NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.9029 8.3544 109.7370 45.3625 0.0000 174.1319 2 C 4.3342 8.2634 122.9670 54.3152 44.3553 171.2581 3 P 4.4746 0.0000 0.0000 63.3463 32.3617 175.6637 4 R 4.4737 8.3240 119.2139 56.0987 30.1935 176.7905 5 I 3.8117 7.5075 119.5388 61.1294 37.5750 175.6972 6 L 4.2411 8.3973 125.2656 54.5389 42.0474 176.3682 7 I 4.7214 8.3778 124.0202 59.3412 40.6846 175.2275 8 R 4.4204 8.7983 126.6794 56.3465 30.6658 174.9359 9 C 4.9724 8.4634 116.2591 54.3893 44.5896 173.9520 10 K 4.2321 9.5708 120.1202 58.0825 32.9187 177.1370 11 Q 4.6329 7.7015 115.0911 53.9288 33.2417 175.2666 12 D 4.3923 8.9427 119.9217 57.8156 40.8445 179.3191 13 S 4.3441 7.9569 110.6381 60.1402 63.0648 174.7696 14 D 4.4316 7.9758 120.9249 56.5274 40.7751 175.7863 15 C 4.7182 7.7229 116.2476 55.1401 36.9386 173.1162 16 L 4.2757 8.0566 120.9726 53.6858 42.1401 176.5471 17 A 3.9611 8.2815 122.9355 54.2431 18.4111 178.1962 18 G 3.9765 9.1830 110.7137 45.1737 0.0000 173.3998 19 C 5.3652 7.5948 115.8054 55.1611 40.6005 173.2407 20 V 4.5666 8.9046 113.1489 59.6527 36.2121 174.1443 21 C 4.8260 9.5724 123.1410 55.6277 40.9639 173.8039 22 G 3.9744 8.9119 116.4532 43.8679 0.0000 171.8001 23 P 4.1302 0.0000 0.0000 66.5578 31.1187 178.2026 24 N 4.6603 8.2054 110.9794 52.3773 37.6937 177.0902 25 G 3.8388 8.4778 106.6045 46.7181 0.0000 173.1521 26 F 5.3128 7.6451 116.7615 55.0724 42.8793 175.3648 27 C 4.9598 9.0293 119.5190 57.5643 36.7666 173.3044 28 G 4.1330 9.1431 109.3605 45.3497 0.0000 172.1991 29 S 4.6929 8.5611 115.9998 57.5094 63.3270 173.4290 30 P 4.1883 0.0000 0.0000 63.3594 31.8543 176.3490 31 A 4.1282 8.5793 121.8311 52.8978 18.6515 176.9675 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 G 8.35 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 2 C 8.26 4.33 0.00 3.13 3.00 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 3 P 0.00 4.47 0.00 2.09 1.98 0.00 3.73 0.00 0.00 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.12 0.00 4 R 8.32 4.47 0.00 1.78 1.91 0.00 3.20 0.00 0.00 3.21 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.63 0.00 5 I 7.51 3.81 1.89 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.47 0.93 0.00 0.00 6 L 8.40 4.24 0.00 1.61 1.69 0.80 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 7 I 8.38 4.72 1.94 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 1.13 0.94 0.00 0.00 8 R 8.80 4.42 0.00 1.60 1.65 0.00 3.10 0.00 0.00 3.09 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.90 1.54 0.00 9 C 8.46 4.97 0.00 3.06 2.98 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 K 9.57 4.23 0.00 2.08 1.87 0.00 1.78 0.00 0.00 1.70 0.00 0.00 2.72 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.40 1.26 7.81 11 Q 7.70 4.63 0.00 2.04 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.14 6.84 0.00 0.00 0.00 0.00 0.00 2.33 2.35 0.00 12 D 8.94 4.39 0.00 2.70 2.74 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 13 S 7.96 4.34 0.00 3.97 3.99 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 14 D 7.98 4.43 0.00 2.81 2.76 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 15 C 7.72 4.72 0.00 3.12 3.03 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 16 L 8.06 4.28 0.00 1.72 1.61 0.93 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 17 A 8.28 3.96 1.25 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 18 G 9.18 3.98 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 19 C 7.59 5.37 0.00 2.86 3.08 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 20 V 8.90 4.57 2.21 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 0.72 0.00 0.00 1.02 0.00 0.00 21 C 9.57 4.83 0.00 2.98 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 22 G 8.91 3.97 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 23 P 0.00 4.13 0.00 2.07 2.18 0.00 3.70 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 2.06 2.13 0.00 24 N 8.21 4.66 0.00 2.74 2.70 0.00 0.00 6.72 7.51 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 25 G 8.48 3.84 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 26 F 7.65 5.31 0.00 3.06 2.90 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 27 C 9.03 4.96 0.00 2.94 3.06 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 28 G 9.14 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 29 S 8.56 4.69 0.00 3.77 3.81 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 30 P 0.00 4.19 0.00 2.04 2.00 0.00 3.83 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.10 0.00 31 A 8.58 4.13 1.26 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