NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 S 4.4181 8.1814 115.2898 58.2973 64.6644 175.6771 2 G 3.5514 7.8985 106.7129 46.6722 0.0000 174.3381 3 I 3.8078 7.7912 121.9951 64.2241 37.9205 176.6322 4 V 3.5890 7.6919 118.5377 66.1462 31.2962 177.8276 5 Q 3.9935 8.4599 118.1856 59.0502 28.4578 178.7354 6 Q 3.9559 7.9949 120.0522 59.2748 29.0552 178.0006 7 Q 3.9725 8.5028 119.5622 59.0826 28.6209 178.5894 8 N 4.2911 8.1564 117.8954 56.7223 38.9090 176.7538 9 N 4.3586 7.9254 117.7719 56.2675 38.6288 177.4107 10 L 3.9756 8.2431 120.7618 57.5325 41.5893 179.3709 11 L 3.9195 8.1626 120.4215 58.4019 42.1730 179.3913 12 R 4.1846 8.6616 119.2918 58.3856 29.8063 179.0349 13 A 3.9992 8.2548 121.1742 55.0752 18.4108 179.7042 14 I 3.6407 7.7771 118.3587 64.4983 37.2761 178.3595 15 E 3.9549 8.4982 119.5001 59.6256 29.4545 179.4739 16 A 4.1896 7.9952 120.4814 55.2623 18.3100 179.7328 17 Q 4.0155 8.4219 116.8619 58.8691 28.7026 178.5828 18 Q 3.9423 8.2300 120.9056 59.4476 28.9943 177.9104 19 H 4.1614 7.9532 116.9292 58.8612 28.6422 177.7703 20 L 3.9999 7.9301 120.4889 57.6859 41.4689 179.3689 21 L 3.9890 8.1855 119.1805 58.0396 41.6587 179.4609 22 Q 4.0429 8.4609 118.1221 59.1841 28.6924 179.2485 23 L 4.0758 8.2693 120.2371 58.0741 41.6970 179.7037 24 T 3.9697 8.2942 110.0076 64.8093 68.6000 176.6089 25 V 3.6087 7.9537 121.0864 65.5120 31.4628 177.7173 26 W 4.1839 8.3720 128.1726 60.4328 30.5209 178.1750 27 G 3.6472 8.4771 105.6533 47.7877 0.0000 175.6314 28 I 3.6515 7.8126 122.3901 64.1884 37.1995 178.6311 29 K 3.9962 7.9550 119.0995 59.5174 31.7467 179.2034 30 Q 3.5419 7.7786 120.0280 58.9003 28.7580 178.3496 31 L 3.8687 7.7662 120.0776 57.5210 41.6691 178.8070 32 Q 3.8755 8.0183 119.4547 59.4705 28.6579 178.8790 33 A 3.9294 7.6258 119.8119 55.1068 18.4493 179.4032 34 R 3.9764 7.8358 115.6287 59.5344 30.2541 178.7310 35 I 3.8180 7.5875 118.1814 64.5232 37.2400 176.6190 36 L 4.2682 7.6405 122.5006 55.0860 41.5999 176.8994 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 S 8.18 4.42 0.00 3.87 3.92 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 2 G 7.90 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 I 7.79 3.81 1.87 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 1.52 0.62 0.91 0.00 0.00 4 V 7.69 3.59 2.08 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 1.07 0.00 0.00 0.93 0.00 0.00 5 Q 8.46 3.99 0.00 2.17 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.59 0.00 0.00 0.00 0.00 0.00 2.38 2.44 0.00 6 Q 7.99 3.96 0.00 2.32 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.76 0.00 0.00 0.00 0.00 0.00 2.35 2.40 0.00 7 Q 8.50 3.97 0.00 2.25 2.15 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 2.38 2.51 0.00 8 N 8.16 4.29 0.00 2.86 2.97 0.00 0.00 7.17 6.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 9 N 7.93 4.36 0.00 2.91 2.85 0.00 0.00 7.03 7.99 0.00 0.00 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 L 8.24 3.98 0.00 1.82 1.72 0.92 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 11 L 8.16 3.92 0.00 1.84 1.88 0.92 1.13 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 12 R 8.66 4.18 0.00 1.95 1.97 0.00 3.19 0.00 0.00 3.46 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.51 0.00 13 A 8.25 4.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 I 7.78 3.64 2.02 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 1.52 1.06 0.91 0.00 0.00 15 E 8.50 3.95 0.00 2.15 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 0.00 2.34 2.47 0.00 16 A 8.00 4.19 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 Q 8.42 4.02 0.00 2.31 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.76 0.00 0.00 0.00 0.00 0.00 2.39 2.54 0.00 18 Q 8.23 3.94 0.00 2.16 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.79 0.00 0.00 0.00 0.00 0.00 2.32 2.39 0.00 19 H 7.95 4.16 0.00 3.41 3.32 0.00 5.68 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 L 7.93 4.00 0.00 1.92 1.73 0.93 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 21 L 8.19 3.99 0.00 1.86 1.74 0.96 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 22 Q 8.46 4.04 0.00 2.26 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.64 0.00 0.00 0.00 0.00 0.00 2.38 2.61 0.00 23 L 8.27 4.08 0.00 1.87 1.75 0.89 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 24 T 8.29 3.97 4.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 25 V 7.95 3.61 2.30 0.00 0.00 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 1.02 0.00 0.00 26 W 8.37 4.18 0.00 3.49 3.40 0.00 0.00 0.00 0.00 0.00 0.00 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 8.48 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 I 7.81 3.65 1.99 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 1.52 0.99 0.88 0.00 0.00 29 K 7.96 4.00 0.00 1.71 1.70 0.00 1.64 0.00 0.00 1.53 0.00 0.00 2.89 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.40 1.60 7.81 30 Q 7.78 3.54 0.00 0.93 1.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.82 0.00 0.00 0.00 0.00 0.00 1.92 2.15 0.00 31 L 7.77 3.87 0.00 1.83 1.64 0.90 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 32 Q 8.02 3.88 0.00 2.24 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.77 0.00 0.00 0.00 0.00 0.00 2.32 2.37 0.00 33 A 7.63 3.93 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 R 7.84 3.98 0.00 1.83 1.98 0.00 3.17 0.00 0.00 3.20 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.64 0.00 35 I 7.59 3.82 2.03 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 1.50 0.61 0.89 0.00 0.00 36 L 7.64 4.27 0.00 1.83 1.57 0.89 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00