NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 7 K 4.0589 8.4145 121.7884 56.0393 32.5029 175.1036 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 7 K 8.41 4.06 0.00 1.73 1.76 0.00 1.79 0.00 0.00 1.70 0.00 0.00 2.98 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.32 1.39 7.81