NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 H 4.7158 8.3033 117.7392 55.5887 30.8045 171.5279 2 F 5.5209 8.8440 121.0982 55.4424 41.7269 169.6045 3 V 4.3824 9.4181 117.8697 59.7374 34.2024 174.4929 4 Q 4.4006 8.6068 126.3633 54.5954 30.3977 174.5611 5 Q 4.2759 8.8758 126.0000 57.3707 29.7482 176.4250 6 T 4.7501 7.4662 105.8987 58.8354 71.9323 172.9201 7 P 4.2203 0.0000 0.0000 65.2254 31.3597 177.3899 8 K 4.4771 7.7738 113.8122 55.9153 32.8618 176.4412 9 S 4.2847 7.7548 115.9760 58.1959 63.3422 173.6842 10 Q 4.1478 8.3026 124.7856 54.6454 29.6624 173.8449 11 P 4.2180 0.0000 0.0000 63.2901 32.1355 175.6247 12 T 4.6704 8.4005 120.0214 61.3435 71.6315 174.2555 13 L 5.0864 8.7449 124.9229 54.6746 41.3588 177.0843 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 H 8.30 4.72 0.00 3.13 3.29 0.00 5.72 0.00 0.00 0.00 0.00 6.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2 F 8.84 5.52 0.00 3.00 2.81 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 0.00 0.00 0.00 3 V 9.42 4.38 2.12 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 0.88 0.00 0.00 0.96 0.00 0.00 4 Q 8.61 4.40 0.00 1.95 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.87 7.07 0.00 0.00 0.00 0.00 0.00 2.32 2.41 0.00 5 Q 8.88 4.28 0.00 2.08 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.57 0.00 0.00 0.00 0.00 0.00 2.36 2.35 0.00 6 T 7.47 4.75 4.23 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 7 P 0.00 4.22 0.00 2.05 2.18 0.00 3.63 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.13 0.00 8 K 7.77 4.48 0.00 1.70 1.79 0.00 1.74 0.00 0.00 1.69 0.00 0.00 3.00 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.33 1.40 7.81 9 S 7.75 4.28 0.00 3.97 3.77 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 8.30 4.15 0.00 1.95 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.88 0.00 0.00 0.00 0.00 0.00 2.27 2.34 0.00 11 P 0.00 4.22 0.00 0.95 1.16 0.00 3.44 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 2.07 0.00 12 T 8.40 4.67 4.46 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 1.26 0.00 0.00 13 L 8.74 5.09 0.00 1.64 1.63 0.97 0.87 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