NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 S 4.0019 8.1933 115.2307 57.4579 64.1044 172.4663 2 W 5.1077 8.8682 127.6364 56.6781 29.6219 174.2579 3 T 5.2731 9.6731 121.0921 61.5093 72.7986 172.5640 4 W 4.5741 8.9425 134.8422 56.7959 31.7950 175.2507 5 E 4.1218 8.5967 127.6158 56.2252 32.1589 174.7407 6 N 4.0408 9.2834 120.3445 54.2934 35.2869 174.5566 7 G 3.6256 7.2877 106.9795 44.9454 0.0000 170.5024 8 K 4.3125 6.3313 119.5656 54.2405 35.7420 174.0580 9 W 5.5457 8.5302 120.8721 55.4716 30.7191 175.9074 10 T 5.0532 9.4374 118.6773 60.0954 70.5634 172.9721 11 W 4.5230 8.8707 135.0000 56.5793 30.6118 176.0554 12 K 4.1102 8.4618 126.4113 56.2083 31.3192 176.7446 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 4.00 0.00 3.63 3.59 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 W 8.87 5.11 0.00 3.16 3.01 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 9.67 5.27 4.41 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 1.36 0.00 0.00 4 W 8.94 4.57 0.00 2.30 2.64 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 0.00 0.00 0.00 0.00 5 E 8.60 4.12 0.00 1.87 1.57 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 2.06 2.17 0.00 6 N 9.28 4.04 0.00 2.64 2.81 0.00 0.00 7.16 7.61 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 7 G 7.29 3.63 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 8 K 6.33 4.31 0.00 1.51 1.42 0.00 1.43 0.00 0.00 1.58 0.00 0.00 3.04 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.32 1.44 7.81 9 W 8.53 5.55 0.00 2.99 3.20 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 T 9.44 5.05 4.39 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 1.31 0.00 0.00 11 W 8.87 4.52 0.00 2.26 2.63 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 8.46 4.11 0.00 1.49 1.57 0.00 1.78 0.00 0.00 1.76 0.00 0.00 2.96 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.42 1.53 7.81