NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 G 3.8351 8.2133 109.7246 45.1799 0.0000 174.0870 3 K 4.1329 8.1949 115.3964 56.2247 31.5848 176.5150 4 G 3.9316 7.8966 106.2751 44.8553 0.0000 173.9492 5 D 4.3663 8.1980 119.8257 58.1066 40.0994 182.3876 6 R 2.9560 7.7488 113.6687 57.1610 32.7302 177.2835 7 R 3.4945 7.3486 123.9898 55.5015 29.2778 175.4259 8 T 4.5327 6.8770 107.6976 60.1098 71.2919 172.6673 9 R 4.1139 8.2956 120.7150 58.5085 29.7544 178.4559 10 R 4.1208 8.5849 121.1215 59.0253 30.3727 178.7832 11 G 3.5295 8.2418 105.9948 47.8157 0.0000 175.7351 12 K 4.1905 7.6421 122.1252 58.2200 31.9628 179.0043 13 I 3.5671 7.3086 119.5449 63.9843 37.1264 177.6562 14 W 4.2064 7.8742 127.4335 60.4526 30.6569 177.4092 15 R 3.9558 7.5628 115.9577 60.1982 29.6567 177.2804 16 G 3.9988 8.2311 103.7785 45.3727 0.0000 173.0739 17 T 4.7103 7.5449 109.4136 60.0521 71.2390 172.9048 18 Y 4.7546 8.2219 117.9253 56.5964 41.3578 175.8093 19 G 4.1650 8.2117 108.2227 45.1567 0.0000 173.5040 20 K 3.8959 9.0233 119.7831 59.0863 32.0121 177.4297 21 Y 4.5729 8.1544 113.4469 57.8353 39.1062 176.5382 22 R 4.7081 8.6650 120.7591 53.8600 31.0320 172.2156 23 P 4.4901 0.0000 0.0000 63.2400 32.5867 177.7015 24 R 4.3051 8.3295 121.3632 55.0820 28.5035 176.6682 25 K 3.7570 7.9766 125.8871 55.7342 32.7092 176.3132 *26 K 4.1330 8.3796 119.9459 54.7786 32.3269 172.4852 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 8.19 4.13 0.00 1.32 0.97 0.00 1.50 0.00 0.00 1.67 0.00 0.00 3.00 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.37 1.36 7.81 4 G 7.90 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 0.00 0.00 0.00 5 D 8.20 4.37 0.00 2.66 2.56 0.00 0.00 0.00 0.00 0.00 0.00 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 7.75 2.96 0.00 1.79 2.08 0.00 3.22 0.00 0.00 3.21 7.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.77 0.00 7 R 7.35 3.49 0.00 1.31 0.66 0.00 2.94 0.00 0.00 2.97 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 1.32 0.00 8 T 6.88 4.53 4.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 9 R 8.30 4.11 0.00 1.97 1.76 0.00 3.25 0.00 0.00 3.33 8.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.78 0.00 10 R 8.58 4.12 0.00 1.89 2.02 0.00 3.17 0.00 0.00 3.34 7.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.73 0.00 11 G 8.24 3.53 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 12 K 7.64 4.19 0.00 1.75 1.74 0.00 1.57 0.00 0.00 1.66 0.00 0.00 3.06 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.46 1.54 7.81 13 I 7.31 3.57 2.06 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 1.33 0.85 0.91 0.00 0.00 14 W 7.87 4.21 0.00 3.40 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 15 R 7.56 3.96 0.00 2.14 1.99 0.00 3.78 0.00 0.00 3.48 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.76 0.00 16 G 8.23 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.54 4.71 4.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 18 Y 8.22 4.75 0.00 2.86 3.03 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 19 G 8.21 4.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 9.02 3.90 0.00 1.80 2.11 0.00 1.77 0.00 0.00 1.81 0.00 0.00 2.61 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.07 1.40 7.81 21 Y 8.15 4.57 0.00 2.90 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 22 R 8.66 4.71 0.00 1.73 1.73 0.00 2.84 0.00 0.00 2.25 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 1.47 0.00 23 P 0.00 4.49 0.00 2.12 2.03 0.00 3.75 0.00 0.00 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.15 0.00 24 R 8.33 4.31 0.00 1.79 1.80 0.00 3.20 0.00 0.00 2.87 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 1.65 0.00 25 K 7.98 3.76 0.00 1.90 1.86 0.00 1.80 0.00 0.00 1.75 0.00 0.00 3.05 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.32 1.44 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 3.05 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.