NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- -9 G 3.9062 8.2127 109.7437 44.5215 0.0000 174.9801 -8 K 3.6870 8.2540 117.9629 56.5138 30.8333 174.6312 -7 F 4.9302 8.3911 111.9859 56.3493 40.4035 176.8478 -6 I 4.4144 7.2678 121.6999 58.8830 36.9210 174.7426 -5 P 4.6305 0.0000 0.0000 62.8882 28.9376 177.3079 -4 S 4.4255 7.9749 118.3660 59.7975 63.5798 174.9368 -3 R 4.1805 7.6026 119.8298 54.9627 30.5078 174.4741 -2 P 4.3226 0.0000 0.0000 62.5989 31.9799 175.9431 -1 A 4.4050 8.2568 123.0248 50.0940 18.8476 175.8241 0 P 4.4313 0.0000 0.0000 63.1781 32.1810 176.2351 1 K 4.4969 8.1428 119.4528 53.9964 33.9898 174.4598 2 P 4.5074 0.0000 0.0000 61.6407 31.9303 175.6472 3 P 4.5491 0.0000 0.0000 62.5822 29.1230 175.4460 4 S 4.5208 7.7259 118.9034 57.6399 65.7387 175.5424 5 S 4.3319 8.4104 118.1315 57.6390 61.6325 174.4583 6 A 4.1880 8.3201 127.1647 52.2286 18.3132 177.1916 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 -9 G 8.21 3.91 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 8.25 3.69 0.00 1.85 1.55 0.00 1.56 0.00 0.00 1.50 0.00 0.00 2.49 0.00 0.00 2.55 0.00 0.00 0.00 0.00 1.04 1.37 7.81 -7 F 8.39 4.93 0.00 3.05 2.88 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 I 7.27 4.41 1.88 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.87 0.93 0.00 0.00 -5 P 0.00 4.63 0.00 2.21 2.14 0.00 3.83 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.04 0.00 -4 S 7.97 4.43 0.00 3.89 3.95 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 R 7.60 4.18 0.00 1.79 1.88 0.00 3.26 0.00 0.00 3.28 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.68 0.00 -2 P 0.00 4.32 0.00 2.18 2.05 0.00 3.76 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.96 0.00 -1 A 8.26 4.41 1.27 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 P 0.00 4.43 0.00 2.19 2.07 0.00 3.76 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.99 0.00 1 K 8.14 4.50 0.00 1.76 1.77 0.00 1.75 0.00 0.00 1.76 0.00 0.00 3.02 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.37 1.40 7.81 2 P 0.00 4.51 0.00 2.17 2.07 0.00 3.77 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.95 0.00 3 P 0.00 4.55 0.00 2.20 2.14 0.00 3.78 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.95 0.00 4 S 7.73 4.52 0.00 3.95 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 5 S 8.41 4.33 0.00 3.88 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 6 A 8.32 4.19 1.23 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 0.00 0.00 0.00