NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.9318 8.3549 109.7364 45.5047 0.0000 172.0218 2 C 4.4144 8.4614 117.9398 56.8598 30.6380 171.4553 *5 N 4.4339 8.4260 122.5645 52.7616 40.1703 172.4048 6 P 4.4900 0.0000 0.0000 63.5890 31.6640 176.4094 7 K 4.1752 7.8755 124.4036 56.8075 32.3392 175.7579 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 G 8.35 3.93 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 0.00 2 C 8.46 4.41 0.00 3.01 2.83 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 *5 N 8.43 4.43 0.00 2.95 2.74 0.00 0.00 6.97 7.71 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 4.49 0.00 2.22 2.14 0.00 3.76 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 1.98 1.98 0.00 7 K 7.88 4.18 0.00 1.75 1.71 0.00 1.75 0.00 0.00 1.74 0.00 0.00 3.00 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.36 1.48 7.81 * Residues marked with a * may have inaccurate shift predictions.