NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 R 4.2731 8.2549 120.8598 55.9255 31.1394 175.3339 2 Q 4.0821 8.4932 124.3677 54.9034 30.2305 177.1409 3 A 4.3448 7.9637 124.1950 51.4213 18.8646 177.1403 *5 L 4.0889 8.2065 116.6593 56.6419 41.5888 176.2814 6 S 4.7574 8.5073 114.6645 56.3647 64.2360 173.3580 7 I 4.7298 8.1555 119.8587 59.1257 40.4004 174.5840 8 S 4.7903 8.3167 117.7774 56.5842 66.1750 174.5807 9 V 3.8129 8.3166 115.2812 61.8231 31.3163 176.2692 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 R 8.25 4.27 0.00 1.79 1.91 0.00 3.20 0.00 0.00 3.22 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.66 0.00 2 Q 8.49 4.08 0.00 2.16 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.59 6.81 0.00 0.00 0.00 0.00 0.00 2.36 2.42 0.00 3 A 7.96 4.34 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.21 4.09 0.00 1.77 1.73 0.92 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 6 S 8.51 4.76 0.00 3.82 3.76 0.00 0.00 0.00 0.00 0.00 0.00 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 I 8.16 4.73 1.87 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.84 0.91 0.00 0.00 8 S 8.32 4.79 0.00 3.83 3.76 0.00 0.00 0.00 0.00 0.00 0.00 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 V 8.32 3.81 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 0.65 0.00 0.00 0.93 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.