NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 W 5.0493 8.2749 120.5728 56.8214 31.6170 176.5599 3 I 3.7854 7.9039 119.3110 64.1296 37.0497 176.8524 4 Q 4.3748 7.6121 119.2869 55.7384 28.9600 176.9910 *6 I 4.3022 7.8410 112.3106 61.5054 39.4418 178.8937 7 T 3.9381 7.8356 115.9866 62.9373 67.3093 174.1559 *9 L 4.0590 7.8649 120.9705 54.6736 42.4004 176.6048 *12 Q 3.9554 8.4951 122.2455 55.0319 29.9428 173.6373 *16 P 4.1876 0.0000 0.0000 63.0337 31.6139 176.2188 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 2 W 8.27 5.05 0.00 3.29 3.27 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 I 7.90 3.79 1.91 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.79 0.94 0.00 0.00 4 Q 7.61 4.37 0.00 2.01 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.63 0.00 0.00 0.00 0.00 0.00 2.36 2.27 0.00 *6 I 7.84 4.30 1.91 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.69 0.98 0.00 0.00 7 T 7.84 3.94 4.26 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 1.22 0.00 0.00 *9 L 7.86 4.06 0.00 1.77 1.70 0.95 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 *12 Q 8.50 3.96 0.00 2.22 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.66 0.00 0.00 0.00 0.00 0.00 2.27 2.36 0.00 *16 P 0.00 4.19 0.00 2.20 2.08 0.00 3.81 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 2.01 0.00 * Residues marked with a * may have inaccurate shift predictions.