NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.9560 8.2127 109.7398 45.6245 0.0000 175.5111 2 I 3.1576 8.1659 118.7353 62.9980 37.8987 172.9163 3 V 3.4966 7.4706 119.2096 66.0198 31.7128 177.2433 4 E 4.0143 7.9588 116.3558 58.9008 29.7127 178.1108 5 Q 4.2267 7.5332 119.6704 58.0023 29.2564 175.4199 6 C 5.0300 7.9717 113.6866 56.6204 41.7529 173.6143 7 C 4.6268 8.3367 117.5180 61.5168 29.8433 175.7146 8 T 4.0400 8.0404 107.9571 64.3991 69.0631 174.1848 9 S 4.7833 7.6065 118.8868 57.0086 64.5820 172.5676 10 I 4.5229 8.0672 122.3001 60.6410 40.4491 176.0300 11 C 5.0303 8.7541 125.3422 55.6938 40.1049 173.6210 12 S 4.6300 8.6802 118.4967 57.0205 64.3608 174.5647 13 L 4.2724 8.1078 118.9636 57.0197 40.4146 177.3844 14 Y 4.4263 7.6657 118.1870 60.6134 38.1773 177.7549 15 Q 4.0149 8.0705 118.5520 58.6033 29.0722 177.9924 16 L 4.2723 7.7409 120.0270 57.6480 42.2178 178.2935 17 E 4.0768 7.7491 118.6167 58.6203 29.2801 178.1321 18 N 4.2267 7.2670 115.9138 56.4487 38.5357 175.3534 19 Y 4.5089 7.0554 114.1788 58.6333 37.6386 175.3173 20 C 4.5111 7.8070 119.0968 58.6474 29.6233 173.3690 21 N 4.5075 8.4864 117.9654 54.0548 38.5757 174.4595 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 3.96 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 0.00 0.00 0.00 2 I 8.17 3.16 1.34 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 1.22 0.77 0.76 0.00 0.00 3 V 7.47 3.50 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 1.08 0.00 0.00 0.87 0.00 0.00 4 E 7.96 4.01 0.00 2.16 2.07 0.00 0.00 0.00 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 2.31 0.00 5 Q 7.53 4.23 0.00 2.39 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.90 0.00 0.00 0.00 0.00 0.00 2.44 2.46 0.00 6 C 7.97 5.03 0.00 3.22 3.01 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 0.00 0.00 0.00 7 C 8.34 4.63 0.00 2.97 2.92 0.00 0.00 0.00 0.00 0.00 0.00 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 8.04 4.04 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 9 S 7.61 4.78 0.00 4.07 3.85 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 0.00 0.00 0.00 10 I 8.07 4.52 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 0.85 0.93 0.00 0.00 11 C 8.75 5.03 0.00 3.05 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 12 S 8.68 4.63 0.00 4.16 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 8.11 4.27 0.00 1.68 1.67 0.45 0.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 14 Y 7.67 4.43 0.00 3.07 3.01 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 0.00 0.00 0.00 15 Q 8.07 4.01 0.00 2.25 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.92 0.00 0.00 0.00 0.00 0.00 2.50 2.46 0.00 16 L 7.74 4.27 0.00 2.10 1.71 0.99 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 17 E 7.75 4.08 0.00 2.36 2.11 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 2.31 2.34 0.00 18 N 7.27 4.23 0.00 2.01 2.49 0.00 0.00 7.03 7.34 0.00 0.00 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 7.06 4.51 0.00 3.21 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 7.81 4.51 0.00 2.99 2.90 0.00 0.00 0.00 0.00 0.00 0.00 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 8.49 4.51 0.00 2.67 2.69 0.00 0.00 6.78 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