NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 4.0273 8.2127 109.7466 45.3664 0.0000 173.6029 2 I 3.1371 8.0717 118.8576 62.4917 37.4858 173.3138 3 V 3.5020 7.7260 119.0106 65.9585 30.5039 177.1104 4 E 3.9317 8.0665 118.5907 58.8648 29.6778 178.4700 5 Q 3.9732 8.4220 119.9998 59.0297 29.0927 176.5601 6 C 5.2775 8.3110 115.1523 56.4423 40.7730 174.4738 7 C 4.3963 8.2281 118.1418 60.0126 28.8227 174.8637 8 T 4.3272 7.2725 108.4605 61.8602 69.8627 174.6682 9 S 4.6284 7.2286 114.2932 56.1381 65.7793 173.0142 10 I 4.0472 8.3611 127.2100 61.7771 37.3625 176.0856 11 C 4.8618 8.5274 122.7375 55.1658 42.5892 174.5526 12 S 4.5070 8.3942 119.2816 57.7925 65.1417 175.2210 13 L 3.9027 8.3361 120.8563 57.9609 40.9160 179.3720 14 Y 4.0957 7.7857 115.7912 60.9668 37.9442 177.6331 15 Q 4.2327 8.3202 119.1683 58.8114 28.7458 178.5821 16 L 4.2300 8.2543 120.4536 57.6687 41.6664 178.9072 17 E 3.9201 8.3883 119.3257 59.3592 29.1829 178.5715 18 N 4.2846 7.7184 115.6437 56.1206 38.9551 175.8328 19 Y 4.4010 8.1411 116.2932 57.5764 38.1504 175.3957 20 C 4.5780 7.3122 118.2305 59.2150 29.0832 173.5086 21 N 4.5416 8.5404 117.4681 53.8103 38.1616 175.4177 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 4.03 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 0.00 0.00 0.00 2 I 8.07 3.14 0.76 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 1.07 0.63 0.67 0.00 0.00 3 V 7.73 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 1.02 0.00 0.00 0.87 0.00 0.00 4 E 8.07 3.93 0.00 2.08 1.94 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 2.39 2.37 0.00 5 Q 8.42 3.97 0.00 2.26 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.52 0.00 0.00 0.00 0.00 0.00 2.43 2.46 0.00 6 C 8.31 5.28 0.00 2.95 3.06 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 7 C 8.23 4.40 0.00 3.07 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 8 T 7.27 4.33 4.25 0.00 0.00 0.00 0.00 0.00 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 7.23 4.63 0.00 3.93 3.69 0.00 0.00 0.00 0.00 0.00 0.00 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 8.36 4.05 1.89 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 1.42 0.66 0.93 0.00 0.00 11 C 8.53 4.86 0.00 2.97 3.06 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 12 S 8.39 4.51 0.00 4.24 4.13 0.00 0.00 0.00 0.00 0.00 0.00 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 8.34 3.90 0.00 1.25 1.55 0.76 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 14 Y 7.79 4.10 0.00 2.99 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 15 Q 8.32 4.23 0.00 2.34 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.81 0.00 0.00 0.00 0.00 0.00 2.44 2.49 0.00 16 L 8.25 4.23 0.00 1.87 1.76 0.91 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 17 E 8.39 3.92 0.00 2.18 2.12 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 2.32 2.35 0.00 18 N 7.72 4.28 0.00 2.68 2.51 0.00 0.00 7.02 7.20 0.00 0.00 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 8.14 4.40 0.00 3.15 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 20 C 7.31 4.58 0.00 3.08 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 8.54 4.54 0.00 2.72 2.74 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