NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 G 3.8202 8.2133 109.7225 44.8578 0.0000 174.4796 3 K 3.5229 8.4032 115.7672 56.8922 32.1168 176.2101 4 G 3.7084 9.3866 108.6767 46.2893 0.0000 173.2552 5 D 4.2329 7.9297 120.0109 54.5635 41.2502 176.6980 6 R 4.2820 8.5432 123.2800 57.0444 29.6310 176.7373 7 R 4.2443 7.6214 116.6946 55.9552 31.0168 174.6439 8 T 4.6983 7.5351 106.3366 58.8523 71.9828 173.6128 9 R 3.9735 8.0680 120.3967 59.7592 30.0687 177.7986 10 R 4.2941 7.8502 116.8814 57.7107 28.8379 178.9731 11 G 3.9746 7.7107 107.8491 46.9237 0.0000 175.5094 12 K 4.4445 8.0427 119.8399 58.3770 32.3723 178.2079 13 I 3.6851 7.7031 119.9101 63.0950 37.0210 177.2904 14 W 4.3476 8.3061 131.0367 61.1108 30.8639 177.9044 15 R 4.0104 7.5431 116.6533 59.6972 29.6801 178.3923 16 G 4.2714 8.2454 107.0226 45.9713 0.0000 173.2025 17 T 4.9226 7.6946 107.1517 59.8418 72.1931 172.1753 18 Y 4.6415 8.1661 118.5846 56.3165 41.2657 175.2005 19 G 3.9764 8.3774 109.0465 45.4378 0.0000 173.3142 20 K 3.8541 7.6153 117.4626 60.5208 32.8133 177.6379 21 Y 4.2684 8.0745 113.0257 58.3666 37.3176 177.5833 22 R 4.5943 8.9189 118.1846 54.6675 32.2518 170.6254 23 P 4.2812 0.0000 0.0000 62.4008 32.5552 177.5982 24 R 4.4796 8.5369 125.9360 55.4952 28.4798 175.4222 25 K 3.7734 7.7916 124.5664 55.9878 32.8166 175.9028 *26 K 4.1330 8.3968 119.6518 54.8213 32.3269 171.9562 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 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.40 3.52 0.00 1.14 0.90 0.00 1.37 0.00 0.00 1.51 0.00 0.00 2.96 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.35 1.31 7.81 4 G 9.39 3.71 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 0.00 0.00 0.00 5 D 7.93 4.23 0.00 2.69 2.51 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 6 R 8.54 4.28 0.00 1.79 1.90 0.00 3.20 0.00 0.00 3.23 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.65 0.00 7 R 7.62 4.24 0.00 1.41 0.85 0.00 2.87 0.00 0.00 2.87 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 1.28 0.00 8 T 7.54 4.70 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 1.18 0.00 0.00 9 R 8.07 3.97 0.00 1.96 1.90 0.00 3.22 0.00 0.00 3.33 7.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.79 0.00 10 R 7.85 4.29 0.00 1.90 1.97 0.00 3.21 0.00 0.00 3.37 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.72 0.00 11 G 7.71 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 12 K 8.04 4.44 0.00 1.78 1.83 0.00 1.57 0.00 0.00 1.84 0.00 0.00 3.09 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.38 1.52 7.81 13 I 7.70 3.69 1.92 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 1.46 0.63 0.93 0.00 0.00 14 W 8.31 4.35 0.00 3.28 3.38 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 0.00 15 R 7.54 4.01 0.00 2.31 2.04 0.00 3.48 0.00 0.00 3.50 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.77 0.00 16 G 8.25 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 0.00 0.00 0.00 0.00 17 T 7.69 4.92 4.31 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 1.25 0.00 0.00 18 Y 8.17 4.64 0.00 2.88 2.92 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 19 G 8.38 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 7.62 3.85 0.00 1.81 1.82 0.00 1.58 0.00 0.00 1.37 0.00 0.00 2.17 0.00 0.00 2.76 0.00 0.00 0.00 0.00 1.09 1.34 7.81 21 Y 8.07 4.27 0.00 2.96 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.92 4.59 0.00 1.72 1.81 0.00 3.02 0.00 0.00 3.09 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 1.47 0.00 23 P 0.00 4.28 0.00 2.12 2.04 0.00 3.75 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.13 0.00 24 R 8.54 4.48 0.00 1.90 1.90 0.00 3.35 0.00 0.00 3.09 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 1.37 0.00 25 K 7.79 3.77 0.00 1.91 1.80 0.00 1.82 0.00 0.00 1.69 0.00 0.00 3.01 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.30 1.43 7.81 *26 K 8.40 4.13 0.00 1.56 1.61 0.00 1.66 0.00 0.00 1.74 0.00 0.00 3.06 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.