NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 E 4.2588 8.4401 118.7985 55.8093 30.9578 175.0090 2 A 4.1047 8.1943 122.2811 51.1629 19.1752 176.3086 3 Q 4.2550 8.2104 119.6250 54.8812 30.4668 173.1966 4 P 4.5516 0.0000 0.0000 62.6772 32.3107 176.1915 5 A 4.4492 8.9784 124.4854 50.7406 20.0315 176.6304 6 P 2.9700 0.0000 0.0000 65.4995 31.0303 178.9127 7 H 3.9205 7.6862 111.2467 57.9437 28.5867 177.1728 8 Q 3.9997 7.3966 121.5830 58.3410 28.9517 178.1921 9 W 4.2029 7.5608 116.8807 59.2781 28.0071 177.4741 10 Q 3.1296 7.0856 117.1306 56.7503 28.0812 176.5883 11 K 4.3773 7.3733 118.3052 56.3660 33.3108 176.8179 12 M 4.1607 7.5752 120.1566 54.2241 32.4907 175.3687 13 P 4.2500 0.0000 0.0000 65.8290 31.7468 177.6244 14 F 4.5966 7.6967 111.0497 57.8075 38.7551 177.1681 15 W 4.4240 7.8414 132.1240 60.3350 30.7273 177.9141 16 Q 3.9457 8.1484 116.5775 58.6419 28.3036 177.7964 17 K 4.0662 7.9354 116.6855 58.3044 32.3994 177.1834 18 V 3.8532 7.3549 122.8510 62.7495 31.3614 175.1188 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 E 8.44 4.26 0.00 2.10 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 0.00 2.18 2.33 0.00 2 A 8.19 4.10 1.30 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 0.00 0.00 0.00 0.00 0.00 0.00 3 Q 8.21 4.26 0.00 2.09 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.90 0.00 0.00 0.00 0.00 0.00 2.38 2.30 0.00 4 P 0.00 4.55 0.00 2.41 2.15 0.00 3.80 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.06 0.00 5 A 8.98 4.45 1.13 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 0.00 0.00 6 P 0.00 2.97 0.00 1.79 1.44 0.00 3.49 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.21 0.00 7 H 7.69 3.92 0.00 3.14 3.25 0.00 5.52 0.00 0.00 0.00 0.00 7.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8 Q 7.40 4.00 0.00 2.20 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.83 0.00 0.00 0.00 0.00 0.00 2.17 1.79 0.00 9 W 7.56 4.20 0.00 3.34 3.20 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 7.09 3.13 0.00 1.42 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.77 0.00 0.00 0.00 0.00 0.00 1.16 1.16 0.00 11 K 7.37 4.38 0.00 1.83 1.79 0.00 1.69 0.00 0.00 1.66 0.00 0.00 2.92 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.34 1.40 7.81 12 M 7.58 4.16 0.00 1.51 1.36 0.00 0.00 0.00 0.00 0.00 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.80 2.47 0.00 13 P 0.00 4.25 0.00 2.15 2.21 0.00 3.65 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.13 0.00 14 F 7.70 4.60 0.00 3.32 3.38 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 15 W 7.84 4.42 0.00 3.40 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 16 Q 8.15 3.95 0.00 2.08 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.89 0.00 0.00 0.00 0.00 0.00 2.39 2.45 0.00 17 K 7.94 4.07 0.00 2.03 1.91 0.00 1.80 0.00 0.00 1.68 0.00 0.00 2.96 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.51 1.44 7.81 18 V 7.35 3.85 2.09 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 0.76 0.00 0.00 1.06 0.00 0.00