NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 T 4.1399 8.1593 117.3659 63.5708 70.2048 173.9831 *5 S 4.2705 7.7457 117.1526 58.7452 62.9416 173.8485 6 C 5.0672 8.2906 124.8138 57.7555 41.5779 172.1769 7 H 5.1878 9.3277 115.4887 54.0884 31.9645 172.7909 8 F 4.4678 8.7407 118.7208 58.7117 39.2272 175.0390 9 G 4.3415 8.3048 110.9996 41.9330 0.0000 171.1217 10 P 4.3380 0.0000 0.0000 65.6949 31.4856 178.3830 11 L 4.1182 7.8961 115.8836 57.0218 41.8904 176.3343 12 T 4.1817 7.4959 109.7170 60.7546 69.9042 171.2767 13 W 4.6763 8.4080 120.5389 57.0901 30.1450 176.5387 14 V 4.3036 9.0902 122.2575 61.5881 33.6620 173.7558 15 C 5.4273 8.8927 126.4607 55.0528 41.7180 174.2493 16 K 4.4703 8.5716 123.2051 54.8436 33.8719 174.8657 17 P 4.4570 0.0000 0.0000 62.5210 32.1075 176.5654 18 Q 4.1651 8.3856 119.5437 56.3674 28.9891 175.2493 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 3 T 8.16 4.14 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 1.19 0.00 0.00 *5 S 7.75 4.27 0.00 3.89 3.94 0.00 0.00 0.00 0.00 0.00 0.00 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 C 8.29 5.07 0.00 2.51 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 7 H 9.33 5.19 0.00 3.17 3.38 0.00 5.29 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8 F 8.74 4.47 0.00 2.88 2.82 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 9 G 8.30 4.34 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 0.00 10 P 0.00 4.34 0.00 2.05 2.11 0.00 3.68 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.12 0.00 11 L 7.90 4.12 0.00 1.63 1.70 0.90 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 12 T 7.50 4.18 4.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 13 W 8.41 4.68 0.00 3.25 3.11 0.00 0.00 0.00 0.00 0.00 0.00 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 V 9.09 4.30 1.82 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 1.07 0.00 0.00 1.00 0.00 0.00 15 C 8.89 5.43 0.00 2.86 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 16 K 8.57 4.47 0.00 1.88 1.84 0.00 1.59 0.00 0.00 1.73 0.00 0.00 2.99 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.41 1.47 7.81 17 P 0.00 4.46 0.00 2.06 2.02 0.00 3.67 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.06 0.00 18 Q 8.39 4.17 0.00 1.98 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.76 6.65 0.00 0.00 0.00 0.00 0.00 2.26 2.32 0.00 * Residues marked with a * may have inaccurate shift predictions.