NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 S 4.4145 8.3301 116.7971 59.0690 64.4779 173.9708 2 A 4.3701 7.7152 120.8355 50.1515 19.8974 175.0330 3 K 4.1207 9.0859 123.7651 58.7603 33.9650 175.6936 4 M 4.1392 7.8842 117.2940 56.4276 32.7772 178.6422 5 R 4.2052 7.9570 118.3069 59.4353 30.3527 178.5110 6 E 4.1724 7.6892 116.2060 59.1739 29.7725 178.9792 7 W 4.3236 8.0938 128.2019 59.9774 30.6629 177.7327 8 F 4.0586 8.4226 120.7198 61.5279 38.8891 177.0811 9 S 4.2830 8.0151 111.5233 60.8930 61.9014 174.8391 10 E 4.3222 7.5949 119.0686 56.6905 29.0778 177.3067 11 T 3.8702 7.1025 117.8425 64.5893 69.9841 176.3683 12 F 4.2892 7.9634 122.4575 61.2299 40.0516 176.7796 13 Q 4.0427 7.8059 117.5880 57.5785 28.9051 177.9580 14 K 3.9654 7.4805 117.9653 58.7802 31.9184 178.6830 15 V 3.5791 7.2242 118.6499 65.3359 31.3262 178.0903 16 K 3.9974 7.6471 117.0274 58.9921 32.0518 178.4754 17 E 4.0487 7.7995 118.6901 58.8664 29.5710 178.6276 18 K 4.1198 7.3786 117.7637 58.9841 32.1893 177.4981 19 L 4.2556 7.3397 121.5289 55.0479 41.6817 176.8165 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 S 8.33 4.41 0.00 3.89 3.89 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 2 A 7.72 4.37 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 K 9.09 4.12 0.00 1.83 1.78 0.00 1.67 0.00 0.00 1.79 0.00 0.00 2.89 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.43 1.52 7.81 4 M 7.88 4.14 0.00 2.04 2.11 0.00 0.00 0.00 0.00 0.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.43 0.00 5 R 7.96 4.21 0.00 1.94 2.04 0.00 3.17 0.00 0.00 3.38 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.84 0.00 6 E 7.69 4.17 0.00 2.24 2.10 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 2.58 2.54 0.00 7 W 8.09 4.32 0.00 3.32 3.25 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 0.00 8 F 8.42 4.06 0.00 3.55 3.12 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 9 S 8.02 4.28 0.00 4.05 4.02 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 10 E 7.59 4.32 0.00 1.86 1.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.55 0.00 11 T 7.10 3.87 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.81 0.00 0.00 12 F 7.96 4.29 0.00 3.10 3.06 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 7.81 4.04 0.00 2.22 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.94 6.60 0.00 0.00 0.00 0.00 0.00 2.47 2.61 0.00 14 K 7.48 3.97 0.00 1.88 1.77 0.00 1.59 0.00 0.00 1.55 0.00 0.00 2.85 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.37 1.50 7.81 15 V 7.22 3.58 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.81 0.00 0.00 0.92 0.00 0.00 16 K 7.65 4.00 0.00 1.62 1.72 0.00 1.62 0.00 0.00 1.21 0.00 0.00 2.90 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.07 1.29 7.81 17 E 7.80 4.05 0.00 2.24 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 2.29 2.31 0.00 18 K 7.38 4.12 0.00 2.00 1.82 0.00 1.76 0.00 0.00 1.68 0.00 0.00 3.01 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.50 1.64 7.81 19 L 7.34 4.26 0.00 1.76 1.55 0.84 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00