NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.9318 8.3393 109.7396 45.6987 0.0000 174.1040 2 T 3.9709 7.9208 113.6457 60.0599 70.9358 173.9118 3 K 3.8397 9.2757 123.5023 59.9731 32.5659 180.1199 4 Q 3.9139 7.8962 117.6540 58.9366 28.7094 178.2841 5 E 3.0946 7.8289 119.2930 58.9634 29.3767 179.7120 6 K 3.9581 7.7767 117.9757 59.6244 32.1275 179.3019 7 T 3.8041 7.8906 115.8345 66.7088 68.3245 176.2682 8 A 3.9583 7.9288 122.2824 55.0790 18.4229 179.2299 9 L 4.0753 7.9513 118.7840 58.7010 42.0841 179.0726 10 N 4.4587 8.7326 116.6733 56.4921 38.3873 177.1125 11 M 4.1126 8.4167 119.6085 58.5804 32.3153 178.1076 12 A 4.0865 8.4941 121.2632 55.1674 18.5838 179.4535 13 R 3.3968 8.3975 117.2549 59.6448 30.0451 178.1624 14 Y 4.1435 8.2893 119.3793 60.8038 38.8533 177.6576 15 I 3.4890 8.1341 121.1650 64.5283 37.2991 178.3406 16 R 3.8214 7.9574 119.5114 59.4169 29.9220 178.7666 17 S 4.1232 7.9568 114.1105 61.3712 62.9329 176.4802 18 Q 3.8229 7.9895 122.1060 58.8965 28.2906 178.8221 19 T 3.8596 7.9694 110.8978 64.5128 68.6266 176.2146 20 L 3.8775 7.8690 123.0293 58.2784 42.0838 179.2304 21 T 3.8194 7.8399 115.4075 66.5808 68.4695 176.2184 22 L 3.9011 8.1458 122.6545 58.3007 41.9632 178.7044 23 L 3.9511 7.9529 119.9709 58.2084 41.9613 178.6918 24 E 3.9032 7.9594 119.2634 59.0843 29.4634 178.7473 25 K 3.9185 8.0333 118.5734 59.6128 32.1567 179.2811 26 L 4.0005 8.4535 119.3852 57.9186 41.5073 179.3452 27 N 4.3629 8.3624 116.4851 56.3564 38.2365 177.2758 28 E 4.0497 8.2297 118.8891 58.5177 29.6173 178.2483 29 L 4.3224 7.4651 117.0110 53.7302 42.3363 175.9368 30 D 4.3212 7.9391 117.7909 55.2153 39.5829 175.5329 31 A 4.4566 7.7218 120.1914 50.5645 15.8665 176.9921 32 D 4.3163 7.8967 125.4537 56.9258 41.6486 178.4866 33 E 3.9592 8.0806 118.3331 59.5564 29.4844 179.3198 34 Q 4.0045 8.0355 117.4120 58.8025 28.8209 178.4077 35 A 3.9760 8.6492 122.1897 55.1908 18.5053 179.3645 36 D 4.3013 8.3925 117.6683 57.5825 40.8232 179.0762 37 I 3.6972 7.6151 119.8007 64.6794 37.1568 178.1460 38 C 4.1095 8.4023 119.6620 62.1591 31.3073 175.2418 39 E 3.9324 8.3992 121.3387 59.3488 29.2260 178.7978 40 S 4.1506 8.0484 112.9909 61.1096 62.3094 175.8745 41 L 3.9785 8.1867 123.6081 58.2095 41.7986 178.3096 42 H 4.2936 8.5226 119.9775 58.9719 29.7258 177.0545 43 D 4.3638 8.2519 120.6345 57.4236 40.5199 178.2117 44 H 4.2134 8.5538 118.8732 59.2214 29.7841 177.2118 45 A 3.9653 8.3660 123.0106 55.0032 18.0784 179.1713 46 D 4.2646 8.2666 116.6337 57.4424 41.3614 177.6367 47 E 3.8950 8.3857 120.3481 59.5218 29.4568 178.6337 48 L 3.9117 8.2357 120.1148 58.3699 42.1053 178.1750 49 Y 4.1515 8.3429 119.6359 61.0359 38.7352 178.4785 50 R 3.6456 8.3176 119.1238 59.0764 30.1220 179.0434 51 S 3.9701 8.0001 113.0377 61.5616 62.3240 176.0844 52 C 3.7483 8.1539 119.6558 62.3923 27.6190 175.8006 53 L 3.7664 7.6471 121.3039 58.0374 41.6995 178.5838 54 A 4.0187 7.6370 119.5792 55.0115 18.3236 179.3435 55 R 3.7594 7.4450 116.3122 58.6846 30.2100 176.9259 56 F 4.9254 8.0103 121.1693 57.6332 39.3901 175.3692 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 8.34 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 T 7.92 3.97 4.20 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 1.19 0.00 0.00 3 K 9.28 3.84 0.00 1.86 1.82 0.00 1.58 0.00 0.00 1.79 0.00 0.00 2.99 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.48 1.57 7.81 4 Q 7.90 3.91 0.00 2.07 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.67 0.00 0.00 0.00 0.00 0.00 2.40 2.45 0.00 5 E 7.83 3.09 0.00 1.99 1.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 2.06 0.00 6 K 7.78 3.96 0.00 1.94 1.83 0.00 1.55 0.00 0.00 1.64 0.00 0.00 3.06 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.45 1.53 7.81 7 T 7.89 3.80 4.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 8 A 7.93 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 9 L 7.95 4.08 0.00 2.06 1.93 0.94 0.67 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 10 N 8.73 4.46 0.00 2.89 2.86 0.00 0.00 6.71 7.66 0.00 0.00 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 M 8.42 4.11 0.00 2.25 2.18 0.00 0.00 0.00 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.72 2.65 0.00 12 A 8.49 4.09 1.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.40 3.40 0.00 1.96 2.14 0.00 3.10 0.00 0.00 3.02 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.01 0.00 14 Y 8.29 4.14 0.00 3.12 3.17 0.00 0.00 0.00 0.00 0.00 0.00 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 I 8.13 3.49 2.01 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.62 0.88 0.00 0.00 16 R 7.96 3.82 0.00 1.82 1.92 0.00 3.03 0.00 0.00 3.17 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.46 0.00 17 S 7.96 4.12 0.00 4.06 4.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 18 Q 7.99 3.82 0.00 1.97 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.84 0.00 0.00 0.00 0.00 0.00 1.53 1.69 0.00 19 T 7.97 3.86 4.25 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 1.19 0.00 0.00 20 L 7.87 3.88 0.00 1.83 1.81 0.75 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 21 T 7.84 3.82 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 1.19 0.00 0.00 22 L 8.15 3.90 0.00 1.69 1.65 0.91 0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 23 L 7.95 3.95 0.00 1.92 1.84 0.96 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 24 E 7.96 3.90 0.00 2.04 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.38 0.00 25 K 8.03 3.92 0.00 2.04 1.84 0.00 1.71 0.00 0.00 1.64 0.00 0.00 2.92 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.45 1.65 7.81 26 L 8.45 4.00 0.00 1.76 1.71 0.91 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 27 N 8.36 4.36 0.00 2.93 2.86 0.00 0.00 7.05 7.18 0.00 0.00 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 E 8.23 4.05 0.00 2.07 2.01 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 2.34 2.59 0.00 29 L 7.47 4.32 0.00 1.73 1.70 0.95 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 30 D 7.94 4.32 0.00 2.78 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 31 A 7.72 4.46 1.31 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 0.00 0.00 0.00 32 D 7.90 4.32 0.00 2.73 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 33 E 8.08 3.96 0.00 2.05 1.99 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 2.40 2.46 0.00 34 Q 8.04 4.00 0.00 2.26 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.91 0.00 0.00 0.00 0.00 0.00 2.45 2.48 0.00 35 A 8.65 3.98 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 36 D 8.39 4.30 0.00 2.83 2.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 I 7.62 3.70 2.00 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 1.41 0.81 0.92 0.00 0.00 38 C 8.40 4.11 0.00 3.08 3.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 39 E 8.40 3.93 0.00 2.07 2.07 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 2.32 2.32 0.00 40 S 8.05 4.15 0.00 3.97 4.08 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 41 L 8.19 3.98 0.00 1.90 1.75 0.92 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 42 H 8.52 4.29 0.00 3.19 3.47 0.00 5.68 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 D 8.25 4.36 0.00 2.90 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 44 H 8.55 4.21 0.00 3.43 3.45 0.00 5.78 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 A 8.37 3.97 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 46 D 8.27 4.26 0.00 2.75 2.82 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 47 E 8.39 3.89 0.00 2.08 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 0.00 2.35 2.37 0.00 48 L 8.24 3.91 0.00 1.79 1.86 0.95 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 49 Y 8.34 4.15 0.00 3.12 3.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 R 8.32 3.65 0.00 1.86 1.91 0.00 3.21 0.00 0.00 3.13 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 2.08 0.00 51 S 8.00 3.97 0.00 3.84 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 C 8.15 3.75 0.00 3.12 3.13 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 53 L 7.65 3.77 0.00 1.18 1.51 0.85 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 54 A 7.64 4.02 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 55 R 7.44 3.76 0.00 1.45 0.71 0.00 2.95 0.00 0.00 2.62 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 1.42 0.00 56 F 8.01 4.93 0.00 3.08 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