NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- -1 Q 4.2685 8.3401 119.6870 54.3074 29.6969 172.5187 0 A 3.9781 8.1095 130.0950 50.8850 23.5687 171.7571 1 C 3.7179 8.4415 118.4306 58.5486 31.6698 171.7446 2 G 4.4434 8.9765 111.4934 46.2387 0.0000 174.0252 3 V 4.3242 7.0968 119.0679 59.5028 31.5824 172.9585 4 P 4.4474 0.0000 0.0000 62.1115 32.0120 177.0757 5 T 4.0279 8.3964 110.7534 63.0771 69.2620 174.4130 6 I 4.3733 7.3933 122.5733 59.1877 38.6761 175.1483 7 Q 4.1486 8.5213 125.4196 54.8260 29.2414 174.6753 8 P 4.2876 0.0000 0.0000 62.4977 32.0492 176.1112 9 V 4.1580 8.1410 122.2390 61.0001 31.7973 175.1752 10 L 4.2138 8.3139 125.8825 54.8915 41.5932 177.2505 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 Q 8.34 4.27 0.00 2.06 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.92 0.00 0.00 0.00 0.00 0.00 2.26 2.37 0.00 0 A 8.11 3.98 1.25 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 0.00 0.00 0.00 1 C 8.44 3.72 0.00 3.28 3.16 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 2 G 8.98 4.44 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 3 V 7.10 4.32 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 0.83 0.00 0.00 0.98 0.00 0.00 4 P 0.00 4.45 0.00 2.23 1.97 0.00 3.73 0.00 0.00 3.72 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 5 T 8.40 4.03 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 1.21 0.00 0.00 6 I 7.39 4.37 1.87 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.68 0.91 0.00 0.00 7 Q 8.52 4.15 0.00 2.04 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.93 0.00 0.00 0.00 0.00 0.00 2.36 2.35 0.00 8 P 0.00 4.29 0.00 2.17 2.05 0.00 3.71 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 9 V 8.14 4.16 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 0.86 0.00 0.00 0.93 0.00 0.00 10 L 8.31 4.21 0.00 1.68 1.56 0.92 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00