NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 C 4.5592 8.4544 120.6365 56.3629 44.3310 172.5460 2 N 4.6477 8.3896 125.8707 51.4703 40.2006 173.7370 3 L 3.8993 9.0080 129.1883 58.2186 43.3561 178.3550 4 A 3.9713 7.9721 120.1811 55.3663 18.3780 179.7151 5 R 3.8567 8.7418 116.9209 59.5123 30.1477 178.5103 6 C 4.2381 8.4783 118.6468 59.7713 41.8593 175.6669 7 Q 3.9134 8.7456 120.2434 58.7212 28.2815 178.3898 8 L 3.8665 8.0097 121.4528 58.1617 42.1342 179.0035 9 S 4.0770 8.0128 113.0451 61.7021 62.2592 175.5854 10 C 4.4356 8.2466 119.2732 59.6598 39.6939 175.9015 11 K 3.8242 8.5248 121.2974 59.5667 31.8424 178.3583 12 S 4.2179 7.9095 112.3586 61.5015 62.3330 175.9077 13 L 4.2101 7.3286 119.4539 55.7039 41.7222 177.6031 14 G 4.1297 9.1303 107.4191 45.5398 0.0000 172.6226 15 L 4.7751 7.2746 116.6429 52.6119 46.4768 175.9535 16 K 4.3217 8.4708 118.8410 56.0659 33.6345 176.3762 17 G 4.3307 8.7022 111.2462 44.5025 0.0000 172.8610 18 G 4.3371 9.1818 113.1643 44.5537 0.0000 170.9591 19 C 5.2373 8.8536 122.0900 55.6760 41.1335 173.4171 20 Q 4.4480 9.1812 124.2181 54.5633 30.1257 177.8286 21 G 3.9390 9.3361 116.8152 46.2000 0.0000 172.6625 22 S 4.7519 9.2714 109.2777 57.3344 64.4568 171.8302 23 F 4.6504 8.3732 120.8653 56.0572 41.2815 172.9930 24 C 5.0671 7.5003 126.5026 55.1854 43.4770 172.5673 25 T 4.9720 8.7790 120.0511 60.6053 71.0654 171.4207 26 C 5.4076 8.8691 122.9853 55.3780 42.5613 174.1319 27 G 3.8114 9.1717 109.6691 46.6629 0.0000 172.4250 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 C 8.45 4.56 0.00 3.02 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 2 N 8.39 4.65 0.00 2.82 2.63 0.00 0.00 6.83 5.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3 L 9.01 3.90 0.00 1.79 1.63 0.92 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 4 A 7.97 3.97 1.34 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 0.00 0.00 0.00 5 R 8.74 3.86 0.00 2.01 1.96 0.00 3.17 0.00 0.00 3.08 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.66 0.00 6 C 8.48 4.24 0.00 2.98 3.21 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 8.75 3.91 0.00 2.28 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.58 0.00 0.00 0.00 0.00 0.00 2.46 2.52 0.00 8 L 8.01 3.87 0.00 1.94 1.65 0.91 0.61 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 9 S 8.01 4.08 0.00 3.91 3.90 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 10 C 8.25 4.44 0.00 3.14 3.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 K 8.52 3.82 0.00 1.88 1.92 0.00 1.81 0.00 0.00 1.63 0.00 0.00 2.97 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.45 1.45 7.81 12 S 7.91 4.22 0.00 4.03 3.88 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 13 L 7.33 4.21 0.00 1.86 1.71 0.96 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 14 G 9.13 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 0.00 0.00 0.00 15 L 7.27 4.78 0.00 1.59 1.55 0.93 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 16 K 8.47 4.32 0.00 1.68 1.72 0.00 1.65 0.00 0.00 1.82 0.00 0.00 2.85 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.51 1.39 7.81 17 G 8.70 4.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 18 G 9.18 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 0.00 0.00 0.00 0.00 19 C 8.85 5.24 0.00 2.87 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 20 Q 9.18 4.45 0.00 2.16 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.08 5.68 0.00 0.00 0.00 0.00 0.00 2.30 2.30 0.00 21 G 9.34 3.94 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 0.00 0.00 0.00 22 S 9.27 4.75 0.00 3.82 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 23 F 8.37 4.65 0.00 3.17 2.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 C 7.50 5.07 0.00 2.86 2.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 T 8.78 4.97 4.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 26 C 8.87 5.41 0.00 2.90 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 27 G 9.17 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00