NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 S 4.4615 8.1933 116.7938 58.7582 65.6004 175.7014 2 I 3.4822 7.3246 121.3452 63.4878 37.0009 177.1015 3 G 3.8208 8.2382 106.8929 47.4903 0.0000 175.0542 4 K 3.8934 7.8629 121.7180 59.4904 32.1229 178.7572 5 A 3.9788 7.7645 120.3674 55.1531 18.3903 179.4666 6 F 4.6267 7.9581 116.3930 60.4543 38.8794 177.7730 7 K 4.0879 8.5374 119.8597 59.7559 31.8305 178.9565 8 I 3.7746 7.4771 118.5927 64.3452 37.1474 178.1177 9 L 4.2681 8.2711 118.4601 55.2877 42.7783 176.8590 10 G 3.6972 8.4844 106.7609 45.8746 0.0000 171.6355 11 Y 4.8183 7.9185 117.1903 55.6000 42.3544 174.0849 12 P 4.3486 0.0000 0.0000 63.7057 32.1992 176.0489 13 D 4.7361 8.6963 118.6351 55.1382 40.9411 173.6858 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 4.46 0.00 3.87 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 I 7.32 3.48 1.79 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.98 0.27 0.00 0.00 3 G 8.24 3.82 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 4 K 7.86 3.89 0.00 1.82 2.00 0.00 1.54 0.00 0.00 1.65 0.00 0.00 3.04 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.43 1.50 7.81 5 A 7.76 3.98 1.17 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 F 7.96 4.63 0.00 3.32 3.09 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 K 8.54 4.09 0.00 2.13 1.97 0.00 1.61 0.00 0.00 1.71 0.00 0.00 3.06 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.48 1.58 7.81 8 I 7.48 3.77 2.04 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.90 0.92 0.00 0.00 9 L 8.27 4.27 0.00 2.06 1.85 1.16 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 10 G 8.48 3.70 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 11 Y 7.92 4.82 0.00 3.31 2.71 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 P 0.00 4.35 0.00 2.20 2.09 0.00 4.13 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.04 0.00 13 D 8.70 4.74 0.00 2.83 2.68 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