NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 4.0407 8.3544 109.7427 44.3604 0.0000 174.0592 2 I 3.9033 7.6141 115.6252 60.3504 41.1722 172.4705 3 V 3.4679 7.8449 119.4078 66.0644 32.2074 177.0405 4 E 4.1938 8.0573 117.2415 58.4739 29.5602 177.7146 5 Q 4.2125 7.7983 118.2174 58.4099 29.7848 177.1469 6 C 4.6703 8.5778 116.4719 57.2840 40.6739 174.2068 7 C 4.6788 8.3220 120.5711 59.3491 31.3264 173.7007 8 T 4.4937 7.9358 108.5649 62.6939 69.9303 176.1862 9 S 4.4825 7.7403 115.4247 57.5596 64.5051 169.9419 10 I 3.4551 7.8322 127.7408 60.2894 37.0035 174.6900 11 C 4.6736 8.5157 121.6637 56.2966 38.5520 173.6119 12 S 4.7534 8.4589 116.6277 57.3722 64.7606 175.3542 13 L 3.8902 8.4712 124.8618 58.9353 41.6584 178.7029 14 Y 4.1260 8.0412 115.9393 61.0665 37.3725 178.1647 15 Q 4.2368 8.1776 118.6770 58.9639 28.8887 178.6158 16 L 4.3897 8.1482 120.2137 57.7917 41.5460 179.1738 17 E 4.0278 8.0209 118.3292 59.5177 29.1314 178.9674 18 N 4.1324 7.6400 114.5685 56.2443 38.6589 175.5574 19 Y 4.2961 7.6729 113.6304 58.7783 38.5808 175.5563 20 C 4.1959 7.9158 120.4286 59.5036 32.2366 172.8830 21 N 4.5172 8.5673 120.8764 53.8304 38.5744 174.7981 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 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 7.61 3.90 1.37 0.00 0.00 0.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 0.48 0.77 0.00 0.00 3 V 7.84 3.47 2.05 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 1.03 0.00 0.00 0.88 0.00 0.00 4 E 8.06 4.19 0.00 1.99 1.97 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 2.29 2.36 0.00 5 Q 7.80 4.21 0.00 2.12 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.93 0.00 0.00 0.00 0.00 0.00 2.35 2.49 0.00 6 C 8.58 4.67 0.00 2.92 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 8.32 4.68 0.00 2.82 2.94 0.00 0.00 0.00 0.00 0.00 0.00 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 7.94 4.49 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 1.24 0.00 0.00 9 S 7.74 4.48 0.00 3.84 3.84 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 10 I 7.83 3.46 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 1.43 1.16 0.92 0.00 0.00 11 C 8.52 4.67 0.00 2.98 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 12 S 8.46 4.75 0.00 4.13 3.95 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 13 L 8.47 3.89 0.00 1.53 1.39 0.79 0.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 14 Y 8.04 4.13 0.00 3.19 3.09 0.00 0.00 0.00 0.00 0.00 0.00 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 8.18 4.24 0.00 2.46 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.43 6.97 0.00 0.00 0.00 0.00 0.00 2.55 2.55 0.00 16 L 8.15 4.39 0.00 1.89 1.77 0.92 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 17 E 8.02 4.03 0.00 2.24 2.02 0.00 0.00 0.00 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 2.29 0.00 18 N 7.64 4.13 0.00 2.25 2.46 0.00 0.00 6.89 7.29 0.00 0.00 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 7.67 4.30 0.00 3.17 3.08 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 20 C 7.92 4.20 0.00 2.98 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 8.57 4.52 0.00 2.74 2.68 0.00 0.00 6.88 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