NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.9830 8.2127 109.7485 45.0797 0.0000 174.5795 2 I 3.0038 7.8091 118.8643 62.6708 37.5786 172.7052 3 V 3.4960 8.3383 119.9904 66.1525 31.7698 177.3627 4 E 3.8219 8.0626 117.7799 59.3468 29.1097 179.2705 5 Q 4.0466 7.8626 116.9432 58.4501 29.0503 176.9334 6 C 4.8648 8.3725 114.4995 56.7261 42.0021 174.4955 7 C 4.3841 7.8026 119.2140 61.5706 32.1460 174.8041 8 T 4.0101 8.6278 115.5286 65.7247 68.1427 174.6666 9 S 4.7737 7.5332 115.7355 56.7388 65.5320 172.8002 10 I 4.4443 8.0389 121.4053 60.0438 38.5704 176.1581 11 C 4.8499 8.5515 122.4050 55.4932 37.7580 174.4032 12 S 4.6279 8.2677 118.5347 57.4332 65.5092 175.1744 13 L 4.0210 8.3852 123.3070 58.5398 41.5975 178.5276 14 Y 4.1137 8.0332 115.4821 61.2418 38.0254 178.1388 15 Q 4.3548 8.4550 118.9861 58.6768 28.9755 178.3254 16 L 4.2300 8.0845 121.5330 57.9825 41.9562 178.2078 17 E 4.2931 8.2204 116.8764 57.7933 29.2506 178.3882 18 N 4.3146 7.7716 116.7772 55.3709 38.5344 175.1456 19 Y 4.6027 7.2933 116.0761 57.8733 38.1392 175.3249 20 C 4.5704 7.4139 117.8810 58.7213 29.4449 173.6400 21 N 4.5432 8.5647 118.0782 53.7759 38.1688 175.3083 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 3.98 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 0.00 0.00 0.00 2 I 7.81 3.00 0.56 0.00 0.00 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.99 0.64 0.00 0.00 3 V 8.34 3.50 2.04 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 0.99 0.00 0.00 0.87 0.00 0.00 4 E 8.06 3.82 0.00 2.06 1.98 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 2.39 2.39 0.00 5 Q 7.86 4.05 0.00 2.21 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.75 0.00 0.00 0.00 0.00 0.00 2.45 2.49 0.00 6 C 8.37 4.86 0.00 2.93 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 7.80 4.38 0.00 2.89 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 8 T 8.63 4.01 4.34 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 0.00 0.00 0.00 1.21 0.00 0.00 9 S 7.53 4.77 0.00 4.09 3.93 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 10 I 8.04 4.44 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 1.42 0.56 0.92 0.00 0.00 11 C 8.55 4.85 0.00 2.99 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 8.27 4.63 0.00 4.10 4.01 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 13 L 8.39 4.02 0.00 1.81 1.76 0.94 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 14 Y 8.03 4.11 0.00 2.86 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 15 Q 8.45 4.35 0.00 2.32 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.81 0.00 0.00 0.00 0.00 0.00 2.38 2.37 0.00 16 L 8.08 4.23 0.00 2.02 1.90 0.98 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 17 E 8.22 4.29 0.00 2.23 1.95 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 2.34 2.63 0.00 18 N 7.77 4.31 0.00 2.30 2.38 0.00 0.00 6.89 7.48 0.00 0.00 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 7.29 4.60 0.00 3.07 2.97 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 0.00 0.00 0.00 20 C 7.41 4.57 0.00 2.95 2.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 N 8.56 4.54 0.00 2.72 2.74 0.00 0.00 6.80 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