NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 Q 4.2334 8.3444 121.7111 55.9093 30.2765 173.6413 2 Q 4.1623 8.3094 121.3390 53.8832 30.0396 172.8585 3 Q 4.3805 8.5439 125.8607 54.2160 30.8666 174.6155 4 Q 4.0464 8.6253 126.9761 56.3195 29.7246 175.0210 5 Q 4.5225 8.4986 123.8221 54.5821 30.1791 174.9663 6 Q 4.7548 8.3615 120.4153 54.2042 32.3937 174.6574 7 Q 4.4405 8.1587 119.2353 54.4226 31.9800 174.0288 8 Q 4.0683 8.6831 126.7472 56.3960 29.6275 176.1060 9 Q 4.0963 8.7953 124.6504 58.2249 29.1974 176.1976 10 Q 4.3893 7.9652 117.6909 55.5901 30.6023 175.2563 11 G 4.0202 8.7390 112.2621 45.7932 0.0000 173.0723 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 4.23 0.00 2.03 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.79 0.00 0.00 0.00 0.00 0.00 2.24 2.36 0.00 2 Q 8.31 4.16 0.00 2.13 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.75 6.66 0.00 0.00 0.00 0.00 0.00 2.29 2.41 0.00 3 Q 8.54 4.38 0.00 2.04 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.69 0.00 0.00 0.00 0.00 0.00 2.28 2.33 0.00 4 Q 8.63 4.05 0.00 2.05 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.57 6.52 0.00 0.00 0.00 0.00 0.00 2.34 2.38 0.00 5 Q 8.50 4.52 0.00 2.07 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.57 0.00 0.00 0.00 0.00 0.00 2.29 2.30 0.00 6 Q 8.36 4.75 0.00 1.99 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.65 0.00 0.00 0.00 0.00 0.00 2.24 2.29 0.00 7 Q 8.16 4.44 0.00 1.93 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.91 0.00 0.00 0.00 0.00 0.00 2.24 2.40 0.00 8 Q 8.68 4.07 0.00 2.03 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.86 0.00 0.00 0.00 0.00 0.00 2.34 2.56 0.00 9 Q 8.80 4.10 0.00 2.08 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.52 0.00 0.00 0.00 0.00 0.00 2.36 2.29 0.00 10 Q 7.97 4.39 0.00 2.00 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.54 0.00 0.00 0.00 0.00 0.00 2.27 2.33 0.00 11 G 8.74 4.02 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 0.00 0.00 0.00 0.00 0.00 0.00