NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.3063 8.2649 123.5821 52.0829 19.6078 176.1443 2 R 4.3996 8.2911 122.2281 54.4411 31.9285 174.8939 3 T 4.0761 9.0898 119.1485 63.6358 70.2194 174.4240 4 K 4.7497 8.1150 125.5473 55.1328 34.6938 175.7071 5 Q 4.1684 8.6707 117.4813 58.5437 29.0404 176.2055 6 T 4.6382 7.4518 105.8682 58.9123 71.5132 173.5926 7 A 4.1957 8.3821 125.7182 52.6084 19.4025 177.7188 8 R 4.3917 7.9211 120.9612 54.9932 32.9110 174.3072 *10 S 4.2554 8.4362 114.6222 59.1068 64.1942 173.8108 11 T 4.1139 8.2691 109.3077 61.9722 68.8101 174.5781 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 A 8.26 4.31 1.28 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 R 8.29 4.40 0.00 1.89 1.86 0.00 3.21 0.00 0.00 3.23 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.71 0.00 3 T 9.09 4.08 4.24 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 1.21 0.00 0.00 4 K 8.11 4.75 0.00 1.72 1.76 0.00 1.74 0.00 0.00 1.70 0.00 0.00 2.97 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.35 1.58 7.81 5 Q 8.67 4.17 0.00 2.04 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.03 6.78 0.00 0.00 0.00 0.00 0.00 2.36 2.29 0.00 6 T 7.45 4.64 4.24 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 1.21 0.00 0.00 7 A 8.38 4.20 1.26 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 R 7.92 4.39 0.00 1.75 1.80 0.00 3.41 0.00 0.00 3.28 7.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.53 0.00 *10 S 8.44 4.26 0.00 4.00 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 11 T 8.27 4.11 4.24 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 1.21 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.