NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 G 3.8244 8.2133 109.7236 44.9703 0.0000 174.7321 3 K 4.1524 7.8277 115.9876 56.1630 31.5909 176.2174 4 G 3.8186 7.5670 107.6108 45.2466 0.0000 172.5584 5 D 4.3527 8.5464 119.8023 54.0554 40.7024 175.7360 6 R 4.0815 8.7525 126.7072 59.6412 30.6917 178.8254 7 R 3.7917 7.5166 115.7853 54.6680 28.6854 174.8885 8 T 4.5663 6.9921 108.8700 58.8697 73.4016 173.6232 9 R 4.1272 8.9354 122.5200 58.2576 29.5592 177.1778 10 R 4.2404 8.9565 120.7762 57.9908 31.0286 177.8267 11 G 4.1888 7.8034 107.5881 46.7013 0.0000 175.5195 12 K 4.1440 8.4016 121.4646 58.3762 32.2132 178.1273 13 I 3.8281 7.9253 121.1185 63.9318 36.8432 177.1348 14 W 4.1764 8.1247 130.4106 59.1446 30.8238 176.5348 15 R 4.0070 7.4681 114.0922 56.0100 30.0433 175.8881 16 G 3.7813 8.7243 106.0267 47.3486 0.0000 173.4767 17 T 4.5060 7.6111 107.5127 59.4808 72.0541 172.4040 18 Y 5.1013 7.8000 118.6317 56.5823 41.4037 176.4217 19 G 4.0382 8.0987 109.6523 45.9372 0.0000 174.3761 20 K 3.9704 8.8200 121.5350 58.1855 32.4514 177.3637 21 Y 4.8140 8.2350 114.8657 56.5423 38.7836 174.6849 22 R 4.0754 7.6758 121.8167 55.6683 30.1286 172.2274 23 P 4.8555 0.0000 0.0000 61.8399 33.5431 175.6112 24 R 4.0717 9.4703 115.8736 57.5792 32.1793 174.5405 25 K 4.3694 7.6981 119.5035 55.5161 31.0826 175.4149 *26 K 4.1330 8.5538 119.7840 54.5307 32.3269 174.4765 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 7.83 4.15 0.00 1.15 1.27 0.00 1.40 0.00 0.00 0.61 0.00 0.00 2.85 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.27 1.27 7.81 4 G 7.57 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 5 D 8.55 4.35 0.00 2.69 2.58 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 6 R 8.75 4.08 0.00 1.82 2.01 0.00 3.28 0.00 0.00 3.25 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.68 0.00 7 R 7.52 3.79 0.00 1.39 0.72 0.00 3.01 0.00 0.00 2.96 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 1.42 0.00 8 T 6.99 4.57 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 1.15 0.00 0.00 9 R 8.94 4.13 0.00 1.99 1.75 0.00 3.29 0.00 0.00 3.41 8.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.83 0.00 10 R 8.96 4.24 0.00 1.89 1.96 0.00 3.16 0.00 0.00 3.35 7.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.73 0.00 11 G 7.80 4.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.40 4.14 0.00 2.15 1.85 0.00 1.57 0.00 0.00 1.79 0.00 0.00 3.14 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.52 1.64 7.81 13 I 7.93 3.83 1.97 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.02 0.98 0.00 0.00 14 W 8.12 4.18 0.00 3.21 3.15 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 0.00 0.00 0.00 0.00 15 R 7.47 4.01 0.00 2.14 2.10 0.00 3.43 0.00 0.00 3.35 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.54 0.00 16 G 8.72 3.78 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 0.00 0.00 0.00 17 T 7.61 4.51 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 1.21 0.00 0.00 18 Y 7.80 5.10 0.00 2.97 2.90 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 19 G 8.10 4.04 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 0.00 0.00 0.00 20 K 8.82 3.97 0.00 1.46 1.13 0.00 1.53 0.00 0.00 1.32 0.00 0.00 2.65 0.00 0.00 2.74 0.00 0.00 0.00 0.00 0.61 1.15 7.81 21 Y 8.23 4.81 0.00 3.06 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 22 R 7.68 4.08 0.00 2.07 2.17 0.00 3.29 0.00 0.00 3.75 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.52 0.00 23 P 0.00 4.86 0.00 2.05 1.98 0.00 3.72 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 1.99 2.30 0.00 24 R 9.47 4.07 0.00 1.62 1.71 0.00 3.07 0.00 0.00 2.99 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.80 1.13 0.00 25 K 7.70 4.37 0.00 1.75 1.23 0.00 1.78 0.00 0.00 1.73 0.00 0.00 3.04 0.00 0.00 2.69 0.00 0.00 0.00 0.00 1.19 1.17 7.81 *26 K 8.55 4.13 0.00 1.56 1.61 0.00 1.66 0.00 0.00 1.74 0.00 0.00 3.16 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.