NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 S 4.6061 8.1933 116.7489 58.6977 64.9402 173.1880 2 C 5.0688 8.5441 119.6539 54.0373 44.0656 171.3759 3 H 3.9704 7.4954 117.5130 54.6348 32.5377 171.4087 4 F 4.4892 8.3786 120.9016 57.2964 40.3448 175.3116 5 G 3.8974 7.3438 113.2942 44.2216 0.0000 169.7790 6 P 4.2582 0.0000 0.0000 65.4587 31.8418 177.6497 7 L 4.4312 7.4632 117.7468 53.6367 41.7410 177.0464 8 G 3.6700 6.9856 117.1348 46.4954 0.0000 174.6941 9 W 4.6695 8.9854 134.1596 56.3383 31.3071 173.9319 10 V 4.3135 7.7290 126.7424 61.1261 34.2122 173.4886 11 C 5.2252 8.5224 123.0037 55.0838 44.0955 174.2546 12 K 4.1324 8.7070 120.3190 56.8338 32.8477 176.3241 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 8.19 4.61 0.00 3.89 3.86 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 C 8.54 5.07 0.00 3.08 3.29 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 3 H 7.50 3.97 0.00 2.94 3.18 0.00 5.25 0.00 0.00 0.00 0.00 6.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 4 F 8.38 4.49 0.00 3.35 3.07 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 5 G 7.34 3.90 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 0.00 6 P 0.00 4.26 0.00 1.98 2.11 0.00 3.55 0.00 0.00 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 2.09 0.00 7 L 7.46 4.43 0.00 1.52 1.57 0.88 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 8 G 6.99 3.67 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 0.00 9 W 8.99 4.67 0.00 3.45 2.99 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 V 7.73 4.31 1.64 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 0.73 0.00 0.00 11 C 8.52 5.23 0.00 2.80 2.99 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 12 K 8.71 4.13 0.00 1.67 1.61 0.00 1.71 0.00 0.00 1.71 0.00 0.00 2.89 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.34 1.35 7.81