NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 4 R 4.2901 8.2549 117.2741 55.6124 30.8009 175.2183 5 S 3.9807 8.4915 117.8858 58.5300 63.3820 172.5170 6 H 4.5769 8.5181 121.3138 54.6902 31.0914 173.6587 *8 Y 4.2288 8.0140 120.7538 56.4929 39.3479 172.9884 9 P 2.9700 0.0000 0.0000 62.4104 32.0242 176.0629 10 A 4.2397 8.0049 121.3573 52.4138 19.0918 177.1132 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 4 R 8.25 4.29 0.00 1.89 1.98 0.00 2.99 0.00 0.00 3.21 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.63 0.00 5 S 8.49 3.98 0.00 3.95 3.84 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 0.00 0.00 0.00 0.00 6 H 8.52 4.58 0.00 3.17 3.28 0.00 5.73 0.00 0.00 0.00 0.00 6.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *8 Y 8.01 4.23 0.00 3.01 2.95 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 2.97 0.00 1.88 1.39 0.00 3.67 0.00 0.00 3.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.75 0.00 10 A 8.00 4.24 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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.