NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 K 4.2606 8.3101 120.1374 55.8847 33.5200 175.4388 2 A 3.9791 8.4857 126.7703 50.9503 19.0227 175.5233 3 L 4.2618 8.2270 123.4277 54.9003 43.8893 174.1387 4 Y 4.8880 8.0356 121.3390 55.0415 40.2976 175.4083 5 N 4.7778 8.7246 120.4305 53.3106 40.7916 176.4866 6 Y 4.7169 7.8864 122.6497 57.3714 37.1585 178.7260 7 A 4.1112 8.8752 117.6696 50.6232 18.9180 175.8943 8 P 4.2939 0.0000 0.0000 63.2182 32.1860 177.5417 *9 I 3.9893 8.0795 115.9368 60.3763 36.0847 174.5494 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 K 8.31 4.26 0.00 1.79 1.86 0.00 1.75 0.00 0.00 1.74 0.00 0.00 2.97 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.36 1.47 7.81 2 A 8.49 3.98 1.31 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 3 L 8.23 4.26 0.00 1.60 1.60 0.80 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 4 Y 8.04 4.89 0.00 3.09 2.84 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 8.72 4.78 0.00 2.80 2.85 0.00 0.00 6.92 7.46 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 Y 7.89 4.72 0.00 2.82 1.98 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 7 A 8.88 4.11 1.25 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 8 P 0.00 4.29 0.00 2.05 2.02 0.00 3.69 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 2.01 2.07 0.00 *9 I 8.08 3.99 1.88 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.51 0.92 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.