NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 T 4.3407 8.1749 117.3747 63.3745 70.9132 174.5582 3 L 4.1456 7.9804 123.0078 56.6313 42.2858 177.0286 4 D 4.3853 8.7150 116.1612 55.1397 42.1078 176.9674 5 E 4.2494 8.0640 118.0733 57.8447 28.8896 177.5576 6 A 4.7829 7.8106 119.3596 52.7157 19.1357 178.2549 7 E 4.5397 7.4691 114.4457 57.5914 30.7263 178.7994 8 R 4.0992 7.6822 117.3472 59.0305 29.9960 178.8005 9 Q 4.0613 8.1153 117.6558 58.4870 28.6336 178.4700 10 W 3.9306 7.7257 129.0652 60.4374 31.0466 177.7620 11 K 3.7364 8.5943 119.4406 59.8596 31.6746 178.3832 12 A 4.1617 8.2246 120.6442 54.7820 17.9329 179.0048 13 E 4.0285 8.0153 116.2016 58.0100 29.5290 179.0970 14 F 3.6242 7.7084 121.8571 61.3942 39.5700 176.6835 15 H 4.1462 7.9063 115.8761 58.3028 29.5291 177.1347 16 R 3.7188 7.3910 119.9963 59.0213 29.6287 178.0797 17 W 3.6371 7.0848 126.3596 60.5261 30.8221 177.5603 18 S 3.3024 7.7498 111.8509 61.1492 61.6635 175.7879 19 S 4.1509 8.0368 116.2487 60.9345 62.0063 175.8029 20 Y 4.1791 7.7532 119.4721 58.1621 37.6925 178.3586 *22 V 3.9643 7.8038 119.3673 63.3390 33.7011 176.9368 23 H 4.3393 7.9032 116.5208 58.4802 28.4467 177.5912 24 W 4.0957 8.0212 130.0154 60.5357 29.2866 178.0268 25 K 3.5178 7.8914 117.5152 58.7744 31.3501 177.6286 26 N 4.3650 7.6909 115.0998 54.4724 38.7881 176.7599 27 Q 4.0276 7.6748 119.5282 59.1090 28.8306 176.1292 28 F 3.8093 7.2589 123.0147 57.3227 38.8778 174.8752 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 T 8.17 4.34 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 1.22 0.00 0.00 3 L 7.98 4.15 0.00 1.77 1.67 0.91 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 4 D 8.72 4.39 0.00 2.66 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 5 E 8.06 4.25 0.00 2.04 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.36 2.30 0.00 6 A 7.81 4.78 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 7 E 7.47 4.54 0.00 2.25 2.04 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 2.19 2.33 0.00 8 R 7.68 4.10 0.00 1.94 2.01 0.00 3.15 0.00 0.00 3.19 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.85 0.00 9 Q 8.12 4.06 0.00 2.17 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.12 6.93 0.00 0.00 0.00 0.00 0.00 2.48 2.68 0.00 10 W 7.73 3.93 0.00 3.53 3.44 0.00 0.00 0.00 0.00 0.00 0.00 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 8.59 3.74 0.00 2.20 1.90 0.00 1.72 0.00 0.00 1.72 0.00 0.00 2.99 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.49 1.61 7.81 12 A 8.22 4.16 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 13 E 8.02 4.03 0.00 1.98 1.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.42 0.00 14 F 7.71 3.62 0.00 1.78 2.80 0.00 0.00 0.00 0.00 0.00 0.00 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 H 7.91 4.15 0.00 3.43 3.30 0.00 5.84 0.00 0.00 0.00 0.00 6.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 16 R 7.39 3.72 0.00 1.85 1.83 0.00 3.01 0.00 0.00 3.06 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.79 1.17 0.00 17 W 7.08 3.64 0.00 2.99 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 18 S 7.75 3.30 0.00 3.48 3.45 0.00 0.00 0.00 0.00 0.00 0.00 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 S 8.04 4.15 0.00 3.83 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 20 Y 7.75 4.18 0.00 2.90 2.75 0.00 0.00 0.00 0.00 0.00 0.00 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 V 7.80 3.96 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 1.03 0.00 0.00 0.93 0.00 0.00 23 H 7.90 4.34 0.00 3.19 3.30 0.00 5.70 0.00 0.00 0.00 0.00 6.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 W 8.02 4.10 0.00 3.42 3.24 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 25 K 7.89 3.52 0.00 1.99 1.95 0.00 1.68 0.00 0.00 1.64 0.00 0.00 2.94 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.36 1.38 7.81 26 N 7.69 4.37 0.00 2.90 2.81 0.00 0.00 7.00 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 27 Q 7.67 4.03 0.00 2.08 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.01 6.97 0.00 0.00 0.00 0.00 0.00 2.15 2.15 0.00 28 F 7.26 3.81 0.00 2.88 2.85 0.00 0.00 0.00 0.00 0.00 0.00 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.