NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- *1 F 4.6924 8.1676 119.0110 56.8388 40.6853 177.0451 2 V 3.5863 7.7248 121.9603 62.7386 31.2485 176.2830 3 N 4.2984 9.0280 118.7119 56.0600 37.2963 178.2515 4 Q 4.0552 8.0494 119.7137 58.5727 28.7853 177.8145 5 H 4.1842 8.2703 119.4667 59.3435 29.4975 177.4026 6 L 3.9634 8.2151 120.9726 57.8169 41.4295 178.9656 7 C 4.2316 8.3384 118.8462 62.5688 31.5398 175.9144 8 G 3.6678 8.4329 107.4894 47.7149 0.0000 175.4589 9 S 3.9703 7.6928 115.1464 61.7408 62.3774 176.0996 10 H 3.9708 7.9305 118.0899 58.3448 28.3900 177.6553 11 L 3.9603 7.9510 121.0263 58.1110 41.5557 180.1138 12 V 3.3292 7.6137 111.9236 64.1741 31.3816 178.5457 13 E 4.0352 7.6334 118.1159 59.0575 29.2324 179.1129 14 A 3.9820 8.0917 121.0076 55.0799 18.4007 179.6449 15 L 3.6524 7.9041 117.7353 57.9089 41.3566 179.1307 16 Y 4.3194 7.8585 119.4625 60.5801 38.5176 177.9563 17 L 3.8328 7.6910 120.2102 58.2800 42.3508 179.0565 18 V 3.7683 7.6661 111.1921 64.4237 31.9028 178.1031 19 C 4.3204 8.5398 116.4643 60.0561 28.2863 175.5766 20 G 3.7255 8.2403 109.9731 45.7485 0.0000 175.9004 21 E 3.9541 8.9762 120.3384 59.1394 29.2976 178.5202 22 R 3.8672 7.7080 117.5685 57.1358 30.2336 177.6369 23 G 3.8985 9.1391 105.3238 45.3496 0.0000 171.6954 24 F 4.8718 7.3522 110.9155 56.3657 39.8385 172.9438 25 F 4.5394 9.1780 120.0514 55.7037 40.9820 174.5005 26 Y 4.7605 8.8342 126.3609 55.9885 39.9239 175.1110 27 T 4.3325 7.8714 117.4887 58.9304 69.9254 171.8429 28 P 4.1027 0.0000 0.0000 64.6852 31.9254 176.8187 29 K 4.1372 7.8392 122.2217 56.3841 32.1736 176.1184 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 8.17 4.69 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 2 V 7.72 3.59 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.77 0.00 0.00 0.96 0.00 0.00 3 N 9.03 4.30 0.00 2.95 3.15 0.00 0.00 6.26 7.48 0.00 0.00 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 4.06 0.00 2.31 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.94 0.00 0.00 0.00 0.00 0.00 2.48 2.44 0.00 5 H 8.27 4.18 0.00 3.27 3.55 0.00 5.78 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 8.22 3.96 0.00 1.87 1.73 0.95 1.04 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 7 C 8.34 4.23 0.00 3.08 3.11 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 8 G 8.43 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.69 3.97 0.00 3.72 3.90 0.00 0.00 0.00 0.00 0.00 0.00 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 7.93 3.97 0.00 3.35 3.31 0.00 5.68 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 L 7.95 3.96 0.00 1.76 1.71 1.05 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 12 V 7.61 3.33 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 0.16 0.00 0.00 0.86 0.00 0.00 13 E 7.63 4.04 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 2.24 2.39 0.00 14 A 8.09 3.98 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.90 3.65 0.00 0.95 0.38 0.81 0.82 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 16 Y 7.86 4.32 0.00 3.30 3.18 0.00 0.00 0.00 0.00 0.00 0.00 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 7.69 3.83 0.00 1.73 1.83 0.90 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 18 V 7.67 3.77 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 0.83 0.00 0.00 0.93 0.00 0.00 19 C 8.54 4.32 0.00 3.20 3.25 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 20 G 8.24 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.98 3.95 0.00 2.08 2.10 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 2.26 2.34 0.00 22 R 7.71 3.87 0.00 2.06 2.10 0.00 3.24 0.00 0.00 3.25 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.60 0.00 23 G 9.14 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.35 4.87 0.00 3.22 3.05 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 25 F 9.18 4.54 0.00 3.08 3.09 0.00 0.00 0.00 0.00 0.00 0.00 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 8.83 4.76 0.00 3.19 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 27 T 7.87 4.33 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 1.32 0.00 0.00 28 P 0.00 4.10 0.00 2.18 2.10 0.00 3.61 0.00 0.00 3.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 2.02 0.00 29 K 7.84 4.14 0.00 1.74 1.74 0.00 1.79 0.00 0.00 1.75 0.00 0.00 3.00 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.38 1.41 7.81 * Residues marked with a * may have inaccurate shift predictions.