NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 I 4.4236 8.2498 113.6693 61.1963 39.0778 173.2418 2 T 4.6146 7.9258 109.2477 57.9552 72.2160 173.6371 3 F 4.4051 9.6832 123.7984 61.6485 40.0398 177.8505 4 E 3.8255 8.1601 117.8882 59.3015 29.1070 179.0282 5 D 4.4251 8.0259 119.1103 57.1375 40.7538 178.6032 6 L 4.2323 7.7419 119.2494 57.4403 41.8015 179.3198 7 L 3.9489 7.4856 118.6272 57.6394 41.3615 178.9607 8 D 4.3638 7.7979 117.9163 56.7839 40.7840 177.4385 9 Y 3.9886 7.4378 118.4815 59.3997 39.3196 176.1784 10 Y 4.6321 8.6313 115.2977 56.3458 39.8236 177.2865 11 G 4.1263 7.3881 103.2917 44.5670 0.0000 171.7018 12 P 4.4344 0.0000 0.0000 62.8664 31.3341 176.3390 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 I 8.25 4.42 1.90 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 2.06 0.97 0.00 0.00 2 T 7.93 4.61 4.31 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 1.24 0.00 0.00 3 F 9.68 4.41 0.00 3.07 3.16 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 E 8.16 3.83 0.00 2.03 1.95 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 2.32 2.39 0.00 5 D 8.03 4.43 0.00 3.00 2.75 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 L 7.74 4.23 0.00 1.85 1.79 1.03 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 7 L 7.49 3.95 0.00 1.54 1.54 0.66 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.44 0.00 0.00 0.00 0.00 0.00 0.00 8 D 7.80 4.36 0.00 2.62 2.70 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 9 Y 7.44 3.99 0.00 3.10 2.75 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 Y 8.63 4.63 0.00 3.15 3.04 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 G 7.39 4.13 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 12 P 0.00 4.43 0.00 2.22 2.06 0.00 3.81 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.96 0.00