NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 P 4.3762 0.0000 0.0000 62.8931 32.6222 176.0326 2 M 4.2730 8.4730 119.6512 53.5416 32.3481 174.2726 3 Q 4.6471 7.2549 116.0110 54.5726 32.6877 174.6509 4 S 4.0965 8.5919 113.9276 60.6961 63.4783 172.9420 *6 P 4.1622 0.0000 0.0000 61.1926 32.2883 176.1022 7 L 4.1136 8.4630 120.8210 55.6289 41.9077 176.8767 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 P 0.00 4.38 0.00 2.23 2.05 0.00 3.63 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 2.11 0.00 2 M 8.47 4.27 0.00 2.08 2.08 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.53 0.00 3 Q 7.25 4.65 0.00 2.10 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 7.07 0.00 0.00 0.00 0.00 0.00 2.22 2.34 0.00 4 S 8.59 4.10 0.00 4.00 4.03 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 P 0.00 4.16 0.00 2.09 2.06 0.00 3.69 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 2.08 0.00 7 L 8.46 4.11 0.00 1.58 1.56 0.92 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.