NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.1367 8.1185 123.5821 52.1283 20.4954 178.4522 *3 A 4.2654 7.9819 124.5034 53.8803 20.8558 179.7681 4 E 3.9509 8.2215 114.6423 59.5460 29.5447 179.2705 5 A 3.9729 8.3282 120.7884 55.1102 18.3879 179.4920 6 A 3.9568 7.9704 118.8182 55.2198 18.4391 179.1937 7 E 3.8746 8.5733 118.2032 59.3981 29.6758 179.2480 8 K 3.9733 8.0542 118.0850 59.4399 32.1197 179.1571 9 A 4.0077 8.1120 120.7648 55.1997 18.2304 179.6040 10 A 3.9989 8.3000 119.4087 55.1531 18.4215 180.0141 11 K 3.9202 8.5568 117.5773 59.7195 32.0986 178.9210 12 Y 3.9881 8.3243 119.6323 60.6106 38.6817 177.9196 13 A 3.9732 8.3956 121.5606 55.1593 18.4030 179.4973 14 A 3.9124 8.1997 119.4644 55.3525 18.4102 179.7772 15 E 3.8264 8.3312 116.9740 59.2914 29.4781 179.4167 16 A 3.7814 7.9032 120.7226 55.0554 18.3618 179.6028 17 A 3.9250 8.1304 119.4480 55.1401 18.3777 179.4595 18 E 3.8407 8.3744 118.2532 59.0812 29.7005 178.7534 19 K 3.7852 8.1729 119.5881 59.6145 32.0017 178.4969 20 A 3.9587 7.5557 118.6536 55.1119 18.3771 179.0865 21 A 4.0770 8.1007 118.5004 55.3082 18.5289 179.7529 22 K 4.1149 8.2596 116.1110 59.2348 32.1979 180.4432 23 A 4.1182 7.7434 118.9912 52.0442 18.4045 177.2204 *25 A 4.0515 8.0708 129.5432 54.0811 19.0371 177.6171 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 A 8.12 4.14 1.31 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 0.00 0.00 0.00 *3 A 7.98 4.27 1.33 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 0.00 0.00 0.00 4 E 8.22 3.95 0.00 2.14 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.40 2.33 0.00 5 A 8.33 3.97 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 A 7.97 3.96 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 E 8.57 3.87 0.00 2.13 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.37 0.00 8 K 8.05 3.97 0.00 2.06 1.85 0.00 1.72 0.00 0.00 1.65 0.00 0.00 2.96 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.47 1.64 7.81 9 A 8.11 4.01 1.38 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 0.00 0.00 10 A 8.30 4.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 K 8.56 3.92 0.00 2.02 1.91 0.00 1.70 0.00 0.00 1.59 0.00 0.00 2.90 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.48 1.63 7.81 12 Y 8.32 3.99 0.00 3.09 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 13 A 8.40 3.97 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 A 8.20 3.91 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.33 3.83 0.00 2.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 2.29 0.00 16 A 7.90 3.78 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.13 3.93 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 18 E 8.37 3.84 0.00 2.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 2.30 0.00 19 K 8.17 3.79 0.00 1.92 1.98 0.00 1.65 0.00 0.00 1.59 0.00 0.00 2.92 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.41 1.44 7.81 20 A 7.56 3.96 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 A 8.10 4.08 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.26 4.11 0.00 1.91 1.87 0.00 1.69 0.00 0.00 1.69 0.00 0.00 3.02 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.46 1.52 7.81 23 A 7.74 4.12 1.28 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 0.00 0.00 *25 A 8.07 4.05 1.31 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 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.