NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.9934 8.2127 109.7431 45.6058 0.0000 173.6767 2 I 3.4169 8.2243 117.7093 63.1440 37.7675 173.7996 3 V 3.5725 8.4464 120.0183 65.8564 30.3836 177.2240 4 E 3.9309 8.0749 117.8059 59.6105 28.1218 179.0499 5 Q 4.2910 8.6332 119.9249 58.4862 28.9864 176.4057 6 C 5.2181 8.4782 115.2186 55.9946 41.5999 174.0922 7 C 4.2898 8.2942 118.0171 60.1400 28.9685 174.8652 8 T 4.2689 7.3163 109.4476 63.1862 69.2438 175.0591 9 S 4.6665 7.4331 112.2980 56.2180 66.1241 173.3356 10 I 3.8063 8.2791 122.9430 61.7066 37.3354 176.2282 11 C 5.0062 8.5956 122.9586 55.2863 41.2885 174.6544 12 S 4.5348 9.2224 120.9097 57.6802 65.2378 175.2517 13 L 3.9606 8.3286 120.9380 57.9130 40.9619 179.3140 14 Y 4.1102 7.7853 115.7664 61.2239 38.1223 178.1640 15 Q 4.2166 8.2678 118.8147 58.9482 28.8226 178.6869 16 L 4.4133 8.4611 120.1514 57.4246 41.6406 178.9865 17 E 3.9705 8.1996 119.0657 58.8265 29.2314 177.9550 18 N 4.1499 7.7196 116.3413 56.6510 38.9151 175.3422 19 Y 4.4440 7.7327 115.0579 57.5126 38.5778 175.5805 20 C 4.4337 7.2977 118.0377 59.6513 29.0147 173.5154 21 N 4.5478 8.5339 117.5049 53.7305 38.2847 175.4634 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 3.99 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2 I 8.22 3.42 1.19 0.00 0.00 0.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.37 0.70 0.00 0.00 3 V 8.45 3.57 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 1.08 0.00 0.00 0.88 0.00 0.00 4 E 8.07 3.93 0.00 2.25 1.99 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 0.00 2.40 2.37 0.00 5 Q 8.63 4.29 0.00 2.20 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 6.66 0.00 0.00 0.00 0.00 0.00 2.52 2.52 0.00 6 C 8.48 5.22 0.00 2.97 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 7 C 8.29 4.29 0.00 3.09 2.95 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 8 T 7.32 4.27 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 1.23 0.00 0.00 9 S 7.43 4.67 0.00 3.95 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 10 I 8.28 3.81 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 0.55 0.93 0.00 0.00 11 C 8.60 5.01 0.00 2.98 3.09 0.00 0.00 0.00 0.00 0.00 0.00 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 9.22 4.53 0.00 4.22 4.14 0.00 0.00 0.00 0.00 0.00 0.00 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 8.33 3.96 0.00 1.44 1.59 0.83 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 14 Y 7.79 4.11 0.00 2.95 3.01 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 15 Q 8.27 4.22 0.00 2.41 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.80 0.00 0.00 0.00 0.00 0.00 2.44 2.49 0.00 16 L 8.46 4.41 0.00 1.72 1.80 0.93 0.96 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 17 E 8.20 3.97 0.00 2.22 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 0.00 2.31 2.31 0.00 18 N 7.72 4.15 0.00 2.73 2.16 0.00 0.00 7.18 8.63 0.00 0.00 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 7.73 4.44 0.00 3.18 2.99 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 0.00 0.00 0.00 0.00 20 C 7.30 4.43 0.00 3.07 2.89 0.00 0.00 0.00 0.00 0.00 0.00 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 8.53 4.55 0.00 2.72 2.73 0.00 0.00 6.79 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