NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 A 4.2089 8.1233 123.5540 52.1922 20.9826 179.0298 3 F 4.0856 7.6031 114.4347 59.8108 38.9096 175.8166 4 L 4.1168 8.2278 119.8150 57.9801 42.4039 178.7905 5 G 3.5325 8.0335 104.9439 47.7403 0.0000 175.1241 6 A 3.9906 8.5337 123.9755 54.7629 18.3608 179.5713 7 A 3.9429 8.1191 118.9338 55.4502 18.5540 179.7579 8 I 3.6199 7.8272 118.0519 64.5989 37.1832 178.5491 9 A 3.9714 8.1094 121.1719 55.1315 18.2378 179.6230 10 A 4.0650 8.2285 119.4828 55.0913 18.4809 180.2098 11 G 3.5172 8.7110 104.5958 47.9882 0.0000 176.0305 12 L 4.0144 7.9151 121.6426 57.3695 41.5522 179.4566 13 A 3.9691 8.1007 120.5514 55.0009 18.2656 179.5800 14 A 3.9097 8.1022 119.3155 55.2363 18.4799 179.9547 15 V 3.5070 7.9171 116.5230 66.0402 31.6049 177.9032 16 A 4.0524 8.2919 120.7754 55.3821 18.2726 179.9598 17 G 3.8749 8.6140 105.3077 47.1956 0.0000 175.8504 18 A 3.9974 8.1301 123.2348 55.0930 18.3843 179.8891 19 I 3.7150 7.8490 118.1688 64.1124 37.2169 178.2319 20 A 3.9759 7.9737 121.8096 55.4335 18.1673 179.8864 21 V 3.5299 7.8113 116.2330 66.0325 31.5035 177.9626 22 A 4.0093 8.1367 120.5195 55.2170 18.2165 179.7066 23 I 3.6300 7.9671 118.2889 64.6601 37.2226 178.7559 24 I 3.6955 7.7468 120.5997 64.3554 36.8406 178.7702 25 V 3.5249 8.2163 119.5371 65.8029 31.3424 177.9557 26 K 3.8662 8.3601 119.4760 59.3450 31.9144 178.5773 27 A 3.9594 8.1011 121.0221 55.5812 18.3641 179.7404 28 T 3.7857 7.8462 114.2166 66.7846 68.4645 177.0447 29 I 3.7326 7.9910 121.9030 64.3988 37.2465 178.3614 30 E 4.0868 8.4483 119.7368 59.2905 29.1653 179.7215 31 G 3.5899 8.4825 106.2770 48.0790 0.0000 176.0679 32 T 3.9110 8.0371 118.1831 66.4014 68.1914 176.9898 33 T 3.9328 7.7605 117.0065 66.9349 68.6077 176.5260 34 R 4.1749 7.6611 117.9310 57.9802 31.7293 177.0778 35 Q 4.5364 8.3347 118.7736 53.6898 29.0471 173.5317 36 P 4.5375 0.0000 0.0000 64.5936 32.1437 178.7082 37 E 4.0108 8.1336 117.5365 58.1995 29.8872 177.4081 38 L 4.5132 8.3649 118.2632 54.6991 41.7025 177.8415 39 R 3.9497 7.7571 122.0605 59.7934 29.8107 178.3595 40 G 3.6294 8.1461 104.7326 47.9708 0.0000 175.1932 41 T 3.8962 7.9229 118.0314 66.3697 68.5502 176.3594 42 L 4.0228 8.1325 120.5130 57.6246 41.5734 179.2965 43 Q 3.6318 8.2330 119.8815 59.1993 28.8966 178.4269 44 T 4.0085 8.1736 117.2106 66.5293 68.5031 176.6902 45 L 4.0005 7.7814 120.5478 57.9876 41.6227 179.2953 46 M 4.0274 8.0085 118.2859 58.5182 31.9429 178.0911 47 F 4.7453 8.0069 116.5803 59.5232 39.5135 177.5833 48 I 4.1711 7.8687 120.2167 63.9866 37.2350 178.1987 49 G 3.6831 8.5268 106.8672 47.7629 0.0000 175.6456 50 V 3.6127 7.9242 120.5525 65.4061 31.4654 176.2718 51 P 4.2721 0.0000 0.0000 65.5941 31.0130 178.3385 52 L 3.9714 7.5750 115.7804 58.1030 41.6696 179.3785 53 A 4.1587 8.1988 119.4404 54.7811 18.7585 178.9258 54 E 4.1493 8.3448 115.9940 57.7970 29.7803 178.6392 55 A 3.9861 7.6589 121.9374 55.5422 18.4031 179.9015 56 V 3.6029 7.7139 115.8266 65.4423 31.6401 176.2022 57 P 4.2501 0.0000 0.0000 65.6516 31.1833 178.5809 58 I 3.7254 7.9946 118.6371 64.4849 36.9442 178.5741 59 I 3.8052 7.7769 120.2072 64.2964 36.7873 178.3876 60 A 4.0186 8.3054 121.8411 54.9376 18.1311 179.8228 61 I 3.6453 7.9208 118.6494 64.5848 37.2121 178.5987 62 V 3.6261 8.2137 119.4717 66.3039 31.2293 178.1340 63 I 3.7295 8.1727 119.7656 64.3029 36.3962 178.2464 64 S 4.0823 8.3576 114.4170 61.5209 62.1052 176.3519 65 L 4.2347 8.1246 121.6423 57.6458 41.1382 179.4371 66 L 4.0501 7.9766 118.4444 57.8922 41.6445 179.3041 67 I 3.7674 7.8148 118.8231 63.9096 36.9945 177.8162 68 L 3.9684 7.1639 117.7018 55.7025 41.9049 176.7306 69 F 4.5452 8.1318 121.4094 57.5595 39.5057 174.7827 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 2 A 8.12 4.21 0.97 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 3 F 7.60 4.09 0.00 3.16 2.97 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 4 L 8.23 4.12 0.00 1.81 1.69 0.94 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 5 G 8.03 3.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.53 3.99 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 7 A 8.12 3.94 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 8 I 7.83 3.62 2.00 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 1.46 0.99 0.91 0.00 0.00 9 A 8.11 3.97 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 10 A 8.23 4.06 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 11 G 8.71 3.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 7.92 4.01 0.00 1.80 1.73 0.92 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 13 A 8.10 3.97 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.10 3.91 1.41 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 0.00 0.00 0.00 15 V 7.92 3.51 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 1.00 0.00 0.00 0.96 0.00 0.00 16 A 8.29 4.05 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.61 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 18 A 8.13 4.00 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 19 I 7.85 3.71 2.02 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 1.46 0.58 0.91 0.00 0.00 20 A 7.97 3.98 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 21 V 7.81 3.53 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.00 0.00 1.05 0.00 0.00 22 A 8.14 4.01 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 I 7.97 3.63 2.02 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 0.97 0.90 0.00 0.00 24 I 7.75 3.70 1.86 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 1.40 0.66 0.88 0.00 0.00 25 V 8.22 3.52 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 1.04 0.00 0.00 0.94 0.00 0.00 26 K 8.36 3.87 0.00 1.89 1.98 0.00 1.68 0.00 0.00 1.64 0.00 0.00 3.13 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.42 1.45 7.81 27 A 8.10 3.96 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 28 T 7.85 3.79 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 1.10 0.00 0.00 29 I 7.99 3.73 1.85 0.00 0.00 0.85 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 0.88 0.90 0.00 0.00 30 E 8.45 4.09 0.00 2.14 1.98 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 2.32 2.49 0.00 31 G 8.48 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 T 8.04 3.91 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 33 T 7.76 3.93 4.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 34 R 7.66 4.17 0.00 1.80 1.98 0.00 3.10 0.00 0.00 3.14 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.62 0.00 35 Q 8.33 4.54 0.00 2.03 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.10 6.78 0.00 0.00 0.00 0.00 0.00 2.23 2.35 0.00 36 P 0.00 4.54 0.00 2.21 2.09 0.00 3.92 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.16 0.00 37 E 8.13 4.01 0.00 1.90 1.97 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 2.29 2.39 0.00 38 L 8.36 4.51 0.00 1.87 1.64 0.91 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 39 R 7.76 3.95 0.00 1.95 1.93 0.00 3.10 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 1.61 1.64 0.00 40 G 8.15 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 T 7.92 3.90 4.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 42 L 8.13 4.02 0.00 1.63 1.65 0.89 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 43 Q 8.23 3.63 0.00 2.37 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.81 0.00 0.00 0.00 0.00 0.00 1.87 2.22 0.00 44 T 8.17 4.01 4.42 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 1.26 0.00 0.00 45 L 7.78 4.00 0.00 1.86 1.69 0.90 0.63 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 46 M 8.01 4.03 0.00 1.75 1.85 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.46 2.33 0.00 47 F 8.01 4.75 0.00 3.12 2.99 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 48 I 7.87 4.17 2.03 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 1.50 1.14 0.93 0.00 0.00 49 G 8.53 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 V 7.92 3.61 2.27 0.00 0.00 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 0.96 0.00 0.00 51 P 0.00 4.27 0.00 2.22 2.11 0.00 3.86 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 2.23 0.00 52 L 7.58 3.97 0.00 1.85 1.76 0.93 0.77 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 53 A 8.20 4.16 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 54 E 8.34 4.15 0.00 2.02 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 2.48 2.48 0.00 55 A 7.66 3.99 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 56 V 7.71 3.60 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 0.94 0.00 0.00 57 P 0.00 4.25 0.00 2.32 2.29 0.00 3.74 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 2.19 0.00 58 I 7.99 3.73 2.08 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 1.53 0.62 0.92 0.00 0.00 59 I 7.78 3.81 1.88 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 1.46 0.96 0.92 0.00 0.00 60 A 8.31 4.02 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 61 I 7.92 3.65 2.08 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 1.62 0.92 0.94 0.00 0.00 62 V 8.21 3.63 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 1.05 0.00 0.00 1.00 0.00 0.00 63 I 8.17 3.73 2.02 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 1.41 0.53 0.91 0.00 0.00 64 S 8.36 4.08 0.00 3.95 4.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 65 L 8.12 4.23 0.00 1.98 1.89 0.98 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 66 L 7.98 4.05 0.00 1.78 1.75 0.94 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 67 I 7.81 3.77 1.98 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.61 0.89 0.00 0.00 68 L 7.16 3.97 0.00 1.39 0.47 0.77 0.59 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 69 F 8.13 4.55 0.00 3.09 2.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00