NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.9560 8.2127 109.7413 45.0810 0.0000 173.7024 2 I 3.2470 8.1381 117.6657 63.3873 37.2893 172.6712 3 V 3.5395 8.3879 120.0067 66.0221 31.8869 177.3432 4 E 3.9618 8.0403 117.8598 59.5026 29.1888 179.2244 5 Q 4.0570 8.2017 117.2206 58.4696 28.9165 177.0886 6 C 4.8470 8.5677 115.3144 56.8585 42.0779 174.3045 7 C 4.4329 7.6882 118.5213 61.5105 32.4172 174.8706 8 T 3.9597 8.0687 114.9852 66.6216 68.3646 174.9198 9 S 4.6384 7.6340 115.2371 56.9843 64.4928 172.7091 10 I 4.7005 8.1000 111.4611 59.4463 40.0571 173.1681 11 C 5.1468 8.2993 114.9736 53.0937 40.1437 174.0587 12 S 4.7448 8.7885 116.0056 57.2535 65.3860 175.1796 13 L 3.9674 8.3918 122.3242 58.2509 41.0668 179.1957 14 Y 4.2536 7.7865 116.2015 61.1753 37.8601 178.2434 15 Q 4.0772 8.1825 118.9865 59.0747 28.8020 178.9693 16 L 4.2351 7.9423 119.7299 57.7738 41.7385 179.1012 17 E 4.1650 7.9984 117.3490 58.5084 29.0994 178.6772 18 N 4.2673 7.9768 116.2580 55.2246 38.4447 175.1366 19 Y 4.6568 7.1249 115.8312 57.5466 38.5343 175.5694 20 C 4.3084 8.1433 118.5356 60.4075 28.7426 173.6184 21 N 4.3506 8.1074 120.2311 52.6798 37.5718 174.4190 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 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.14 3.25 0.63 0.00 0.00 0.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 1.06 0.63 0.00 0.00 3 V 8.39 3.54 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 1.06 0.00 0.00 0.87 0.00 0.00 4 E 8.04 3.96 0.00 2.34 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 2.46 0.00 5 Q 8.20 4.06 0.00 2.32 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.78 0.00 0.00 0.00 0.00 0.00 2.46 2.50 0.00 6 C 8.57 4.85 0.00 3.00 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 7.69 4.43 0.00 2.89 3.13 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 8 T 8.07 3.96 4.38 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 1.21 0.00 0.00 9 S 7.63 4.64 0.00 3.85 4.05 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 10 I 8.10 4.70 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 1.48 0.87 0.92 0.00 0.00 11 C 8.30 5.15 0.00 3.25 3.32 0.00 0.00 0.00 0.00 0.00 0.00 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 8.79 4.74 0.00 4.23 4.12 0.00 0.00 0.00 0.00 0.00 0.00 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 3.97 0.00 1.38 1.60 0.84 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 14 Y 7.79 4.25 0.00 3.03 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 15 Q 8.18 4.08 0.00 2.43 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.79 0.00 0.00 0.00 0.00 0.00 2.54 2.46 0.00 16 L 7.94 4.24 0.00 1.96 1.79 0.94 0.99 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 17 E 8.00 4.17 0.00 2.20 2.01 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 2.32 2.52 0.00 18 N 7.98 4.27 0.00 1.97 2.22 0.00 0.00 6.83 6.98 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 19 Y 7.12 4.66 0.00 3.04 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 8.14 4.31 0.00 2.99 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 21 N 8.11 4.35 0.00 2.74 2.68 0.00 0.00 6.88 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