NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.2606 8.2649 123.5821 51.4501 19.8904 176.5057 2 R 3.8239 8.5874 120.9288 55.0825 30.4617 174.2655 3 T 4.6517 7.8623 115.7698 59.9086 72.1623 172.4224 *5 Q 4.2066 8.3487 118.0829 57.6943 29.5174 175.2640 6 T 4.2672 8.3114 112.0665 62.5981 69.6371 174.6645 7 A 3.7586 8.4078 126.2009 51.3796 17.9476 177.2583 8 R 4.6760 8.0746 117.7681 54.2182 32.9554 175.3197 9 K 4.1692 8.5686 121.4095 57.1933 32.8620 176.7003 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 4.26 1.27 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 0.00 0.00 2 R 8.59 3.82 0.00 1.87 1.91 0.00 3.20 0.00 0.00 3.25 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.74 0.00 3 T 7.86 4.65 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 1.23 0.00 0.00 *5 Q 8.35 4.21 0.00 2.19 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.90 7.49 0.00 0.00 0.00 0.00 0.00 2.22 2.45 0.00 6 T 8.31 4.27 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 8.41 3.76 1.33 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 8.07 4.68 0.00 1.73 1.76 0.00 3.23 0.00 0.00 3.28 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.57 0.00 9 K 8.57 4.17 0.00 1.90 1.77 0.00 1.66 0.00 0.00 1.74 0.00 0.00 2.95 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.40 1.43 7.81 * Residues marked with a * may have inaccurate shift predictions.