NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- *1 F 4.6038 8.3244 119.0068 56.4005 39.7674 173.6266 2 V 4.2214 8.0325 122.6120 59.7177 33.5821 173.7187 3 N 4.5486 9.4067 126.5885 53.5239 40.5294 173.0363 4 Q 4.6296 8.0475 120.5248 54.0284 31.3694 175.0268 5 H 4.3847 8.5350 115.9827 55.7358 29.2713 175.3904 6 L 4.7226 8.3967 122.6174 53.2091 44.2403 175.7404 7 C 4.9511 8.3577 120.9304 58.7458 32.6592 174.6274 8 G 3.7427 8.4035 111.5274 46.5558 0.0000 177.7193 9 S 4.0842 8.5494 118.9981 60.9238 63.2322 176.0071 10 H 4.2480 8.1415 118.5959 58.1101 28.2050 177.3017 11 L 3.9595 7.8224 122.6734 57.9649 41.9927 179.1411 12 V 3.3180 7.3537 111.5736 63.6571 31.5121 178.3294 13 E 3.9165 8.0601 118.6408 59.3504 29.4619 179.0690 14 A 3.9490 7.7372 120.2734 55.0557 18.3628 179.7253 15 L 3.5793 7.7220 117.4829 58.1188 41.3759 178.4606 16 Y 4.2141 7.5886 119.1897 60.8669 38.3762 177.7473 17 L 3.8413 7.9530 121.0172 58.5730 42.3039 179.3677 18 V 3.6606 7.3931 115.9643 65.5755 31.7401 176.9521 19 C 4.4213 8.4094 115.8560 57.7417 29.1085 176.5924 20 G 3.5061 9.4296 108.9015 46.1470 0.0000 175.6865 21 E 3.9988 9.1418 122.1164 59.1193 29.5624 177.9973 22 R 3.9146 7.8514 117.4505 58.4437 30.2562 177.4554 23 G 3.8822 9.4070 102.6681 45.3474 0.0000 171.4079 24 F 4.7969 7.6094 111.9774 56.2588 40.0422 172.6838 25 F 4.9726 8.1663 115.7592 55.0303 39.7056 174.2821 26 Y 4.8050 8.9298 124.9894 56.2900 39.1664 175.1915 27 T 4.2684 8.0907 118.8573 58.4427 69.1605 172.4246 28 P 4.0151 0.0000 0.0000 65.8507 31.3266 178.2008 29 K 4.0283 7.8432 118.8356 59.1762 32.4853 176.4295 30 T 4.0470 7.3930 118.7118 63.8883 68.2688 173.6820 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 F 8.32 4.60 0.00 2.32 2.15 0.00 0.00 0.00 0.00 0.00 0.00 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 V 8.03 4.22 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 0.93 0.00 0.00 0.93 0.00 0.00 3 N 9.41 4.55 0.00 2.71 2.68 0.00 0.00 7.02 7.08 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 4 Q 8.05 4.63 0.00 2.03 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.73 0.00 0.00 0.00 0.00 0.00 2.27 2.43 0.00 5 H 8.53 4.38 0.00 3.11 3.23 0.00 5.64 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6 L 8.40 4.72 0.00 1.56 1.54 0.89 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 7 C 8.36 4.95 0.00 2.97 2.81 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 0.00 0.00 0.00 8 G 8.40 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 9 S 8.55 4.08 0.00 3.89 4.05 0.00 0.00 0.00 0.00 0.00 0.00 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 H 8.14 4.25 0.00 3.32 3.36 0.00 5.61 0.00 0.00 0.00 0.00 6.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 L 7.82 3.96 0.00 1.79 1.76 0.87 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 12 V 7.35 3.32 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.13 0.00 0.00 0.81 0.00 0.00 13 E 8.06 3.92 0.00 2.17 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 2.28 2.43 0.00 14 A 7.74 3.95 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 15 L 7.72 3.58 0.00 0.59 0.34 0.63 0.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 16 Y 7.59 4.21 0.00 3.25 3.16 0.00 0.00 0.00 0.00 0.00 0.00 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 L 7.95 3.84 0.00 1.77 1.68 0.93 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 18 V 7.39 3.66 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 0.83 0.00 0.00 0.88 0.00 0.00 19 C 8.41 4.42 0.00 3.10 3.03 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 20 G 9.43 3.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 E 9.14 4.00 0.00 1.94 2.03 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 2.31 2.39 0.00 22 R 7.85 3.91 0.00 1.86 2.05 0.00 3.17 0.00 0.00 3.23 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.83 0.00 23 G 9.41 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 24 F 7.61 4.80 0.00 2.91 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 25 F 8.17 4.97 0.00 3.27 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 26 Y 8.93 4.81 0.00 3.16 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 27 T 8.09 4.27 4.20 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 1.30 0.00 0.00 28 P 0.00 4.02 0.00 2.11 2.12 0.00 3.35 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.84 0.00 29 K 7.84 4.03 0.00 1.71 1.83 0.00 1.77 0.00 0.00 1.68 0.00 0.00 2.98 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.40 1.44 7.81 30 T 7.39 4.05 4.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.