NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 T 4.2830 8.1749 117.3156 63.5139 69.8817 172.9984 3 Y 4.8033 8.2640 122.7950 54.6360 41.5728 173.7308 4 F 5.0591 7.9750 116.4914 56.1929 41.5562 172.7180 5 T 4.6342 8.4111 111.0619 60.2996 71.6331 172.8525 6 Y 4.6973 7.4695 118.5175 56.4930 40.3400 173.6360 *8 S 4.3611 8.5703 112.4440 58.3415 64.1746 174.2198 *11 K 4.2402 7.8767 122.0136 56.9213 32.5726 175.2907 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 2 T 8.17 4.28 4.14 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 1.21 0.00 0.00 3 Y 8.26 4.80 0.00 3.07 2.83 0.00 0.00 0.00 0.00 0.00 0.00 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 F 7.97 5.06 0.00 3.27 3.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5 T 8.41 4.63 4.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 6 Y 7.47 4.70 0.00 3.16 3.18 0.00 0.00 0.00 0.00 0.00 0.00 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 S 8.57 4.36 0.00 3.99 4.09 0.00 0.00 0.00 0.00 0.00 0.00 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 7.88 4.24 0.00 1.87 1.65 0.00 1.19 0.00 0.00 0.61 0.00 0.00 2.87 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.19 1.30 7.81 * Residues marked with a * may have inaccurate shift predictions.