.7341 117.3876 59.4147 30.2328 178.6498 33 I 3.8581 7.4482 118.3053 64.7807 37.2510 178.2940 34 T 4.1328 8.1140 108.9232 62.4546 68.9050 175.8889 35 G 3.9937 8.0263 109.1093 45.5128 0.0000 173.7672 36 N 4.1549 8.0597 118.5441 54.9303 37.3596 175.5070 *38 D 4.5973 8.9575 129.3212 53.3088 42.5777 178.3792 39 K 3.8216 8.1549 121.1335 59.6995 32.1399 177.8400 40 Q 3.9800 8.0779 119.0469 59.3868 28.9768 178.3732 41 K 4.0206 8.0504 118.8154 59.3036 32.0830 178.8002 42 L 4.0702 8.5557 121.1313 58.2696 42.0220 179.3904 43 G 3.6463 8.4204 105.8021 47.5364 0.0000 175.5473 44 K 4.1462 8.6297 122.2636 59.3554 32.1919 178.5967 45 A 4.0065 8.4532 121.4464 55.3098 18.2976 178.6169 46 Y 3.7926 8.1174 117.9952 61.2249 38.7093 178.8276 47 F 4.2856 8.2896 118.2784 60.2686 38.9817 177.3727 48 Q 3.9703 8.5800 119.9416 59.2827 28.7163 178.5512 49 V 3.5440 7.8156 119.0879 66.1508 31.4673 177.6133 50 Q 3.8405 7.4501 117.0577 59.1845 28.6390 179.3751 51 K 3.8839 8.3977 120.4987 59.6881 32.0330 178.8417 52 I 3.7706 7.9732 120.3927 63.9726 37.0468 178.0447 53 E 3.8772 8.1019 118.7806 59.3642 29.3115 178.6539 54 A 4.0837 8.1686 120.9061 55.6013 18.1048 179.3882 55 E 3.8874 8.2714 116.5031 59.5930 29.5780 179.4325 56 L 3.9508 8.0407 118.9565 58.1031 41.5327 178.8260 57 Y 4.2494 8.3468 118.0547 61.2743 39.1171 177.4662 58 Q 3.7884 8.3523 120.2116 59.6451 28.8641 177.7169 59 L 4.2496 8.1254 119.3945 56.0258 42.4409 178.5533 60 I 3.8964 7.7317 120.0834 65.0839 37.0110 178.2648 61 K 3.7389 7.4907 117.8159 59.3444 31.9053 178.5392 62 V 3.8788 7.5782 114.6402 62.3540 31.7512 176.3356 63 S 4.4079 7.7513 116.0549 60.4378 63.0499 173.4766 64 H 4.5076 7.7442 118.5882 55.7145 28.5970 174.7630 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 7 E 8.29 4.31 0.00 2.06 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 2.28 2.38 0.00 8 K 7.95 3.99 0.00 2.05 2.02 0.00 1.56 0.00 0.00 1.82 0.00 0.00 2.95 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.49 1.54 7.81 9 E 8.89 4.36 0.00 1.98 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 2.33 2.41 0.00 10 L 7.53 4.45 0.00 1.85 1.76 0.93 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 11 F 8.23 4.12 0.00 3.17 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 12 E 8.06 4.14 0.00 2.17 1.95 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 2.33 2.42 0.00 *14 L 7.80 4.36 0.00 1.63 1.52 0.28 0.99 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 15 D 8.39 4.31 0.00 2.90 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 16 E 7.87 3.96 0.00 2.22 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 2.31 2.36 0.00 17 D 7.92 4.51 0.00 2.90 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 18 V 8.01 3.56 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 1.01 0.00 0.00 0.91 0.00 0.00 19 R 8.01 3.90 0.00 2.06 1.96 0.00 3.19 0.00 0.00 3.10 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.85 0.00 20 E 8.35 3.93 0.00 2.13 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.36 0.00 21 L 8.13 3.90 0.00 1.93 1.74 0.88 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 22 L 7.76 3.83 0.00 1.93 1.62 0.94 0.80 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 23 S 8.04 4.10 0.00 4.01 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 24 L 7.90 3.97 0.00 1.87 1.72 0.97 0.61 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 25 I 7.87 3.70 1.92 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 1.77 0.80 0.93 0.00 0.00 26 H 8.17 4.27 0.00 3.34 3.32 0.00 5.62 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27 E 8.49 4.01 0.00 2.01 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 2.35 2.49 0.00 28 I 8.46 3.71 1.94 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 1.42 1.00 0.92 0.00 0.00 29 K 8.26 3.89 0.00 1.96 2.01 0.00 1.55 0.00 0.00 1.65 0.00 0.00 3.03 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.45 1.54 7.81 30 I 7.72 3.68 2.03 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 1.76 0.77 0.92 0.00 0.00 31 D 8.39 4.37 0.00 2.84 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 32 R 7.73 3.89 0.00 1.93 1.99 0.00 3.35 0.00 0.00 3.39 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 1.82 0.00 33 I 7.45 3.86 1.98 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 1.58 0.47 0.91 0.00 0.00 34 T 8.11 4.13 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 1.29 0.00 0.00 35 G 8.03 3.99 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 0.00 0.00 0.00 36 N 8.06 4.15 0.00 2.71 2.62 0.00 0.00 6.88 7.91 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 *38 D 8.96 4.60 0.00 2.86 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 39 K 8.15 3.82 0.00 1.85 1.86 0.00 1.74 0.00 0.00 1.75 0.00 0.00 2.94 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.51 1.51 7.81 40 Q 8.08 3.98 0.00 2.14 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.43 6.67 0.00 0.00 0.00 0.00 0.00 2.46 2.42 0.00 41 K 8.05 4.02 0.00 1.98 1.87 0.00 1.75 0.00 0.00 1.76 0.00 0.00 2.90 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.55 1.52 7.81 42 L 8.56 4.07 0.00 1.92 1.86 0.94 1.09 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 43 G 8.42 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 K 8.63 4.15 0.00 1.94 2.07 0.00 1.69 0.00 0.00 1.69 0.00 0.00 3.13 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.51 1.54 7.81 45 A 8.45 4.01 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 46 Y 8.12 3.79 0.00 3.00 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 47 F 8.29 4.29 0.00 3.45 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 48 Q 8.58 3.97 0.00 2.28 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.12 6.79 0.00 0.00 0.00 0.00 0.00 2.36 2.41 0.00 49 V 7.82 3.54 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 0.89 0.00 0.00 0.86 0.00 0.00 50 Q 7.45 3.84 0.00 2.23 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.54 0.00 0.00 0.00 0.00 0.00 1.86 2.42 0.00 51 K 8.40 3.88 0.00 1.92 2.02 0.00 1.65 0.00 0.00 1.79 0.00 0.00 2.98 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.56 1.51 7.81 52 I 7.97 3.77 1.98 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.49 0.85 0.00 0.00 53 E 8.10 3.88 0.00 2.13 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 2.34 2.31 0.00 54 A 8.17 4.08 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 E 8.27 3.89 0.00 1.96 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 2.53 2.45 0.00 56 L 8.04 3.95 0.00 1.96 1.75 0.82 0.97 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 57 Y 8.35 4.25 0.00 2.77 3.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 Q 8.35 3.79 0.00 2.38 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.70 0.00 0.00 0.00 0.00 0.00 2.35 2.39 0.00 59 L 8.13 4.25 0.00 1.64 1.81 1.19 1.20 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 60 I 7.73 3.90 2.09 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.41 0.93 0.00 0.00 61 K 7.49 3.74 0.00 1.69 1.76 0.00 1.52 0.00 0.00 1.36 0.00 0.00 3.09 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.38 1.47 7.81 62 V 7.58 3.88 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 0.68 0.00 0.00 0.91 0.00 0.00 63 S 7.75 4.41 0.00 4.09 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 64 H 7.74 4.51 0.00 3.27 3.28 0.00 5.63 0.00 0.00 0.00 0.00 6.91 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.