NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- -2 P 4.3935 0.0000 0.0000 62.3407 32.1662 173.1423 -1 Q 4.5236 8.2802 118.3500 55.7670 31.2940 171.3350 -1 E 4.5336 8.3802 118.7500 56.6670 31.7940 171.9350 2 E 4.7293 9.2707 124.0045 54.4603 32.9249 175.6338 3 I 4.0956 8.0126 122.5626 60.0173 38.1415 174.4696 4 P 4.3770 0.0000 0.0000 62.7033 31.7856 175.7512 *5 I 4.2569 8.1491 114.3539 59.3202 38.9745 174.8742 6 Y 4.3930 8.3590 127.0692 59.3560 37.9241 175.0359 7 L 4.3636 8.7945 125.6690 54.9340 41.4593 174.1949 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 P 0.00 4.39 0.00 2.11 1.83 0.00 3.68 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.59 0.00 -1 Q 8.28 4.52 0.00 2.06 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.07 6.46 0.00 0.00 0.00 0.00 0.00 2.25 2.44 0.00 -1 E 8.38 4.53 0.00 2.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 2.39 0.00 2 E 9.27 4.73 0.00 1.93 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 2.24 0.00 3 I 8.01 4.10 1.88 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.47 0.93 0.00 0.00 4 P 0.00 4.38 0.00 2.04 1.97 0.00 3.65 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.07 0.00 *5 I 8.15 4.26 1.87 0.00 0.00 0.87 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 0.90 0.91 0.00 0.00 6 Y 8.36 4.39 0.00 2.90 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 7 L 8.79 4.36 0.00 1.82 1.96 0.96 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 0.00 0.00 0.00 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.