NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 P 4.4165 0.0000 0.0000 62.0687 32.6595 175.9984 2 I 3.7276 8.0561 120.4082 58.5444 37.6385 174.0933 3 P 4.4403 0.0000 0.0000 62.6703 32.7828 175.8796 4 F 4.3549 9.0140 123.3223 61.5372 39.8615 176.1590 5 L 3.9894 7.5420 120.0762 54.2495 42.4362 176.0604 *7 Q 3.9959 8.2955 118.8698 57.7616 29.9308 175.3021 8 K 4.2181 8.5794 117.7653 56.9384 31.5495 176.5746 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 4.42 0.00 2.22 2.14 0.00 3.75 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 1.90 2.01 0.00 2 I 8.06 3.73 1.89 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 1.48 0.16 0.91 0.00 0.00 3 P 0.00 4.44 0.00 2.20 2.09 0.00 3.78 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.97 0.00 4 F 9.01 4.35 0.00 2.96 3.16 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 L 7.54 3.99 0.00 1.70 1.58 0.98 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 *7 Q 8.30 4.00 0.00 2.05 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.90 5.73 0.00 0.00 0.00 0.00 0.00 2.24 2.33 0.00 8 K 8.58 4.22 0.00 1.90 1.94 0.00 1.77 0.00 0.00 1.74 0.00 0.00 2.97 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.30 1.40 7.81 * Residues marked with a * may have inaccurate shift predictions.