NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 T 4.1124 8.1593 110.9327 61.6127 70.0228 173.4739 *5 S 4.2388 8.1746 114.5185 59.0261 62.9239 174.3115 6 C 5.6290 8.4525 125.9846 56.9030 42.6980 171.2133 7 H 4.6819 8.5442 113.7943 55.4184 30.9880 173.7337 8 F 4.9793 8.5409 117.5241 58.2155 40.4689 174.9068 9 G 3.9874 8.6702 109.1817 45.3451 0.0000 170.3200 10 P 3.9017 0.0000 0.0000 66.5060 31.7922 178.1956 11 L 4.0922 7.6349 119.4692 57.0461 42.3842 177.1404 12 T 4.2854 7.4004 108.9107 60.4860 69.9352 172.0281 13 W 4.9252 8.4835 120.4298 57.5763 29.6835 176.0379 14 V 4.4625 9.3219 123.9546 61.3772 33.6589 173.6301 15 C 5.4262 8.8924 124.8899 55.0194 42.6571 174.0387 16 K 4.3295 8.6550 123.2791 54.8673 33.5195 175.2566 17 P 4.2716 0.0000 0.0000 62.7739 31.1131 176.1833 18 Q 4.0924 8.5454 123.6111 56.1485 29.0034 175.3741 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 4.11 4.19 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 1.17 0.00 0.00 *5 S 8.17 4.24 0.00 3.90 3.98 0.00 0.00 0.00 0.00 0.00 0.00 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 8.45 5.63 0.00 2.60 3.05 0.00 0.00 0.00 0.00 0.00 0.00 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 8.54 4.68 0.00 3.17 3.36 0.00 5.47 0.00 0.00 0.00 0.00 6.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8 F 8.54 4.98 0.00 2.86 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 9 G 8.67 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 3.90 0.00 2.04 2.05 0.00 3.67 0.00 0.00 3.66 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 11 L 7.63 4.09 0.00 1.62 1.69 0.92 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 12 T 7.40 4.29 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 1.26 0.00 0.00 13 W 8.48 4.93 0.00 3.26 3.10 0.00 0.00 0.00 0.00 0.00 0.00 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 9.32 4.46 1.84 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 1.17 0.00 0.00 1.04 0.00 0.00 15 C 8.89 5.43 0.00 2.84 2.96 0.00 0.00 0.00 0.00 0.00 0.00 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 8.66 4.33 0.00 1.87 1.83 0.00 1.63 0.00 0.00 1.83 0.00 0.00 2.84 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.55 1.36 7.81 17 P 0.00 4.27 0.00 2.19 2.13 0.00 3.76 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 1.98 1.95 0.00 18 Q 8.55 4.09 0.00 2.14 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.68 0.00 0.00 0.00 0.00 0.00 2.32 2.33 0.00 * Residues marked with a * may have inaccurate shift predictions.