NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- *1 Y 4.5491 8.2445 119.1527 56.8188 38.4289 175.7388 *2 N 4.3711 8.1407 120.7886 54.6109 37.9849 176.0434 *3 S 4.4666 7.2099 111.8788 54.6226 66.5261 176.1969 4 G 4.0978 8.9906 108.8398 46.1064 0.0000 174.0583 *5 K 3.8841 8.3265 119.1098 55.1428 29.9676 178.8833 *6 L 4.1490 7.2871 124.5632 56.5991 40.5096 181.2113 *9 F 4.6582 8.9976 115.7515 58.0702 39.8815 176.1103 *10 V 4.6623 7.4385 122.1516 63.0592 34.0087 178.3012 *11 Q 4.7155 8.0773 113.2509 56.4593 31.6288 170.5834 12 G 4.6563 8.0722 116.3840 45.8615 0.0000 171.0453 *13 N 5.1177 7.9407 116.6303 51.4429 42.5844 176.7968 *14 L 4.7262 8.1869 113.9562 56.7646 42.6585 174.9656 *16 R 4.3256 8.1750 118.2241 57.9088 31.4864 180.6588 *18 C 4.8149 8.2852 115.9378 56.8775 42.1235 180.5265 *19 M 4.2247 7.3762 120.8706 53.4259 29.2412 177.2665 *22 K 4.2878 7.9394 126.3900 54.7718 35.2267 174.6354 *23 C 4.9594 9.0053 117.8018 54.6588 40.6711 175.0173 *24 S 4.7007 8.8433 109.3621 58.5197 65.8073 179.9865 *25 F 4.0668 8.0253 121.0805 57.0891 36.8386 175.6888 *28 A 4.3006 8.5435 132.5034 52.2777 20.1762 180.0259 *29 R 3.7425 7.5312 115.4660 57.6187 29.8076 180.4885 *31 V 4.3230 8.0788 119.7983 62.1692 35.3057 180.5199 *32 F 4.0110 8.4531 120.2315 58.2102 36.3536 179.2271 *34 N 4.5602 9.2728 113.8557 53.4547 39.1749 178.6523 *35 T 3.7626 8.5845 117.9871 60.8713 68.3339 171.3954 *37 R 4.0574 8.0389 123.1763 60.8214 30.2627 177.7460 *38 T 4.2996 8.2559 126.5765 61.6987 66.1304 172.1457 *39 T 4.7010 7.1888 117.6753 61.3944 69.0687 179.0917 *41 F 4.6586 8.2642 125.5940 57.6853 40.6334 180.2199 *42 W 4.2650 7.9028 127.1789 61.1496 27.5873 180.8174 *43 K 4.2259 7.5631 122.9021 61.2968 31.1975 184.6870 *44 Q 4.4297 7.8816 122.9406 60.8107 28.1391 180.2254 *45 Y 4.3843 8.0765 123.7297 63.1822 37.3842 179.7644 *46 V 4.6477 7.8400 120.4041 61.1357 32.2287 179.6551 *47 D 4.5424 8.4991 116.7566 55.2188 40.7733 172.5003 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 Y 8.24 4.55 0.00 2.35 2.21 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 0.00 *2 N 8.14 4.37 0.00 2.82 2.76 0.00 0.00 6.61 6.76 0.00 0.00 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 S 7.21 4.47 0.00 3.58 3.64 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.99 4.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.33 3.88 0.00 1.87 1.67 0.00 1.85 0.00 0.00 1.74 0.00 0.00 3.00 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.28 0.98 7.81 *6 L 7.29 4.15 0.00 1.60 0.62 0.92 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 *9 F 9.00 4.66 0.00 2.32 2.23 0.00 0.00 0.00 0.00 0.00 0.00 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 V 7.44 4.66 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 0.91 0.00 0.00 0.93 0.00 0.00 *11 Q 8.08 4.72 0.00 2.03 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 7.67 0.00 0.00 0.00 0.00 0.00 2.02 1.72 0.00 12 G 8.07 4.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 N 7.94 5.12 0.00 2.69 2.57 0.00 0.00 6.59 7.79 0.00 0.00 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 L 8.19 4.73 0.00 1.50 1.56 0.92 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.00 0.00 0.00 0.00 0.00 0.00 *16 R 8.17 4.33 0.00 1.85 1.90 0.00 3.26 0.00 0.00 3.26 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.20 0.00 *18 C 8.29 4.81 0.00 2.75 3.07 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 0.00 0.00 0.00 *19 M 7.38 4.22 0.00 2.09 1.91 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.35 0.00 *22 K 7.94 4.29 0.00 1.79 1.67 0.00 1.72 0.00 0.00 1.74 0.00 0.00 2.95 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.26 1.01 7.81 *23 C 9.01 4.96 0.00 2.66 2.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *24 S 8.84 4.70 0.00 3.57 3.59 0.00 0.00 0.00 0.00 0.00 0.00 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 F 8.03 4.07 0.00 2.20 2.26 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 0.00 *28 A 8.54 4.30 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 *29 R 7.53 3.74 0.00 1.82 1.85 0.00 3.30 0.00 0.00 3.26 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.48 0.00 *31 V 8.08 4.32 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 0.86 0.00 0.00 0.93 0.00 0.00 *32 F 8.45 4.01 0.00 2.33 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *34 N 9.27 4.56 0.00 2.76 2.69 0.00 0.00 6.44 7.71 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 *35 T 8.58 3.76 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 *37 R 8.04 4.06 0.00 1.85 1.85 0.00 3.29 0.00 0.00 3.26 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.20 0.00 *38 T 8.26 4.30 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 *39 T 7.19 4.70 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 *41 F 8.26 4.66 0.00 2.22 2.36 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 *42 W 7.90 4.26 0.00 2.53 2.33 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 *43 K 7.56 4.23 0.00 1.89 1.76 0.00 1.78 0.00 0.00 1.74 0.00 0.00 3.00 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.39 1.33 7.81 *44 Q 7.88 4.43 0.00 2.18 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.78 6.96 0.00 0.00 0.00 0.00 0.00 2.31 2.24 0.00 *45 Y 8.08 4.38 0.00 2.40 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *46 V 7.84 4.65 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 0.85 0.00 0.00 0.93 0.00 0.00 *47 D 8.50 4.54 0.00 2.63 2.38 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 * Residues marked with a * may have inaccurate shift predictions.