NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 G 3.8436 8.2133 109.7263 45.0027 0.0000 174.8358 3 K 3.7725 8.4782 117.6610 56.6699 31.6402 176.0685 4 G 3.9078 8.9339 106.5406 44.5995 0.0000 172.2519 5 D 4.5293 7.9385 120.1440 53.0766 41.2312 176.4050 6 R 4.1184 8.6516 126.2596 58.2934 30.3727 177.2844 7 R 4.2464 7.4772 117.4934 55.0805 30.5380 175.9951 8 T 4.7265 7.2939 106.4626 59.5830 73.2810 171.8890 9 R 4.0030 8.9616 120.5033 59.1723 29.4932 177.7865 10 R 4.0477 8.4936 119.7364 59.5412 30.5636 178.4166 11 G 4.2466 7.9740 106.7936 47.1988 0.0000 175.3979 12 K 3.9652 9.2725 123.6505 59.4917 32.2004 178.0903 13 I 3.6699 8.4700 120.4820 62.8052 36.5524 177.8457 14 W 4.1831 8.0768 132.5351 60.9967 31.1432 178.2543 15 R 3.6893 7.6610 117.7956 57.1286 30.9156 176.4775 16 G 3.5841 9.6412 106.3379 44.3998 0.0000 171.0415 17 T 3.9322 6.6731 106.6788 62.0589 72.4729 171.8087 18 Y 4.8886 8.9948 118.3141 56.2532 42.3437 174.2477 19 G 3.9763 9.0889 106.8905 46.0719 0.0000 172.2877 20 K 3.7025 8.9066 120.1597 60.1149 31.8001 178.1066 21 Y 4.2382 8.1326 111.8949 58.8624 38.3698 176.5017 22 R 4.8423 8.1883 118.4379 55.2990 33.0417 173.7929 23 P 5.1048 0.0000 0.0000 61.6275 31.6321 179.6041 24 R 4.3582 7.9824 117.1055 55.9876 30.9394 174.0993 25 K 3.6669 7.7202 123.6286 55.9499 32.9525 175.8203 *26 K 4.1330 8.3831 119.9585 54.7703 32.3269 172.6728 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 2 G 8.21 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 0.00 0.00 0.00 3 K 8.48 3.77 0.00 1.34 1.25 0.00 1.60 0.00 0.00 1.65 0.00 0.00 2.79 0.00 0.00 2.65 0.00 0.00 0.00 0.00 1.35 1.34 7.81 4 G 8.93 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 5 D 7.94 4.53 0.00 2.59 2.54 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 6 R 8.65 4.12 0.00 1.82 1.98 0.00 3.24 0.00 0.00 3.25 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.69 0.00 7 R 7.48 4.25 0.00 1.35 0.74 0.00 2.89 0.00 0.00 3.04 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 1.34 0.00 8 T 7.29 4.73 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 1.14 0.00 0.00 9 R 8.96 4.00 0.00 2.00 1.82 0.00 3.29 0.00 0.00 3.39 8.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.83 0.00 10 R 8.49 4.05 0.00 1.90 2.00 0.00 3.19 0.00 0.00 3.34 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.74 0.00 11 G 7.97 4.25 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 0.00 0.00 0.00 12 K 9.27 3.97 0.00 1.92 1.99 0.00 1.65 0.00 0.00 1.66 0.00 0.00 3.22 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.48 1.61 7.81 13 I 8.47 3.67 1.94 0.00 0.00 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 1.41 1.02 0.92 0.00 0.00 14 W 8.08 4.18 0.00 3.26 3.45 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 15 R 7.66 3.69 0.00 2.01 2.12 0.00 3.38 0.00 0.00 3.35 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.61 0.00 16 G 9.64 3.58 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 T 6.67 3.93 4.23 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 0.00 0.00 0.00 1.19 0.00 0.00 18 Y 8.99 4.89 0.00 2.90 3.28 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 19 G 9.09 3.98 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 0.00 0.00 0.00 0.00 0.00 0.00 20 K 8.91 3.70 0.00 1.74 2.00 0.00 1.74 0.00 0.00 1.74 0.00 0.00 2.36 0.00 0.00 2.83 0.00 0.00 0.00 0.00 0.83 1.30 7.81 21 Y 8.13 4.24 0.00 3.02 3.04 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 0.00 0.00 0.00 22 R 8.19 4.84 0.00 1.84 1.85 0.00 3.07 0.00 0.00 3.26 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.65 0.00 23 P 0.00 5.10 0.00 2.08 1.75 0.00 3.75 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.34 0.00 24 R 7.98 4.36 0.00 1.47 1.18 0.00 2.94 0.00 0.00 2.25 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 1.40 0.00 25 K 7.72 3.67 0.00 1.86 1.79 0.00 1.79 0.00 0.00 1.73 0.00 0.00 2.80 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.30 1.41 7.81 *26 K 8.38 4.13 0.00 1.56 1.61 0.00 1.66 0.00 0.00 1.74 0.00 0.00 3.09 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.26 1.50 7.81 * Residues marked with a * may have inaccurate shift predictions.