NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 R 4.2099 8.2544 120.8605 55.7242 32.3736 174.4123 2 C 4.2621 7.7828 118.1833 58.3730 32.4186 171.9233 3 C 4.8363 8.9228 123.1248 59.4651 29.8105 172.4531 4 H 4.8784 7.7934 119.2854 53.3771 32.5839 172.1764 5 P 4.2387 0.0000 0.0000 65.9123 31.4458 178.4057 6 Q 4.0146 8.4667 118.1623 59.0513 29.1096 176.0818 7 C 4.4507 7.9161 110.9634 58.3098 29.5200 173.8678 8 G 3.8150 7.9397 106.6060 46.4196 0.0000 173.8547 9 M 3.9244 8.0788 118.4043 56.0717 32.5031 174.9661 10 V 4.1411 8.5282 124.5309 63.9226 33.2741 174.9680 11 E 4.6594 7.6915 116.2302 53.9529 31.4154 175.4789 12 E 4.1487 8.5993 120.6968 57.0245 30.2924 176.9379 13 C 4.4219 8.3947 116.7271 60.0760 28.6842 174.2365 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 R 8.25 4.21 0.00 1.77 1.93 0.00 3.24 0.00 0.00 3.22 7.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.69 0.00 2 C 7.78 4.26 0.00 3.06 2.82 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 3 C 8.92 4.84 0.00 2.97 2.89 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 4 H 7.79 4.88 0.00 3.10 3.07 0.00 5.70 0.00 0.00 0.00 0.00 6.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5 P 0.00 4.24 0.00 2.16 2.08 0.00 2.96 0.00 0.00 3.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.02 0.00 6 Q 8.47 4.01 0.00 2.07 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 7.58 0.00 0.00 0.00 0.00 0.00 2.35 2.37 0.00 7 C 7.92 4.45 0.00 3.09 3.00 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 8 G 7.94 3.82 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 9 M 8.08 3.92 0.00 1.98 2.12 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.68 2.54 0.00 10 V 8.53 4.14 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 0.91 0.00 0.00 1.00 0.00 0.00 11 E 7.69 4.66 0.00 2.09 1.91 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 2.19 2.30 0.00 12 E 8.60 4.15 0.00 1.97 1.93 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 2.31 2.34 0.00 13 C 8.39 4.42 0.00 2.92 2.79 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