NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.8286 8.3544 109.7273 45.7940 0.0000 173.0641 2 I 3.8012 7.7493 116.5292 60.8632 38.3918 171.8728 3 V 3.4701 8.0187 118.3573 66.2064 31.4039 176.0441 4 E 3.6543 8.2107 117.8528 59.7696 29.5794 178.8839 5 Q 3.9415 8.0506 117.9012 59.1839 29.1761 178.4508 6 C 4.7124 8.0218 115.9313 58.4908 41.1565 174.2030 7 C 4.2685 8.8719 121.3280 60.5069 30.7916 174.5166 8 T 3.8513 8.0843 118.8912 67.2011 69.0101 175.1832 9 S 4.5702 7.9355 116.1907 57.8810 64.1276 173.6191 10 I 5.0734 8.2231 121.1205 58.9914 39.5300 173.8918 11 C 5.0877 8.3774 116.3651 53.1343 39.7764 173.7408 12 S 4.6694 8.1859 115.3450 57.0765 65.8018 174.8520 13 L 4.0974 8.2990 120.6121 57.7394 41.0386 178.9867 14 Y 4.0913 7.9995 118.6352 60.3660 39.0151 177.5662 15 Q 4.4909 7.8920 120.0615 58.2256 28.6721 178.0841 16 L 4.3205 7.6943 119.4233 57.3814 41.5056 179.5239 17 E 3.8966 7.5917 119.0161 59.3088 29.5399 178.7761 18 N 4.1525 7.6578 115.9605 55.2504 38.1403 175.9566 19 Y 4.7538 6.3880 115.7007 59.4817 38.7113 176.1816 20 C 4.5100 7.9565 119.5640 58.9481 30.3175 173.3625 21 N 4.4477 8.7690 119.1125 54.9667 38.4329 175.5438 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 8.35 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.75 3.80 1.09 0.00 0.00 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 -0.36 0.62 0.00 0.00 3 V 8.02 3.47 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.00 0.00 0.88 0.00 0.00 4 E 8.21 3.65 0.00 2.05 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.37 2.39 0.00 5 Q 8.05 3.94 0.00 2.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.43 6.75 0.00 0.00 0.00 0.00 0.00 2.38 2.49 0.00 6 C 8.02 4.71 0.00 3.02 3.11 0.00 0.00 0.00 0.00 0.00 0.00 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 8.87 4.27 0.00 2.91 2.74 0.00 0.00 0.00 0.00 0.00 0.00 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 8.08 3.85 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 1.21 0.00 0.00 9 S 7.94 4.57 0.00 3.93 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 10 I 8.22 5.07 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 1.11 1.57 0.93 0.00 0.00 11 C 8.38 5.09 0.00 3.33 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 12 S 8.19 4.67 0.00 4.13 4.09 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 13 L 8.30 4.10 0.00 1.73 1.80 0.94 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 14 Y 8.00 4.09 0.00 2.89 3.03 0.00 0.00 0.00 0.00 0.00 0.00 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 7.89 4.49 0.00 2.36 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.73 0.00 0.00 0.00 0.00 0.00 2.48 2.38 0.00 16 L 7.69 4.32 0.00 1.65 1.76 1.03 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 17 E 7.59 3.90 0.00 1.74 1.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.25 2.38 0.00 18 N 7.66 4.15 0.00 1.85 2.49 0.00 0.00 6.44 6.18 0.00 0.00 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 6.39 4.75 0.00 3.02 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 20 C 7.96 4.51 0.00 3.17 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 8.77 4.45 0.00 2.68 2.70 0.00 0.00 6.68 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