NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.8714 8.3544 109.7374 45.9089 0.0000 172.8533 2 I 4.0042 7.6681 120.9899 60.2628 38.9708 174.4899 3 G 3.5111 8.6991 110.0076 47.4044 0.0000 173.5468 4 E 4.6952 8.5195 114.9560 55.5180 32.2704 176.3469 5 Q 3.9150 8.5587 122.7301 59.4741 28.8556 177.4433 6 C 4.4419 8.0671 117.1384 57.1235 42.2973 171.6169 7 C 4.5316 8.4047 125.0583 58.9625 33.2588 174.4097 8 T 4.5653 8.2648 108.5092 59.5149 68.8084 174.2108 9 S 4.8819 7.3503 117.0287 59.2803 63.9131 175.5903 10 I 4.1355 7.8030 121.6563 60.2751 37.7900 176.7027 11 C 4.5457 8.6739 123.5057 55.4560 40.1776 173.5921 12 S 4.2120 8.7394 119.8405 58.8261 62.8307 175.5531 13 L 4.0139 8.9273 124.9869 57.9132 41.0440 178.6564 14 Y 4.1856 8.1620 118.3116 61.2027 38.7062 178.1560 15 Q 4.0002 8.3026 118.4817 58.7027 29.0066 178.0003 16 L 4.2773 7.6974 117.9209 56.3802 41.7978 178.8023 17 E 4.0038 8.2126 119.7440 59.0267 29.1525 178.3621 18 N 4.2109 7.3086 116.2305 56.2065 38.9328 175.8805 19 Y 4.5583 7.1029 116.5340 59.1189 38.3264 175.1436 20 C 3.9752 7.2058 119.7544 59.0137 32.3515 173.3572 21 N 4.5484 8.5822 118.4727 53.6411 38.0915 175.3022 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 G 8.35 3.87 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 2 I 7.67 4.00 1.50 0.00 0.00 0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.89 0.71 0.00 0.00 3 G 8.70 3.51 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 4 E 8.52 4.70 0.00 1.90 1.89 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 2.19 2.25 0.00 5 Q 8.56 3.92 0.00 2.12 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 7.24 0.00 0.00 0.00 0.00 0.00 2.36 2.34 0.00 6 C 8.07 4.44 0.00 2.99 3.05 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 7 C 8.40 4.53 0.00 2.91 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 8 T 8.26 4.57 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 1.22 0.00 0.00 9 S 7.35 4.88 0.00 4.09 3.97 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 10 I 7.80 4.14 1.88 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.59 0.93 0.00 0.00 11 C 8.67 4.55 0.00 2.99 3.10 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 S 8.74 4.21 0.00 4.09 4.08 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 0.00 0.00 0.00 0.00 13 L 8.93 4.01 0.00 1.72 1.83 0.96 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 14 Y 8.16 4.19 0.00 2.89 3.11 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 15 Q 8.30 4.00 0.00 2.32 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 6.67 0.00 0.00 0.00 0.00 0.00 2.35 2.46 0.00 16 L 7.70 4.28 0.00 1.79 1.81 1.06 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 17 E 8.21 4.00 0.00 2.03 1.85 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 2.30 2.45 0.00 18 N 7.31 4.21 0.00 2.32 2.26 0.00 0.00 7.08 7.33 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 19 Y 7.10 4.56 0.00 3.21 2.91 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 0.00 0.00 0.00 20 C 7.21 3.98 0.00 2.95 3.12 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 21 N 8.58 4.55 0.00 2.76 2.73 0.00 0.00 6.78 7.57 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