NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.1365 8.1185 123.5819 52.1210 20.4392 178.6515 *3 A 4.2661 8.0087 124.7543 53.8800 20.8490 179.8290 4 E 3.9621 8.1351 114.7348 59.3687 29.4448 179.2491 5 A 3.9548 8.3244 120.8668 55.0486 18.3942 179.4510 6 A 3.9250 7.9604 118.8359 55.2799 18.4294 179.2469 7 E 3.8668 8.4947 118.0579 59.4523 29.6522 179.1770 8 K 3.9648 8.2343 118.2686 59.4061 32.0820 179.2253 9 A 3.9784 8.4275 121.1835 55.0816 18.2456 179.5494 10 A 3.9791 8.3032 119.5537 55.3391 18.4344 180.0525 11 K 3.9276 8.3564 117.1902 59.5164 32.0272 178.8472 12 Y 3.9403 8.4302 119.9586 60.7803 38.6777 178.1281 13 A 4.0304 8.3797 121.3605 55.1939 18.4847 179.4059 14 A 3.9166 8.2894 119.4081 55.3195 18.4058 179.7765 15 E 3.8194 8.3332 116.9130 59.4476 29.5436 179.4213 16 A 3.8234 7.9293 120.6631 55.0605 18.4301 179.5839 17 A 3.9277 8.1900 119.4853 55.1372 18.3464 179.4902 18 E 3.8601 8.2820 117.8801 59.3855 29.6694 179.1260 19 K 3.8800 8.1946 118.3691 59.4358 31.8508 179.2169 20 A 3.9369 7.7673 119.8696 55.0682 18.4041 179.1791 21 A 4.0742 8.2789 118.6346 55.2785 18.4792 179.7596 22 K 4.1115 8.1172 116.3129 59.0840 32.3910 180.4452 23 A 4.1715 7.9824 121.6359 51.5556 18.2755 177.2195 *25 A 4.0526 8.0711 129.8994 53.8812 19.0373 177.5130 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 8.12 4.14 1.31 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 A 8.01 4.27 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 4 E 8.14 3.96 0.00 2.13 2.01 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 2.40 2.32 0.00 5 A 8.32 3.95 1.32 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 6 A 7.96 3.93 1.35 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 0.00 0.00 7 E 8.49 3.87 0.00 2.13 2.13 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 2.32 2.36 0.00 8 K 8.23 3.96 0.00 2.01 1.86 0.00 1.72 0.00 0.00 1.66 0.00 0.00 2.96 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.48 1.65 7.81 9 A 8.43 3.98 1.37 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 10 A 8.30 3.98 1.38 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 11 K 8.36 3.93 0.00 2.00 1.90 0.00 1.70 0.00 0.00 1.59 0.00 0.00 2.91 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.47 1.62 7.81 12 Y 8.43 3.94 0.00 3.11 3.14 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 13 A 8.38 4.03 1.46 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 14 A 8.29 3.92 1.36 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 15 E 8.33 3.82 0.00 1.91 1.87 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 2.49 2.40 0.00 16 A 7.93 3.82 1.20 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 A 8.19 3.93 1.35 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 0.00 0.00 18 E 8.28 3.86 0.00 2.11 2.07 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 2.28 2.33 0.00 19 K 8.19 3.88 0.00 1.95 1.81 0.00 1.64 0.00 0.00 1.60 0.00 0.00 2.89 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.42 1.56 7.81 20 A 7.77 3.94 1.36 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 21 A 8.28 4.07 1.34 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 22 K 8.12 4.11 0.00 1.85 1.87 0.00 1.69 0.00 0.00 1.69 0.00 0.00 3.02 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.46 1.57 7.81 23 A 7.98 4.17 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 *25 A 8.07 4.05 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 * Residues marked with a * may have inaccurate shift predictions.