NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 T 4.3679 8.1593 117.3744 63.5424 70.0268 172.7224 2 I 4.4123 7.9095 121.4589 58.1988 40.0092 172.0419 *5 Q 4.0046 9.2923 121.6717 56.5252 30.5800 177.3936 6 R 4.1461 8.5873 122.9821 56.5663 30.2159 176.3004 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 8.16 4.37 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 7.91 4.41 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 0.79 0.91 0.00 0.00 *5 Q 9.29 4.00 0.00 2.06 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.90 7.13 0.00 0.00 0.00 0.00 0.00 2.24 2.33 0.00 6 R 8.59 4.15 0.00 1.84 1.82 0.00 3.45 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 1.63 1.56 0.00 * Residues marked with a * may have inaccurate shift predictions.