NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 T 4.2717 8.1749 110.9391 60.9123 70.7677 172.6370 2 I 4.1932 7.3400 122.2771 58.4165 40.2040 172.5410 *5 Q 4.1053 9.0307 122.2058 56.3956 30.5798 174.7456 6 R 4.2250 8.3586 121.9241 56.4832 31.0509 175.1606 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 T 8.17 4.27 4.24 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 2 I 7.34 4.19 1.87 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.29 0.91 0.00 0.00 *5 Q 9.03 4.11 0.00 2.03 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.02 6.84 0.00 0.00 0.00 0.00 0.00 2.24 2.33 0.00 6 R 8.36 4.22 0.00 1.78 1.74 0.00 3.29 0.00 0.00 3.26 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.58 0.00 * Residues marked with a * may have inaccurate shift predictions.