NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 R 4.3147 8.1127 119.7062 56.5717 32.7289 177.3135 2 M 3.8200 8.0412 116.8876 57.6179 32.2273 176.4575 3 K 3.9306 8.7591 120.5459 59.7237 32.9052 178.0930 4 Q 4.0072 8.0679 117.8303 58.7776 28.5314 178.5127 5 L 3.9285 8.0444 121.2841 58.2419 42.1773 178.8519 6 E 3.9490 8.1975 118.4377 59.5443 29.3871 179.1853 7 D 4.3416 8.2055 118.7745 57.4466 40.8632 179.0900 8 K 4.0260 8.2262 119.0427 59.3403 32.0192 179.6920 9 V 3.6020 8.1049 118.9298 65.9368 31.4288 178.0262 10 E 4.0057 8.2733 118.5756 59.0949 29.1960 178.8842 11 E 3.9132 8.2150 119.5557 59.0757 29.6494 178.4390 12 L 3.8764 8.2013 120.8270 58.1580 42.0297 178.7544 13 L 3.6483 7.8416 120.0661 58.2187 42.0490 178.9653 14 S 4.2516 8.1725 112.9827 61.1413 62.1999 176.2668 15 K 4.0346 8.4056 121.5876 59.1863 31.6844 179.1699 16 A 3.9478 8.2182 121.3838 55.4439 18.4534 179.2847 17 Y 4.3020 7.9177 115.4632 61.3971 37.9275 178.3820 18 H 4.1983 8.5060 119.1489 59.2357 29.9736 176.8751 19 L 4.1322 8.1795 123.7950 57.5987 41.8909 178.4557 20 E 3.9095 8.5331 119.4257 59.5027 29.4709 178.3832 21 N 4.3920 8.1935 116.6072 56.4503 38.7165 176.8254 22 E 3.9066 8.2381 120.2934 59.3331 29.4450 179.4393 23 V 3.5802 8.1150 118.3244 65.7948 31.3245 178.0051 24 A 3.9776 7.6917 119.7664 55.1330 18.5899 179.4689 25 R 4.0045 8.1968 116.7982 59.3675 30.1867 179.0219 26 L 3.9430 8.1362 120.2486 58.0654 41.9519 178.8965 27 K 3.9698 8.4355 119.6859 59.2764 31.7898 178.7899 28 K 4.0716 7.7644 117.9225 58.7728 32.0010 178.5475 29 L 4.3043 7.7871 118.3920 55.6843 41.9500 177.1369 30 V 4.0097 7.5839 115.2482 64.0260 33.3909 175.3152 *31 G 3.7392 7.6545 111.5352 45.7501 0.0000 172.2468 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 8.11 4.31 0.00 1.89 2.04 0.00 3.10 0.00 0.00 3.33 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.62 0.00 2 M 8.04 3.82 0.00 2.20 2.05 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.77 2.71 0.00 3 K 8.76 3.93 0.00 1.90 1.78 0.00 1.67 0.00 0.00 1.82 0.00 0.00 3.03 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.51 1.59 7.81 4 Q 8.07 4.01 0.00 2.13 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.68 0.00 0.00 0.00 0.00 0.00 2.45 2.42 0.00 5 L 8.04 3.93 0.00 1.84 1.90 0.91 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 6 E 8.20 3.95 0.00 2.20 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.54 0.00 7 D 8.21 4.34 0.00 2.96 2.71 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 8 K 8.23 4.03 0.00 1.79 1.84 0.00 1.66 0.00 0.00 1.57 0.00 0.00 2.89 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.45 1.60 7.81 9 V 8.10 3.60 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 1.01 0.00 0.00 0.99 0.00 0.00 10 E 8.27 4.01 0.00 2.04 1.99 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 2.50 2.46 0.00 11 E 8.21 3.91 0.00 2.15 2.11 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 2.30 2.31 0.00 12 L 8.20 3.88 0.00 1.82 1.79 0.89 0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 13 L 7.84 3.65 0.00 1.68 1.71 0.34 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 14 S 8.17 4.25 0.00 4.04 4.03 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 15 K 8.41 4.03 0.00 2.01 1.85 0.00 1.72 0.00 0.00 1.65 0.00 0.00 2.95 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.47 1.59 7.81 16 A 8.22 3.95 1.24 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 0.00 0.00 0.00 17 Y 7.92 4.30 0.00 3.22 2.92 0.00 0.00 0.00 0.00 0.00 0.00 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 H 8.51 4.20 0.00 3.38 3.51 0.00 5.80 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 L 8.18 4.13 0.00 1.84 1.87 0.91 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 20 E 8.53 3.91 0.00 2.21 2.14 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 2.34 2.35 0.00 21 N 8.19 4.39 0.00 2.93 2.79 0.00 0.00 7.24 7.02 0.00 0.00 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 E 8.24 3.91 0.00 2.12 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 2.18 0.00 23 V 8.12 3.58 2.20 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 1.10 0.00 0.00 0.93 0.00 0.00 24 A 7.69 3.98 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.20 4.00 0.00 1.97 1.99 0.00 3.14 0.00 0.00 3.09 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.86 0.00 26 L 8.14 3.94 0.00 1.86 1.85 0.92 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 27 K 8.44 3.97 0.00 1.98 1.97 0.00 1.68 0.00 0.00 1.65 0.00 0.00 2.95 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.44 1.49 7.81 28 K 7.76 4.07 0.00 2.03 1.85 0.00 1.74 0.00 0.00 1.70 0.00 0.00 3.02 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.47 1.61 7.81 29 L 7.79 4.30 0.00 1.80 1.71 0.92 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 30 V 7.58 4.01 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.81 0.00 0.00 0.93 0.00 0.00 *31 G 7.65 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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.