NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 K 4.3478 8.3149 119.9985 56.7695 33.9825 174.3743 2 S 4.5089 8.3241 113.8650 56.4898 66.1157 172.4332 3 T 4.4982 8.5088 120.9370 61.2455 71.4369 173.4884 4 Q 3.8896 8.8253 128.0089 56.3234 29.3764 176.0042 5 A 4.5413 8.4555 128.5282 51.4028 20.5854 175.3068 6 T 4.7358 8.0269 111.4869 60.1034 70.2872 174.4482 7 L 4.2953 8.2929 125.5394 56.9045 40.9079 178.3996 8 E 3.9380 8.0604 118.8150 59.7254 29.3395 178.5587 9 R 3.9267 7.2617 117.1439 58.0077 30.0031 177.9888 10 W 4.7174 7.7959 116.4496 57.3509 29.9834 176.2563 11 F 4.5329 7.9055 122.1621 57.7896 38.4294 175.1139 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 K 8.31 4.35 0.00 1.89 1.92 0.00 1.49 0.00 0.00 1.71 0.00 0.00 2.95 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.31 1.48 7.81 2 S 8.32 4.51 0.00 3.91 3.76 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 3 T 8.51 4.50 4.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 4 Q 8.83 3.89 0.00 2.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.91 0.00 0.00 0.00 0.00 0.00 2.36 2.46 0.00 5 A 8.46 4.54 1.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 T 8.03 4.74 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 7 L 8.29 4.30 0.00 1.68 1.24 0.93 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 8 E 8.06 3.94 0.00 2.01 1.87 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 2.33 2.38 0.00 9 R 7.26 3.93 0.00 0.67 1.19 0.00 2.96 0.00 0.00 2.85 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 1.44 0.00 10 W 7.80 4.72 0.00 3.60 3.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 F 7.91 4.53 0.00 3.13 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