NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.2931 8.2644 123.5821 51.7304 19.9523 176.4602 2 S 4.0932 8.4193 116.6521 56.7752 63.1527 172.1153 3 L 4.0457 8.6561 129.8083 55.1763 43.0401 175.5907 4 A 4.1729 7.9994 127.6471 54.1636 19.6337 178.7507 *16 K 4.2841 7.6040 114.2206 55.1152 34.1835 177.7190 17 R 4.3497 7.3632 121.8937 55.2229 29.7382 174.4186 18 S 4.2814 8.4798 120.6828 58.7113 63.8394 174.2710 19 R 4.6538 8.1546 125.5630 55.3934 32.0105 172.7579 20 Q 4.3237 8.7392 115.7384 56.2715 31.7101 175.4216 21 V 3.6843 8.2052 114.0678 61.3025 31.4903 171.3625 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 8.26 4.29 1.27 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 2 S 8.42 4.09 0.00 3.92 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 3 L 8.66 4.05 0.00 1.64 1.55 0.92 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 4 A 8.00 4.17 1.26 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 0.00 0.00 0.00 *16 K 7.60 4.28 0.00 1.78 1.90 0.00 1.80 0.00 0.00 1.76 0.00 0.00 3.06 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.34 1.38 7.81 17 R 7.36 4.35 0.00 1.87 1.91 0.00 3.04 0.00 0.00 3.22 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.64 0.00 18 S 8.48 4.28 0.00 3.88 3.85 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.15 4.65 0.00 1.71 1.76 0.00 3.23 0.00 0.00 3.28 7.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.57 0.00 20 Q 8.74 4.32 0.00 2.14 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.84 5.88 0.00 0.00 0.00 0.00 0.00 2.22 2.35 0.00 21 V 8.21 3.68 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.70 0.00 0.00 0.93 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.