NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.2363 8.1633 120.2897 55.0876 33.9295 177.2881 2 W 4.3571 7.9849 116.6566 57.8005 29.2929 175.0646 3 D 4.5521 8.4147 118.1356 57.0680 41.6151 176.1035 4 F 4.6061 7.9707 113.1637 56.5679 38.7439 173.6740 5 D 4.1290 7.7388 118.4914 52.8575 44.8651 176.4104 6 D 4.4638 7.8436 124.2963 53.4025 39.2791 176.5079 *8 M 4.2663 7.5549 114.7296 54.2174 32.2938 174.6620 9 P 4.4671 0.0000 0.0000 61.3055 32.1102 174.1044 10 P 4.3194 0.0000 0.0000 63.6524 31.4372 176.4756 11 A 4.7205 8.3369 123.8726 51.4644 19.5371 175.9597 12 D 4.5985 7.7443 116.7311 55.3047 44.7509 175.8228 13 E 4.0950 8.0250 117.7553 56.3286 30.0929 175.4691 14 D 4.5137 6.1843 128.4616 53.6372 41.6288 174.5745 15 Y 5.0449 7.4164 110.6917 58.0690 39.0515 178.2791 16 S 4.6882 7.7203 116.1653 55.9640 62.9779 173.1875 17 P 4.4378 0.0000 0.0000 62.7430 31.1538 177.2531 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 M 8.16 4.24 0.00 1.45 0.93 0.00 0.00 0.00 0.00 0.00 -0.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 2.25 0.00 2 W 7.98 4.36 0.00 3.59 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 3 D 8.41 4.55 0.00 2.74 2.84 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 0.00 0.00 0.00 4 F 7.97 4.61 0.00 3.18 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 5 D 7.74 4.13 0.00 2.49 2.37 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 6 D 7.84 4.46 0.00 2.58 2.65 0.00 0.00 0.00 0.00 0.00 0.00 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 M 7.55 4.27 0.00 2.57 2.36 0.00 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.53 2.64 0.00 9 P 0.00 4.47 0.00 2.11 2.11 0.00 3.84 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.16 0.00 10 P 0.00 4.32 0.00 2.23 2.22 0.00 3.68 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.07 0.00 11 A 8.34 4.72 1.20 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 0.00 0.00 0.00 12 D 7.74 4.60 0.00 2.79 2.53 0.00 0.00 0.00 0.00 0.00 0.00 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 4.10 0.00 1.94 1.92 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 2.09 2.17 0.00 14 D 6.18 4.51 0.00 2.29 2.17 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 15 Y 7.42 5.04 0.00 2.98 2.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 16 S 7.72 4.69 0.00 3.81 3.79 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.44 0.00 2.19 2.06 0.00 3.86 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.99 0.00 * Residues marked with a * may have inaccurate shift predictions.