NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 M 4.4383 8.2893 120.3268 54.3992 34.2528 175.3875 4 P 4.3739 0.0000 0.0000 60.3728 32.2896 173.5968 5 P 4.3678 0.0000 0.0000 62.7843 32.8543 177.3690 6 T 4.1038 8.1396 117.1370 63.3863 69.0846 174.6600 7 L 4.2710 8.2053 125.3207 53.6598 42.5472 175.4339 8 P 4.3893 0.0000 0.0000 62.1312 32.0161 175.9135 9 H 4.0859 8.7043 121.5016 56.3975 30.2170 174.6948 10 R 4.0153 7.8043 122.3351 54.3430 31.4754 174.8283 11 D 4.6227 7.2679 118.7921 53.8589 41.1990 176.6997 12 W 4.7654 6.7061 122.2603 56.7979 28.2540 174.5314 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 3 M 8.29 4.44 0.00 2.03 2.20 0.00 0.00 0.00 0.00 0.00 -0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.54 0.00 4 P 0.00 4.37 0.00 2.26 2.06 0.00 3.79 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 1.96 2.05 0.00 5 P 0.00 4.37 0.00 2.06 2.05 0.00 3.68 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.13 0.00 6 T 8.14 4.10 4.24 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 1.20 0.00 0.00 7 L 8.21 4.27 0.00 1.62 1.58 0.93 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 8 P 0.00 4.39 0.00 1.99 1.96 0.00 3.68 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.06 0.00 9 H 8.70 4.09 0.00 3.00 3.16 0.00 5.88 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 10 R 7.80 4.02 0.00 0.67 1.33 0.00 3.08 0.00 0.00 3.14 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.94 0.00 11 D 7.27 4.62 0.00 2.57 2.69 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 12 W 6.71 4.77 0.00 3.31 3.19 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