NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 P 4.4545 0.0000 0.0000 62.8879 32.6450 175.3806 2 T 4.5737 8.1455 108.7426 59.5792 71.8088 169.8873 3 E 4.7079 8.0925 121.5529 54.4405 34.4459 176.4312 *5 F 4.5962 8.3153 115.3452 56.3634 39.0266 174.8879 6 R 4.0487 8.5324 123.1983 56.4621 30.6855 176.1668 7 E 4.3424 8.4089 122.8990 56.7193 30.5513 175.3519 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 4.45 0.00 2.21 2.13 0.00 3.68 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 1.97 0.00 2 T 8.15 4.57 4.23 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 1.20 0.00 0.00 3 E 8.09 4.71 0.00 1.77 1.92 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 2.30 2.29 0.00 *5 F 8.32 4.60 0.00 3.19 3.07 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 R 8.53 4.05 0.00 1.83 1.92 0.00 3.19 0.00 0.00 3.25 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.65 0.00 7 E 8.41 4.34 0.00 1.84 1.76 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 2.36 2.60 0.00 * Residues marked with a * may have inaccurate shift predictions.