NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 R 4.2739 8.2549 117.2810 55.7124 30.7832 174.6964 2 R 4.0102 8.1511 117.4177 54.7554 30.8479 174.4371 3 K 4.4999 8.3516 121.0099 54.5298 34.5920 177.3012 4 W 4.0202 8.4733 135.0000 56.4897 31.7451 174.6521 *7 W 4.7891 8.1968 112.9827 56.9332 28.6147 173.8808 8 H 5.0641 8.5483 115.4071 53.5960 31.5866 174.0994 9 L 4.2589 8.6215 120.2974 55.3626 41.4097 177.2995 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 R 8.25 4.27 0.00 1.92 2.02 0.00 3.01 0.00 0.00 3.24 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.68 0.00 2 R 8.15 4.01 0.00 1.78 1.79 0.00 3.05 0.00 0.00 3.06 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.61 0.00 3 K 8.35 4.50 0.00 1.77 1.76 0.00 1.82 0.00 0.00 1.81 0.00 0.00 3.29 0.00 0.00 3.50 0.00 0.00 0.00 0.00 1.56 1.59 7.81 4 W 8.47 4.02 0.00 3.48 2.93 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 *7 W 8.20 4.79 0.00 3.47 3.30 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 H 8.55 5.06 0.00 3.16 3.27 0.00 5.90 0.00 0.00 0.00 0.00 6.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 9 L 8.62 4.26 0.00 1.70 1.64 0.96 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.