NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 G 3.8554 8.2133 109.7197 45.0564 0.0000 174.8548 3 K 3.5398 8.6144 120.3303 58.1487 32.1020 175.9027 4 G 3.4104 7.6639 106.5627 46.0353 0.0000 173.0407 5 D 4.3743 8.4298 120.9592 53.3209 40.4886 176.5583 6 R 4.1145 8.5642 128.1786 58.7651 30.6230 177.1058 7 R 3.9731 7.3483 117.9487 54.6198 29.7742 174.9226 8 T 4.5888 6.8708 107.9464 59.5934 73.5185 174.0787 9 R 3.9331 8.4717 119.2695 59.5502 30.1083 179.2834 10 R 4.1366 8.1072 117.3238 59.3648 30.1610 179.0517 11 G 4.2766 7.8995 106.4323 47.4125 0.0000 175.8576 12 K 4.0858 7.9907 120.7505 59.0553 32.0726 179.2161 13 I 3.5619 8.2529 120.4742 64.2331 36.8492 177.8881 14 W 4.0982 8.2621 128.3500 60.6698 30.6633 177.3556 15 R 4.0974 7.9817 114.3274 55.7690 29.6026 176.8824 16 G 3.7100 8.2940 104.8967 46.6814 0.0000 174.0279 17 T 4.3049 7.1443 109.6347 60.5030 70.8146 172.6586 18 Y 4.9426 9.0222 117.8682 55.8990 42.2727 175.1257 19 G 3.9322 8.5330 106.5516 45.3580 0.0000 172.3771 20 K 3.6662 8.6078 120.6956 60.0515 31.7601 178.1528 21 Y 4.3907 7.8496 111.9840 59.1924 38.3231 176.6808 22 R 4.7783 8.1659 120.2606 54.6861 31.7788 171.8556 23 P 4.7371 0.0000 0.0000 62.1476 32.6206 177.1341 24 R 3.7527 8.2167 120.0910 56.2159 29.3880 177.0577 25 K 3.6078 7.7529 121.1595 56.3312 31.8605 176.9968 *26 K 4.1215 8.3728 119.0135 55.1284 32.3269 173.1217 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 G 8.21 3.86 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 0.00 3 K 8.61 3.54 0.00 1.24 1.09 0.00 1.56 0.00 0.00 1.73 0.00 0.00 3.00 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.42 1.38 7.81 4 G 7.66 3.41 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 0.00 5 D 8.43 4.37 0.00 2.56 2.49 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 6 R 8.56 4.11 0.00 1.79 1.91 0.00 3.27 0.00 0.00 3.22 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.69 0.00 7 R 7.35 3.97 0.00 1.35 0.69 0.00 3.04 0.00 0.00 3.15 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 1.36 0.00 8 T 6.87 4.59 4.21 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 1.14 0.00 0.00 9 R 8.47 3.93 0.00 1.92 2.04 0.00 3.18 0.00 0.00 3.38 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.78 0.00 10 R 8.11 4.14 0.00 1.84 2.01 0.00 3.13 0.00 0.00 3.34 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.72 0.00 11 G 7.90 4.28 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 0.00 12 K 7.99 4.09 0.00 2.18 1.92 0.00 1.72 0.00 0.00 1.89 0.00 0.00 3.32 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.52 1.54 7.81 13 I 8.25 3.56 2.05 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 1.08 0.92 0.00 0.00 14 W 8.26 4.10 0.00 3.32 3.35 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 15 R 7.98 4.10 0.00 2.30 1.97 0.00 3.65 0.00 0.00 3.32 7.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.78 0.00 16 G 8.29 3.71 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 0.00 17 T 7.14 4.30 4.27 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 1.26 0.00 0.00 18 Y 9.02 4.94 0.00 2.94 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 19 G 8.53 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 0.00 0.00 0.00 20 K 8.61 3.67 0.00 1.59 1.62 0.00 1.59 0.00 0.00 1.26 0.00 0.00 2.58 0.00 0.00 2.82 0.00 0.00 0.00 0.00 0.68 1.22 7.81 21 Y 7.85 4.39 0.00 3.06 3.03 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 22 R 8.17 4.78 0.00 1.86 1.84 0.00 2.96 0.00 0.00 2.96 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.64 0.00 23 P 0.00 4.74 0.00 2.10 1.97 0.00 3.79 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.26 0.00 24 R 8.22 3.75 0.00 1.59 1.60 0.00 3.17 0.00 0.00 2.95 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.08 0.00 25 K 7.75 3.61 0.00 1.86 1.81 0.00 1.78 0.00 0.00 1.74 0.00 0.00 3.02 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.35 1.43 7.81 *26 K 8.37 4.12 0.00 1.52 1.62 0.00 1.61 0.00 0.00 1.74 0.00 0.00 3.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.26 1.50 7.81 * Residues marked with a * may have inaccurate shift predictions.