NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 G 3.8761 8.2133 109.7181 44.1053 0.0000 175.5098 3 K 3.8873 7.6956 122.7516 57.6311 32.9784 176.4082 4 G 3.5740 7.7715 106.3347 44.8878 0.0000 172.9282 5 D 4.5668 8.2168 121.8626 51.8085 40.2533 177.1237 6 R 4.0269 8.3596 125.2315 58.1552 30.3701 177.6154 7 R 4.1921 7.7131 117.0293 55.3269 30.7144 176.2957 8 T 4.7715 7.5162 106.3990 59.8719 72.8910 171.9993 9 R 3.6466 8.7812 117.8795 60.8904 30.2597 178.0282 10 R 3.9344 8.2622 115.7497 59.8469 30.0860 178.6904 11 G 3.9890 8.1301 103.9947 48.1987 0.0000 175.2074 12 K 4.1342 8.3401 121.6746 59.4178 32.0877 178.7830 13 I 3.6172 8.4176 120.8422 63.7788 36.9061 177.8931 14 W 4.1226 8.2759 129.1000 60.4842 30.4132 177.4651 15 R 4.3477 7.5554 116.4198 57.3966 29.8448 177.1538 16 G 3.8770 8.2848 105.3453 45.2001 0.0000 172.3759 17 T 4.7534 7.2504 108.8858 59.6716 71.3736 172.7247 18 Y 4.8571 8.1106 117.5555 56.6078 41.7543 175.6371 19 G 4.1072 8.8611 109.1656 45.3872 0.0000 173.4667 20 K 3.5215 9.1836 119.6086 59.8671 31.8625 177.4444 21 Y 4.2672 8.1311 112.5694 58.1892 38.2651 176.2536 22 R 4.5847 8.9092 121.9504 54.4454 31.7176 171.5485 23 P 4.5840 0.0000 0.0000 62.4294 32.0392 177.5939 24 R 4.2255 8.3508 120.6091 56.4265 29.4428 176.9919 25 K 4.0377 8.3944 116.0076 56.1699 33.0056 176.8955 *26 K 4.1330 8.1843 120.8704 54.7787 32.3269 175.2395 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 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3 K 7.70 3.89 0.00 1.37 1.07 0.00 1.62 0.00 0.00 2.03 0.00 0.00 3.04 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.57 1.42 7.81 4 G 7.77 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.22 4.57 0.00 2.63 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 8.36 4.03 0.00 1.77 1.96 0.00 3.22 0.00 0.00 3.24 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.65 0.00 7 R 7.71 4.19 0.00 1.49 1.15 0.00 2.95 0.00 0.00 2.95 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 1.28 0.00 8 T 7.52 4.77 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 1.17 0.00 0.00 9 R 8.78 3.65 0.00 1.84 1.95 0.00 3.33 0.00 0.00 3.24 8.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.85 0.00 10 R 8.26 3.93 0.00 1.90 1.92 0.00 3.22 0.00 0.00 3.34 7.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.76 0.00 11 G 8.13 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.34 4.13 0.00 2.20 1.86 0.00 1.55 0.00 0.00 1.77 0.00 0.00 3.19 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.49 1.70 7.81 13 I 8.42 3.62 2.10 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.70 0.91 0.00 0.00 14 W 8.28 4.12 0.00 3.23 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 15 R 7.56 4.35 0.00 2.25 2.08 0.00 3.60 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 1.68 1.75 0.00 16 G 8.28 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 T 7.25 4.75 4.33 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 1.26 0.00 0.00 18 Y 8.11 4.86 0.00 2.82 3.06 0.00 0.00 0.00 0.00 0.00 0.00 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 8.86 4.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 9.18 3.52 0.00 1.74 2.02 0.00 1.74 0.00 0.00 1.73 0.00 0.00 2.39 0.00 0.00 2.85 0.00 0.00 0.00 0.00 0.75 1.29 7.81 21 Y 8.13 4.27 0.00 3.01 3.04 0.00 0.00 0.00 0.00 0.00 0.00 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 8.91 4.58 0.00 1.75 1.83 0.00 2.99 0.00 0.00 3.05 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.60 0.00 23 P 0.00 4.58 0.00 2.26 1.99 0.00 3.70 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.09 0.00 24 R 8.35 4.23 0.00 1.61 1.75 0.00 2.93 0.00 0.00 2.86 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.50 0.00 25 K 8.39 4.04 0.00 1.86 2.06 0.00 1.91 0.00 0.00 1.75 0.00 0.00 3.01 0.00 0.00 2.74 0.00 0.00 0.00 0.00 1.32 1.37 7.81 *26 K 8.18 4.13 0.00 1.56 1.61 0.00 1.66 0.00 0.00 1.74 0.00 0.00 2.92 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.