NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 V 4.0411 8.0549 120.3925 61.8546 31.6505 175.1364 2 P 4.3119 0.0000 0.0000 60.7699 31.9736 174.3165 3 P 4.3832 0.0000 0.0000 61.9365 32.7137 174.2413 4 P 4.3820 0.0000 0.0000 62.2720 31.7696 176.6613 5 V 3.7388 8.2031 123.2739 61.7985 32.1775 173.8757 6 P 4.3730 0.0000 0.0000 61.5187 31.8015 174.5747 7 P 4.3581 0.0000 0.0000 62.5009 31.0494 176.5157 8 R 3.9928 8.1902 120.2326 56.6212 30.3583 176.9026 9 R 4.0738 8.6552 117.7851 57.0331 28.1286 176.2647 10 R 4.1137 8.2979 120.5322 56.4169 30.1064 176.8707 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 V 8.05 4.04 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 0.99 0.00 0.00 0.93 0.00 0.00 2 P 0.00 4.31 0.00 2.16 1.96 0.00 3.75 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.16 0.00 3 P 0.00 4.38 0.00 2.03 2.00 0.00 3.67 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.09 0.00 4 P 0.00 4.38 0.00 2.17 2.07 0.00 3.77 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.95 0.00 5 V 8.20 3.74 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 0.77 0.00 0.00 0.93 0.00 0.00 6 P 0.00 4.37 0.00 2.08 1.97 0.00 3.73 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.07 0.00 7 P 0.00 4.36 0.00 2.17 2.09 0.00 3.76 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.95 0.00 8 R 8.19 3.99 0.00 1.92 1.97 0.00 3.04 0.00 0.00 3.22 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.71 0.00 9 R 8.66 4.07 0.00 1.87 2.40 0.00 3.20 0.00 0.00 3.22 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.57 0.00 10 R 8.30 4.11 0.00 1.78 1.84 0.00 3.29 0.00 0.00 3.26 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.68 0.00