NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.9462 8.2127 109.7365 45.2417 0.0000 175.2322 2 I 3.3224 8.3959 118.8869 63.2293 37.5126 172.9905 3 V 3.4717 8.3799 119.8826 66.1171 31.6932 177.2413 4 E 3.7706 7.9798 117.4477 59.4262 29.5249 178.6248 5 Q 3.9393 8.5901 119.8264 59.7937 28.8837 178.1804 6 C 4.5249 8.2411 115.7221 59.3747 40.1656 174.7837 7 C 4.3930 7.2535 118.9401 61.3814 32.1431 175.4165 8 T 4.0808 8.0260 110.4148 63.8761 68.6121 174.2373 9 S 4.3518 8.4928 114.1041 56.6452 64.2155 173.8191 10 I 4.0224 7.3426 112.2082 61.0945 39.6124 172.0114 11 C 5.1121 8.4971 115.1414 54.2094 44.7255 172.9585 12 S 4.9717 8.2127 113.8927 56.2255 65.1283 174.8833 13 L 4.0282 8.4683 121.8237 58.4379 40.9750 179.1780 14 Y 4.3247 7.7087 115.9028 61.6759 37.6132 178.9809 15 Q 4.0047 8.0765 118.1872 58.7618 28.9292 178.2500 16 L 4.3296 7.9620 119.1467 56.8114 41.8049 178.9820 17 E 4.0907 7.8779 118.7741 59.2168 29.1322 178.5661 18 N 4.3669 7.9617 115.6853 55.3313 38.6077 175.0780 19 Y 4.2707 7.4919 116.0232 57.6946 38.7800 175.7080 20 C 4.4523 7.5788 117.7471 59.0142 29.1828 173.2505 21 N 4.4891 8.5652 119.3063 54.0067 38.5813 174.8521 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 3.95 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 0.00 0.00 0.00 2 I 8.40 3.32 1.42 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 1.23 0.01 0.00 0.00 3 V 8.38 3.47 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 0.97 0.00 0.00 0.82 0.00 0.00 4 E 7.98 3.77 0.00 2.08 1.96 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 2.39 2.41 0.00 5 Q 8.59 3.94 0.00 2.06 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.45 6.77 0.00 0.00 0.00 0.00 0.00 2.36 2.42 0.00 6 C 8.24 4.52 0.00 2.96 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 7 C 7.25 4.39 0.00 2.77 3.03 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 0.00 0.00 0.00 0.00 8 T 8.03 4.08 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 1.25 0.00 0.00 9 S 8.49 4.35 0.00 3.77 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 7.34 4.02 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 1.47 0.48 0.91 0.00 0.00 11 C 8.50 5.11 0.00 3.16 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 12 S 8.21 4.97 0.00 4.12 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 13 L 8.47 4.03 0.00 1.36 1.57 0.82 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 14 Y 7.71 4.32 0.00 3.08 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 8.08 4.00 0.00 2.39 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.84 0.00 0.00 0.00 0.00 0.00 2.46 2.48 0.00 16 L 7.96 4.33 0.00 1.86 1.74 0.89 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 17 E 7.88 4.09 0.00 2.35 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 0.00 2.35 2.35 0.00 18 N 7.96 4.37 0.00 2.80 2.47 0.00 0.00 6.92 7.39 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 19 Y 7.49 4.27 0.00 3.21 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 7.58 4.45 0.00 2.98 2.87 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 21 N 8.57 4.49 0.00 2.67 2.70 0.00 0.00 6.87 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