NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 E 4.1142 8.4293 120.2461 56.1709 31.0048 175.6778 2 T 4.1990 7.7521 111.6438 60.1508 71.0973 174.7328 3 F 4.3386 9.6372 124.2264 61.7337 39.8347 177.9835 4 E 3.8836 8.4350 117.6459 59.6746 29.0078 178.6889 5 H 3.9081 7.7588 116.8514 59.1188 30.1016 176.9762 6 W 4.4296 7.5091 120.4492 59.5968 28.8020 178.4156 7 W 3.6841 8.3362 128.9463 60.1964 30.0778 178.1598 8 S 4.1256 8.4639 114.6216 61.5348 62.3168 176.5702 9 Q 3.9168 7.7026 121.8315 58.6313 28.1802 178.2204 10 L 3.9994 7.6443 118.7907 56.1514 41.6280 178.0966 11 L 4.4937 7.3870 117.5330 54.3712 42.2006 176.2429 12 S 4.2717 7.5912 119.1312 58.3978 62.3291 173.4873 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 8.43 4.11 0.00 1.16 1.12 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 1.93 1.47 0.00 2 T 7.75 4.20 4.32 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 1.21 0.00 0.00 3 F 9.64 4.34 0.00 3.37 3.27 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 4 E 8.44 3.88 0.00 2.09 2.02 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 2.50 2.58 0.00 5 H 7.76 3.91 0.00 2.90 3.10 0.00 5.96 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6 W 7.51 4.43 0.00 3.55 3.14 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 7 W 8.34 3.68 0.00 2.66 2.80 0.00 0.00 0.00 0.00 0.00 0.00 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 S 8.46 4.13 0.00 4.03 4.21 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 9 Q 7.70 3.92 0.00 2.14 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.87 0.00 0.00 0.00 0.00 0.00 2.24 2.44 0.00 10 L 7.64 4.00 0.00 0.98 1.27 -0.61 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 11 L 7.39 4.49 0.00 1.69 1.69 1.05 0.79 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 12 S 7.59 4.27 0.00 3.81 3.88 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