NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- *1 H 4.5434 8.5445 117.3740 53.7936 30.1435 173.6530 *2 P 4.1147 0.0000 0.0000 61.7110 32.5979 175.3770 *3 Q 4.2136 8.5058 119.2742 55.3220 29.6565 174.4699 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 H 8.54 4.54 0.00 2.67 2.91 0.00 5.84 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *2 P 0.00 4.11 0.00 1.91 1.89 0.00 3.62 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 1.84 2.08 0.00 *3 Q 8.51 4.21 0.00 1.81 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.62 0.00 0.00 0.00 0.00 0.00 2.18 2.42 0.00 * Residues marked with a * may have inaccurate shift predictions.