NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 0 R 4.2871 8.2549 120.8624 55.6319 31.2199 175.3286 1 L 3.9733 8.4164 125.1542 53.6525 42.2423 175.0055 2 Y 4.3520 8.4015 122.8993 58.0852 39.9642 175.8770 3 Q 3.9627 8.5862 126.0204 58.7225 29.3555 176.4919 4 N 4.0123 6.7774 115.8014 52.0770 39.3868 172.2119 5 P 4.1005 0.0000 0.0000 62.8014 31.6363 176.4521 6 T 4.0918 8.2532 114.0843 61.9267 69.3870 174.0650 7 T 4.2335 8.0969 120.7000 62.5562 69.8594 174.4883 8 Y 4.3563 8.0657 121.9768 57.7562 38.7488 176.1794 9 I 3.9603 8.3968 122.1846 61.8413 37.1917 176.1487 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 0 R 8.25 4.29 0.00 1.80 1.92 0.00 3.22 0.00 0.00 3.23 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.67 0.00 1 L 8.42 3.97 0.00 1.77 1.62 0.93 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 2 Y 8.40 4.35 0.00 2.78 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 3 Q 8.59 3.96 0.00 2.09 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.71 0.00 0.00 0.00 0.00 0.00 2.14 2.21 0.00 4 N 6.78 4.01 0.00 2.38 1.77 0.00 0.00 6.97 7.69 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 5 P 0.00 4.10 0.00 2.00 1.93 0.00 3.61 0.00 0.00 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 2.00 0.00 6 T 8.25 4.09 4.25 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 1.29 0.00 0.00 7 T 8.10 4.23 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 1.25 0.00 0.00 8 Y 8.07 4.36 0.00 3.00 2.86 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 I 8.40 3.96 1.93 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.78 0.94 0.00 0.00