NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.9670 8.3544 109.7475 45.7515 0.0000 174.8872 2 I 3.8660 7.8324 120.5093 60.4153 39.3269 169.9524 3 V 3.9034 7.7703 117.5146 63.4547 32.2504 176.0216 4 E 4.2199 8.1269 116.9766 57.5172 30.0486 176.3956 5 Q 4.4440 7.9410 117.3986 56.3531 29.7045 176.6966 6 C 4.9702 7.2266 116.8057 58.9380 41.7388 175.2344 7 C 4.0851 7.7675 118.1439 62.0268 31.1639 174.2108 8 T 4.2885 7.7566 115.3380 64.3547 69.7279 173.8550 9 S 4.9175 7.3541 115.8307 56.6936 66.1667 172.4469 10 I 4.4732 8.0812 120.6895 60.4655 38.4590 176.4540 11 C 4.9201 8.3997 121.8491 54.8967 38.8632 173.9192 12 S 4.3746 8.7272 121.1983 57.7575 63.2435 175.6174 13 L 3.4396 8.7936 125.7562 59.3764 39.5838 178.9846 14 Y 4.4971 7.9135 120.4491 60.3486 38.6620 177.5739 15 Q 4.0936 9.2713 120.2365 58.4227 28.7669 177.4745 16 L 4.4293 7.7117 118.9946 55.8098 42.2771 176.8278 17 E 4.4628 8.3297 118.5082 57.3622 29.2734 176.1570 18 N 4.8801 7.7059 113.6626 54.0478 39.4273 173.8681 19 Y 4.4915 7.8681 113.1133 58.0435 38.5220 175.1310 20 C 4.8276 7.7913 116.4007 57.8845 30.5568 173.8204 21 N 4.5186 8.6069 118.7363 53.7283 38.1608 175.1884 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 3.97 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 0.00 0.00 0.00 2 I 7.83 3.87 1.76 0.00 0.00 0.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.33 0.83 0.00 0.00 3 V 7.77 3.90 2.06 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 0.97 0.00 0.00 0.90 0.00 0.00 4 E 8.13 4.22 0.00 1.98 1.95 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 2.26 2.41 0.00 5 Q 7.94 4.44 0.00 2.31 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.23 6.50 0.00 0.00 0.00 0.00 0.00 2.35 2.38 0.00 6 C 7.23 4.97 0.00 3.00 3.04 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 7.77 4.09 0.00 3.03 2.96 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 7.76 4.29 4.52 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 9 S 7.35 4.92 0.00 4.11 3.78 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 8.08 4.47 1.88 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 0.81 0.91 0.00 0.00 11 C 8.40 4.92 0.00 2.90 2.98 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 8.73 4.37 0.00 4.09 4.06 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 8.79 3.44 0.00 2.07 2.05 0.94 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 14 Y 7.91 4.50 0.00 2.94 3.15 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 9.27 4.09 0.00 2.15 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 6.67 0.00 0.00 0.00 0.00 0.00 2.46 2.48 0.00 16 L 7.71 4.43 0.00 1.72 1.64 0.40 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 17 E 8.33 4.46 0.00 2.27 1.78 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 2.33 2.35 0.00 18 N 7.71 4.88 0.00 2.51 2.44 0.00 0.00 6.68 7.28 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 7.87 4.49 0.00 2.90 2.97 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 20 C 7.79 4.83 0.00 2.94 2.84 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 8.61 4.52 0.00 2.72 2.73 0.00 0.00 6.82 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