NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 40 P 4.2909 0.0000 0.0000 62.5267 32.8511 175.9415 *42 S 4.1500 8.9454 121.0241 58.9243 62.7196 175.0300 *44 L 4.0983 9.0849 122.3811 54.7212 44.1461 179.9274 *51 K 4.2799 7.6603 118.0830 55.7066 32.8946 180.7302 52 Y 4.6539 7.6776 119.8033 56.5007 42.0379 177.9937 53 E 4.3247 8.7793 119.3878 55.0954 29.8316 172.1963 54 P 4.1119 0.0000 0.0000 65.9107 31.8338 176.2730 55 F 4.2671 8.3974 119.4899 57.8787 38.2560 174.5050 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 40 P 0.00 4.29 0.00 2.17 2.17 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 1.87 1.95 0.00 *42 S 8.95 4.15 0.00 3.94 3.68 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 *44 L 9.08 4.10 0.00 1.73 1.60 0.92 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 *51 K 7.66 4.28 0.00 1.79 1.72 0.00 1.72 0.00 0.00 1.70 0.00 0.00 2.88 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.26 1.04 7.81 52 Y 7.68 4.65 0.00 2.84 2.88 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 53 E 8.78 4.32 0.00 1.98 1.81 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 2.24 1.89 0.00 54 P 0.00 4.11 0.00 1.95 1.79 0.00 3.82 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 2.08 1.98 0.00 55 F 8.40 4.27 0.00 3.27 3.24 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 * Residues marked with a * may have inaccurate shift predictions.