NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 Q 4.2846 8.3444 118.8243 55.4552 30.0035 174.1151 2 Q 3.8453 8.4262 118.8952 55.3805 29.4331 173.3055 3 Q 4.4811 8.4709 124.7281 53.9721 31.2997 174.6340 4 Q 4.0547 8.6358 126.9477 56.2073 29.7271 174.8861 5 Q 4.5444 8.5192 124.1067 54.5556 30.2130 174.8907 6 Q 4.7748 8.3841 120.2714 54.2030 32.7173 174.6234 7 Q 4.5533 8.1577 116.8735 54.2220 32.6804 175.2789 8 Q 4.1821 8.5754 121.6483 55.9959 29.3703 176.7078 9 Q 4.0787 8.6841 121.2921 57.6968 29.2632 175.8888 10 Q 4.5559 8.0113 118.9763 54.1468 30.4576 175.2436 11 G 3.7357 8.4118 113.1344 45.9158 0.0000 171.9352 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 Q 8.34 4.28 0.00 2.18 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.93 0.00 0.00 0.00 0.00 0.00 2.22 2.36 0.00 2 Q 8.43 3.85 0.00 2.11 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.88 6.72 0.00 0.00 0.00 0.00 0.00 2.34 2.41 0.00 3 Q 8.47 4.48 0.00 2.04 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.69 0.00 0.00 0.00 0.00 0.00 2.26 2.32 0.00 4 Q 8.64 4.05 0.00 2.05 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.52 6.51 0.00 0.00 0.00 0.00 0.00 2.34 2.38 0.00 5 Q 8.52 4.54 0.00 2.07 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.43 6.58 0.00 0.00 0.00 0.00 0.00 2.29 2.30 0.00 6 Q 8.38 4.77 0.00 1.98 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.69 0.00 0.00 0.00 0.00 0.00 2.24 2.33 0.00 7 Q 8.16 4.55 0.00 1.97 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.93 0.00 0.00 0.00 0.00 0.00 2.25 2.36 0.00 8 Q 8.58 4.18 0.00 2.04 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 7.13 0.00 0.00 0.00 0.00 0.00 2.36 2.32 0.00 9 Q 8.68 4.08 0.00 2.04 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.72 0.00 0.00 0.00 0.00 0.00 2.36 2.29 0.00 10 Q 8.01 4.56 0.00 1.99 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.84 0.00 0.00 0.00 0.00 0.00 2.25 2.33 0.00 11 G 8.41 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00