NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 4.0362 8.2127 109.7330 46.5321 0.0000 176.0403 2 I 3.0477 7.2774 120.4715 62.7490 37.7179 171.3695 3 V 3.4388 8.6685 119.3764 66.5422 31.5881 176.7624 4 E 3.9566 8.1030 117.0318 59.8014 29.0037 179.4643 5 Q 4.2393 7.7977 117.3516 57.8777 28.8878 176.6533 6 C 4.7475 8.2424 116.0552 56.1715 41.0573 174.0787 7 C 4.4562 7.7100 117.9976 61.8142 29.0722 175.5118 8 T 4.0714 7.5015 113.7396 65.6305 68.1206 174.9823 9 S 4.8253 7.4505 116.5804 56.0143 66.0797 173.1979 10 I 4.1572 8.1946 116.2820 60.7649 37.8700 176.0865 11 C 4.8667 8.6053 123.5234 55.6584 42.5895 174.4632 12 S 4.5312 8.7328 119.7951 57.4071 65.2318 175.1700 13 L 3.7861 8.1006 122.4941 58.3910 41.3623 178.3931 14 Y 4.0767 7.0985 115.5638 61.0261 38.0497 177.8622 15 Q 4.2912 8.2040 119.0224 58.9554 28.8845 178.6456 16 L 4.2758 8.2369 120.1281 57.6168 41.5144 179.0382 17 E 4.0211 8.2370 119.2564 59.0270 29.2346 178.5315 18 N 4.2951 7.5997 115.9089 55.7231 38.5621 175.2548 19 Y 4.5305 7.4119 115.6770 58.2978 38.4166 175.4426 20 C 4.5010 7.5698 118.0717 59.1913 29.1624 173.4928 21 N 4.5474 8.5075 117.1941 53.7443 38.2863 175.5207 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 8.21 4.04 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 0.00 0.00 0.00 2 I 7.28 3.05 0.56 0.00 0.00 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 1.11 0.59 0.00 0.00 3 V 8.67 3.44 2.03 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 0.98 0.00 0.00 0.85 0.00 0.00 4 E 8.10 3.96 0.00 2.10 2.01 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 2.41 2.48 0.00 5 Q 7.80 4.24 0.00 2.02 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.67 0.00 0.00 0.00 0.00 0.00 2.70 2.66 0.00 6 C 8.24 4.75 0.00 2.97 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 7 C 7.71 4.46 0.00 3.09 2.95 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 0.00 0.00 0.00 8 T 7.50 4.07 4.39 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 7.45 4.83 0.00 4.04 3.73 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 8.19 4.16 1.88 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 1.43 0.55 0.92 0.00 0.00 11 C 8.61 4.87 0.00 3.02 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 12 S 8.73 4.53 0.00 4.21 4.12 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 13 L 8.10 3.79 0.00 1.49 1.11 0.76 0.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 14 Y 7.10 4.08 0.00 3.11 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 15 Q 8.20 4.29 0.00 2.35 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.80 0.00 0.00 0.00 0.00 0.00 2.42 2.48 0.00 16 L 8.24 4.28 0.00 1.81 1.77 1.03 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 17 E 8.24 4.02 0.00 2.29 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 18 N 7.60 4.30 0.00 1.99 2.54 0.00 0.00 6.98 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 Y 7.41 4.53 0.00 3.01 2.93 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 0.00 0.00 0.00 20 C 7.57 4.50 0.00 2.94 2.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 N 8.51 4.55 0.00 2.72 2.73 0.00 0.00 6.76 7.56 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