NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4330 8.1627 120.3237 54.9689 33.9327 175.8474 2 I 3.4858 8.1336 118.3755 62.7346 38.0066 176.2225 3 L 4.1372 8.1778 120.1370 57.9749 40.2960 178.5161 4 G 3.4971 7.3069 106.0800 47.7759 0.0000 175.0898 5 A 4.1925 7.5312 121.8070 53.0782 18.9643 179.4674 6 V 3.4834 7.3757 117.7007 65.7673 31.5483 177.4918 7 F 4.7532 7.2989 112.3515 58.2910 38.4857 177.2116 8 Y 4.7111 6.3271 115.6381 60.4946 37.8442 177.3597 9 I 4.0063 7.3816 118.4177 61.5103 39.5145 177.7492 10 V 3.8005 7.6013 120.0774 64.5666 30.9602 178.2912 11 F 4.3151 8.2058 115.2915 59.6339 38.1409 177.9081 12 I 3.4939 6.3662 119.4842 63.8324 36.7763 178.0532 13 A 3.9792 8.4137 122.2698 54.7096 18.1331 179.4588 14 L 3.9467 7.6132 118.9502 58.6810 42.2983 178.6473 15 F 4.7217 8.6530 117.9059 61.0116 38.7479 177.1066 16 F 4.0111 8.7748 119.4983 61.7235 38.9108 177.3876 17 G 4.4665 8.4979 105.2528 48.3783 0.0000 175.2135 18 I 3.8471 8.6073 116.2225 63.1554 37.9831 177.6744 19 A 3.8849 8.6644 123.9826 54.5599 18.0056 178.5752 20 V 3.5703 9.2950 118.0865 64.0785 30.8663 177.7161 21 G 3.9479 6.6385 108.5204 48.2378 0.0000 174.9500 22 I 3.9274 8.1603 121.9628 64.2369 37.0197 177.9767 23 I 3.6870 6.9690 117.8283 64.3524 37.7300 177.0936 24 F 4.5212 7.9157 115.7330 58.8995 39.0944 176.1886 25 A 4.0772 8.0786 126.1191 54.4361 17.7510 178.5049 26 I 4.0342 8.0797 114.6274 61.4341 37.7918 177.3462 27 K 4.5454 7.8926 119.2671 56.5601 31.5221 177.3619 28 S 4.5988 7.7958 111.4908 58.7262 66.2558 175.7831 29 I 3.9257 7.8219 119.4470 63.1637 37.0904 177.3055 30 K 4.4766 7.3753 117.5650 57.3667 32.9966 176.8983 31 L 3.9493 7.2467 121.6969 57.5215 42.6385 176.8196 32 I 3.9917 7.4433 124.9666 61.5457 37.1868 175.9986 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 M 8.16 4.43 0.00 2.13 2.08 0.00 0.00 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.60 0.00 2 I 8.13 3.49 1.85 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.20 0.90 0.00 0.00 3 L 8.18 4.14 0.00 2.01 1.95 1.00 0.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 4 G 7.31 3.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 7.53 4.19 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 V 7.38 3.48 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 1.08 0.00 0.00 0.93 0.00 0.00 7 F 7.30 4.75 0.00 3.43 3.36 0.00 0.00 0.00 0.00 0.00 0.00 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 Y 6.33 4.71 0.00 2.86 2.83 0.00 0.00 0.00 0.00 0.00 0.00 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 I 7.38 4.01 1.77 0.00 0.00 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.89 0.91 0.00 0.00 10 V 7.60 3.80 2.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.00 0.00 0.97 0.00 0.00 11 F 8.21 4.32 0.00 3.18 3.55 0.00 0.00 0.00 0.00 0.00 0.00 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 I 6.37 3.49 1.37 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.41 0.87 0.00 0.00 13 A 8.41 3.98 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 7.61 3.95 0.00 1.91 1.92 1.04 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 15 F 8.65 4.72 0.00 3.45 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 16 F 8.77 4.01 0.00 3.38 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 17 G 8.50 4.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 I 8.61 3.85 1.94 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.39 0.99 0.00 0.00 19 A 8.66 3.88 1.21 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 0.00 0.00 0.00 0.00 0.00 0.00 20 V 9.30 3.57 2.25 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 0.99 0.00 0.00 0.72 0.00 0.00 21 G 6.64 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 0.00 0.00 0.00 22 I 8.16 3.93 2.03 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.77 0.94 0.00 0.00 23 I 6.97 3.69 1.83 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.81 0.82 0.00 0.00 24 F 7.92 4.52 0.00 2.97 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 25 A 8.08 4.08 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 I 8.08 4.03 1.90 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 1.43 1.00 0.92 0.00 0.00 27 K 7.89 4.55 0.00 1.89 1.77 0.00 1.68 0.00 0.00 1.64 0.00 0.00 2.93 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.66 1.54 7.81 28 S 7.80 4.60 0.00 3.78 3.74 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 29 I 7.82 3.93 1.88 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 1.48 0.76 0.92 0.00 0.00 30 K 7.38 4.48 0.00 1.89 1.81 0.00 1.61 0.00 0.00 1.64 0.00 0.00 2.93 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.47 1.38 7.81 31 L 7.25 3.95 0.00 1.66 1.56 0.88 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 32 I 7.44 3.99 1.85 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.64 0.89 0.00 0.00