NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- *1 F 4.6534 8.1827 119.0102 56.0233 40.7025 176.3336 2 V 3.5764 7.7007 120.6079 66.4608 31.3358 175.8709 3 N 4.3254 9.0236 117.2226 56.6658 38.8696 176.7486 4 Q 4.0443 8.0571 118.7529 59.0587 28.6192 178.0707 5 H 4.2406 7.8874 118.2321 59.2721 30.0263 177.0889 6 L 4.0963 8.1873 120.9454 57.7428 41.3868 178.9617 7 C 4.2373 8.3630 118.9033 62.5614 31.5465 175.9638 8 G 3.6214 8.2646 107.1604 47.6534 0.0000 175.5477 9 S 3.9506 7.7021 115.4241 61.6579 62.3790 175.9616 10 H 4.2744 8.0255 118.3155 58.3275 28.5265 177.5028 11 L 3.9251 7.9622 121.0989 58.0337 41.5205 180.0784 12 V 3.2244 7.4524 112.1603 64.0376 31.3773 178.3188 13 E 3.9180 7.7462 117.7553 58.9650 29.3595 178.7572 14 A 3.9541 8.0151 121.0046 55.0288 18.3775 179.5523 15 L 3.6228 7.8373 117.8155 57.8046 41.2181 179.0481 16 Y 4.1632 7.6206 119.3526 60.7255 38.5094 178.3840 17 L 3.8350 7.5154 118.0311 57.7666 41.8718 179.3400 18 V 3.6692 7.7410 117.1978 66.2266 31.9196 177.5426 19 C 4.3045 8.6165 116.5316 59.8749 28.3292 175.3486 20 G 3.6961 8.1779 109.3596 46.2823 0.0000 177.0140 21 E 4.0358 8.8662 122.5589 58.9137 29.4889 178.2615 22 R 3.8890 7.7657 117.5403 57.3047 30.2025 177.7397 23 G 3.9681 9.3649 104.9169 45.2658 0.0000 171.5331 24 F 4.9273 7.6304 111.9612 55.9147 40.1950 172.9861 25 F 4.8334 8.3628 115.9651 54.9604 39.6455 173.9901 26 Y 4.5910 8.8188 125.7822 55.9397 39.7905 175.1180 27 T 4.3343 7.8014 117.7967 58.9210 69.5369 172.4469 28 P 4.1652 0.0000 0.0000 64.1072 31.5953 177.6226 29 K 4.0734 7.4464 126.1563 55.2927 31.4839 181.5215 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 8.18 4.65 0.00 2.22 2.35 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 2 V 7.70 3.58 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 1.01 0.00 0.00 0.94 0.00 0.00 3 N 9.02 4.33 0.00 2.79 2.87 0.00 0.00 7.16 7.86 0.00 0.00 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 8.06 4.04 0.00 2.30 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.91 0.00 0.00 0.00 0.00 0.00 2.48 2.44 0.00 5 H 7.89 4.24 0.00 3.15 3.55 0.00 5.95 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6 L 8.19 4.10 0.00 1.90 1.72 0.94 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 7 C 8.36 4.24 0.00 3.07 3.10 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 8 G 8.26 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.70 3.95 0.00 3.72 3.91 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 10 H 8.03 4.27 0.00 3.34 3.29 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 7.96 3.93 0.00 1.78 1.64 1.04 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 12 V 7.45 3.22 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 0.09 0.00 0.00 0.83 0.00 0.00 13 E 7.75 3.92 0.00 2.03 2.01 0.00 0.00 0.00 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 2.36 0.00 14 A 8.02 3.95 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.84 3.62 0.00 0.64 0.49 0.70 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 16 Y 7.62 4.16 0.00 3.19 3.13 0.00 0.00 0.00 0.00 0.00 0.00 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 7.52 3.84 0.00 1.76 1.67 0.94 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 18 V 7.74 3.67 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 0.79 0.00 0.00 0.92 0.00 0.00 19 C 8.62 4.30 0.00 3.14 3.17 0.00 0.00 0.00 0.00 0.00 0.00 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 8.18 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.87 4.04 0.00 1.96 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 2.29 2.32 0.00 22 R 7.77 3.89 0.00 2.01 2.05 0.00 3.22 0.00 0.00 3.25 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.59 0.00 23 G 9.36 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.63 4.93 0.00 3.02 2.97 0.00 0.00 0.00 0.00 0.00 0.00 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 8.36 4.83 0.00 3.21 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 8.82 4.59 0.00 3.17 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 27 T 7.80 4.33 4.25 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 1.38 0.00 0.00 28 P 0.00 4.17 0.00 2.15 2.03 0.00 3.62 0.00 0.00 2.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 1.97 0.00 29 K 7.45 4.07 0.00 1.79 1.64 0.00 1.84 0.00 0.00 1.74 0.00 0.00 2.94 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.40 1.27 7.81 * Residues marked with a * may have inaccurate shift predictions.