NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 K 4.2763 8.4145 122.1404 56.6162 33.3027 175.1908 2 S 4.6710 8.3111 113.4651 59.1466 65.2095 170.0503 3 A 4.5816 7.4428 121.0700 51.4267 22.0384 174.3790 4 P 4.3923 0.0000 0.0000 62.6168 32.0020 177.4525 5 A 4.0750 8.4313 122.4722 54.0991 18.8206 177.8875 6 T 4.4881 7.7117 113.2640 60.8940 72.1776 174.3174 7 G 3.9256 9.3668 113.9417 44.0163 0.0000 168.9097 8 G 3.7664 8.0318 104.7843 44.3490 0.0000 172.6422 9 V 4.1142 7.6343 112.1500 59.9390 33.7594 175.2797 *11 K 3.9575 8.5988 125.1398 56.2957 32.5040 175.3771 12 P 4.5282 0.0000 0.0000 62.3812 31.8400 175.4483 13 H 3.9958 8.6735 112.9028 56.8197 28.3967 175.4585 14 R 4.2180 7.6894 119.2075 55.0114 31.7085 174.4490 15 Y 4.6496 8.0982 120.3569 57.0095 39.1551 175.5279 16 R 4.7773 8.2416 118.0670 53.2262 32.4304 173.8506 17 P 4.4067 0.0000 0.0000 63.3506 31.0928 176.0640 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 1 K 8.41 4.28 0.00 1.79 1.72 0.00 1.83 0.00 0.00 1.70 0.00 0.00 2.91 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.26 1.01 7.81 2 S 8.31 4.67 0.00 3.65 3.70 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 3 A 7.44 4.58 1.19 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 4 P 0.00 4.39 0.00 2.41 2.18 0.00 3.69 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 1.96 0.00 5 A 8.43 4.07 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 T 7.71 4.49 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 1.21 0.00 0.00 7 G 9.37 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 8 G 8.03 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 9 V 7.63 4.11 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.73 0.00 0.00 0.95 0.00 0.00 *11 K 8.60 3.96 0.00 1.72 1.76 0.00 1.76 0.00 0.00 1.72 0.00 0.00 2.87 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.28 1.40 7.81 12 P 0.00 4.53 0.00 2.27 2.11 0.00 3.82 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.95 0.00 13 H 8.67 4.00 0.00 2.84 3.18 0.00 5.48 0.00 0.00 0.00 0.00 6.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 R 7.69 4.22 0.00 1.67 1.80 0.00 3.28 0.00 0.00 3.08 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.52 0.00 15 Y 8.10 4.65 0.00 3.01 2.79 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.24 4.78 0.00 1.89 1.90 0.00 3.07 0.00 0.00 3.30 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.60 0.00 17 P 0.00 4.41 0.00 2.20 2.10 0.00 3.82 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.98 0.00 * Residues marked with a * may have inaccurate shift predictions.