NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.9026 8.2127 109.7365 45.1504 0.0000 173.6053 2 V 3.3506 8.5667 118.0742 66.1606 31.4612 176.5548 3 I 3.9242 8.4965 120.3289 64.3784 37.4468 177.6373 4 D 4.4186 7.9982 119.3059 57.4008 40.8624 178.3522 5 T 4.1441 7.7769 115.1577 65.6511 68.2972 177.1070 6 S 5.0079 8.2644 119.0435 60.9792 62.8435 176.2755 7 A 4.1061 7.8031 124.3647 54.0680 18.1347 179.6076 8 V 3.5312 7.5925 116.9047 66.3232 31.5914 177.8250 9 E 3.9448 8.0515 117.8898 59.7196 28.9671 179.8092 10 S 4.0825 7.7195 114.4639 61.6970 62.9192 176.6748 11 A 4.1213 8.1163 123.4039 55.0695 18.1054 179.7656 12 I 3.6665 8.0401 118.6471 64.5237 37.0935 178.6932 13 T 3.8327 7.9404 116.7546 66.8245 68.2629 176.2358 14 D 4.4625 8.0710 120.6011 57.3226 40.8799 179.0200 15 G 3.6924 8.2981 106.3544 48.1581 0.0000 175.6966 16 Q 4.1536 8.6817 121.1380 58.3088 28.5885 178.9453 17 G 3.6719 8.0847 106.8393 48.0206 0.0000 175.2624 18 D 4.3638 8.3447 122.2543 57.1880 40.9396 178.7606 19 M 4.0258 8.0129 118.9760 58.5947 32.1474 178.8599 20 K 4.0527 8.2022 118.9380 58.7444 32.3626 178.9333 21 A 3.9174 7.6770 121.1386 55.2653 18.3386 179.6905 22 I 3.8349 8.2395 118.8660 64.5267 37.3280 178.8379 23 G 3.8119 8.2867 106.7344 47.8091 0.0000 175.5240 24 G 3.6931 7.9413 107.4861 48.2905 0.0000 175.2054 25 Y 4.6321 8.0200 122.4325 60.0044 38.7636 178.0505 26 I 3.7374 8.2018 121.3513 64.3242 37.0881 178.4116 27 V 3.7144 7.8735 119.0296 65.6979 31.2993 178.0463 28 G 3.8995 8.0845 105.0441 47.9733 0.0000 175.3828 29 A 3.9638 7.7630 123.5262 54.8638 18.4520 179.6729 30 L 4.0153 8.0954 117.5345 57.8703 41.6166 180.1662 31 V 3.5843 8.0680 118.5234 66.1407 31.5518 178.1314 32 I 3.8402 7.7119 119.4790 64.5493 36.7655 178.1659 33 L 3.9760 8.5254 120.1586 57.2877 41.5588 178.9111 34 A 3.9986 8.5294 120.9500 55.7467 18.3423 180.0049 35 V 3.5703 8.3726 116.4710 66.0393 31.6143 178.1009 36 A 4.2067 8.2958 120.7225 54.7765 18.1020 179.6868 37 G 3.8071 8.4399 104.5442 47.5105 0.0000 176.0646 38 L 4.0301 7.6308 120.5570 57.6119 41.8712 179.1450 39 I 3.9722 7.6144 119.7378 64.2738 37.0995 177.5829 40 Y 4.3183 8.1825 120.4546 61.0568 38.5611 178.5008 41 S 3.9321 8.4085 115.9438 61.2763 62.7480 176.2244 42 M 4.1060 8.0477 121.3479 58.1131 31.7109 178.3424 43 L 3.9805 7.8223 118.1130 57.8601 42.1172 178.6776 44 R 4.0763 7.8376 116.6892 59.4506 30.0867 178.7427 45 K 4.0321 7.7223 117.0537 58.8488 32.4592 176.4451 46 A 4.3280 8.1710 125.6183 52.1633 19.1438 175.8091 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 8.21 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 V 8.57 3.35 2.08 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 0.87 0.00 0.00 0.93 0.00 0.00 3 I 8.50 3.92 1.87 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.43 0.91 0.00 0.00 4 D 8.00 4.42 0.00 2.77 2.71 0.00 0.00 0.00 0.00 0.00 0.00 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 T 7.78 4.14 4.37 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 0.00 0.00 0.00 1.21 0.00 0.00 6 S 8.26 5.01 0.00 4.04 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 7 A 7.80 4.11 1.37 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 0.00 0.00 0.00 0.00 0.00 0.00 8 V 7.59 3.53 2.08 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 1.10 0.00 0.00 0.98 0.00 0.00 9 E 8.05 3.94 0.00 2.32 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.64 0.00 10 S 7.72 4.08 0.00 3.97 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 11 A 8.12 4.12 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.04 3.67 2.08 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.69 0.91 0.00 0.00 13 T 7.94 3.83 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 1.21 0.00 0.00 14 D 8.07 4.46 0.00 2.85 2.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 15 G 8.30 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 8.68 4.15 0.00 2.21 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.72 0.00 0.00 0.00 0.00 0.00 2.38 2.68 0.00 17 G 8.08 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 D 8.34 4.36 0.00 2.83 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 19 M 8.01 4.03 0.00 2.08 2.41 0.00 0.00 0.00 0.00 0.00 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.63 2.57 0.00 20 K 8.20 4.05 0.00 1.98 1.79 0.00 1.63 0.00 0.00 1.64 0.00 0.00 2.95 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.43 1.45 7.81 21 A 7.68 3.92 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.24 3.83 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 1.50 0.78 0.95 0.00 0.00 23 G 8.29 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 0.00 0.00 0.00 24 G 7.94 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Y 8.02 4.63 0.00 3.01 2.89 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 26 I 8.20 3.74 2.14 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 0.62 0.93 0.00 0.00 27 V 7.87 3.71 2.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.00 0.00 0.98 0.00 0.00 28 G 8.08 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 29 A 7.76 3.96 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.10 4.02 0.00 1.96 1.76 0.96 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 31 V 8.07 3.58 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 0.00 0.00 1.01 0.00 0.00 32 I 7.71 3.84 1.96 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.49 0.91 0.00 0.00 33 L 8.53 3.98 0.00 1.77 1.70 0.93 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 34 A 8.53 4.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 V 8.37 3.57 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 1.02 0.00 0.00 0.96 0.00 0.00 36 A 8.30 4.21 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 G 8.44 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 0.00 0.00 0.00 38 L 7.63 4.03 0.00 1.93 1.76 0.93 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 39 I 7.61 3.97 2.06 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 1.43 1.15 0.95 0.00 0.00 40 Y 8.18 4.32 0.00 3.03 3.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 S 8.41 3.93 0.00 4.07 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 42 M 8.05 4.11 0.00 2.25 2.20 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.63 0.00 43 L 7.82 3.98 0.00 1.93 1.77 1.03 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 44 R 7.84 4.08 0.00 1.92 1.94 0.00 2.71 0.00 0.00 2.95 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.53 0.00 45 K 7.72 4.03 0.00 1.88 2.01 0.00 1.73 0.00 0.00 1.70 0.00 0.00 3.06 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.44 1.43 7.81 46 A 8.17 4.33 1.20 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 0.00 0.00