NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- -1 Q 4.3374 8.3293 118.8183 55.5376 30.2450 174.1152 0 P 4.6367 0.0000 0.0000 61.6907 32.8956 176.3544 1 Q 4.7568 8.6675 113.9065 54.9735 30.8836 176.5448 2 A 4.0205 8.8956 124.3553 54.9271 16.9603 179.4208 3 V 4.0115 8.7208 126.2521 62.0128 33.0232 178.4549 4 H 4.6208 7.7360 118.6002 55.3296 27.9588 175.4613 5 T 2.8446 7.7948 109.7305 62.0659 69.3797 173.8041 6 Y 4.5271 5.3700 121.4320 58.8398 39.1432 175.2237 7 C 4.3967 9.1056 120.1288 60.4197 33.3428 171.3856 8 G 3.8645 9.3157 122.7005 45.8662 0.0000 170.5913 9 R 3.9496 8.2276 123.7904 57.5910 29.5056 177.5623 10 H 4.1100 7.5504 113.8318 57.8424 28.9551 177.1297 11 L 4.1154 7.7982 118.7069 56.2241 42.3750 178.6889 12 A 4.0333 8.5453 122.0136 54.7645 18.8014 178.6686 13 R 4.0498 7.8389 115.2184 58.9095 30.9171 178.6552 14 T 3.8839 7.3922 114.8734 66.8625 68.7643 176.4893 15 L 4.2557 7.7584 119.1872 56.1422 41.3426 178.1108 16 A 4.5796 7.2955 118.6039 52.4852 19.5409 177.3468 17 D 4.5230 8.3882 115.4448 54.4381 42.6262 177.6564 18 L 4.4100 7.5879 118.8230 57.4807 42.0343 178.4300 19 C 4.1698 7.9901 116.0086 62.0904 27.9442 176.2817 20 W 4.0744 8.2418 129.9870 60.5561 30.3626 177.4815 21 E 4.2174 8.3926 115.6371 58.0774 29.0054 178.2071 22 A 4.4125 7.4392 119.1688 52.9115 20.5857 177.2655 23 G 4.1614 7.6728 103.2261 44.7233 0.0000 174.7121 24 V 2.8126 7.6116 118.2156 65.0116 32.1876 175.3716 25 D 4.5127 7.6212 123.3645 55.1510 40.6937 176.4955 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 Q 8.33 4.34 0.00 2.13 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.83 0.00 0.00 0.00 0.00 0.00 2.20 2.40 0.00 0 P 0.00 4.64 0.00 2.29 2.03 0.00 3.63 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.93 0.00 1 Q 8.67 4.76 0.00 2.25 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 7.13 0.00 0.00 0.00 0.00 0.00 2.28 2.35 0.00 2 A 8.90 4.02 1.21 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 0.00 0.00 3 V 8.72 4.01 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 0.72 0.00 0.00 0.86 0.00 0.00 4 H 7.74 4.62 0.00 3.18 3.38 0.00 5.74 0.00 0.00 0.00 0.00 7.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5 T 7.79 2.84 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.00 0.00 6 Y 5.37 4.53 0.00 3.14 3.02 0.00 0.00 0.00 0.00 0.00 0.00 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 9.11 4.40 0.00 2.90 2.82 0.00 0.00 0.00 0.00 0.00 0.00 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 G 9.32 3.86 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 0.00 0.00 0.00 9 R 8.23 3.95 0.00 1.93 1.68 0.00 3.10 0.00 0.00 3.12 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.57 0.00 10 H 7.55 4.11 0.00 3.32 3.23 0.00 5.66 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 L 7.80 4.12 0.00 1.72 1.75 1.09 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 12 A 8.55 4.03 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 13 R 7.84 4.05 0.00 1.84 1.86 0.00 3.06 0.00 0.00 3.22 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.58 0.00 14 T 7.39 3.88 4.41 0.00 0.00 0.00 0.00 0.00 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 15 L 7.76 4.26 0.00 1.72 1.73 0.95 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 16 A 7.30 4.58 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 17 D 8.39 4.52 0.00 2.55 2.76 0.00 0.00 0.00 0.00 0.00 0.00 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 L 7.59 4.41 0.00 1.77 1.73 0.97 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 19 C 7.99 4.17 0.00 3.20 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 20 W 8.24 4.07 0.00 3.38 3.41 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.39 4.22 0.00 2.19 2.06 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 2.45 2.54 0.00 22 A 7.44 4.41 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 23 G 7.67 4.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 V 7.61 2.81 1.63 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 -0.36 0.00 0.00 0.21 0.00 0.00 25 D 7.62 4.51 0.00 2.62 2.56 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 0.00 0.00 0.00 0.00