NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 4.1456 8.3549 108.0436 46.3172 0.0000 172.5784 2 Q 4.6452 8.7652 119.3918 53.2330 30.4813 174.2288 3 R 3.8037 9.1784 126.7377 56.6849 31.9090 174.6559 4 A 5.0616 8.4694 126.2619 50.8551 23.6903 174.9538 5 V 4.7561 8.5479 118.3847 59.6126 34.6774 175.0194 6 A 4.6704 8.9564 126.6207 52.1286 19.0516 177.6635 7 L 4.4353 8.7367 122.0436 54.9247 42.4302 176.0805 8 Y 4.5583 7.3828 115.2209 55.9767 41.9871 174.6902 9 D 4.8326 8.6145 121.0059 54.6889 42.3337 176.1185 10 F 5.0583 9.2127 123.4087 57.1939 42.7312 172.9587 11 E 4.2555 8.7073 128.4916 53.7400 29.9654 173.9322 12 P 3.9987 0.0000 0.0000 62.7274 31.9368 176.4216 13 E 4.5509 9.0740 119.3029 56.3181 31.2288 176.1019 14 N 5.0992 7.8158 115.4266 51.1341 42.4090 175.0682 15 D 4.4487 8.6619 120.3793 56.7116 41.2500 176.9871 16 N 4.7017 8.0781 115.6981 52.8166 37.7726 173.9198 17 E 5.1415 7.8100 118.4005 55.2050 31.7477 174.9799 18 L 4.6754 8.5982 124.9684 53.2493 43.4260 176.2503 19 R 4.3117 8.7614 127.1972 56.5696 31.0435 175.3692 20 L 5.0277 8.9639 124.9520 52.9190 45.5564 175.0860 21 A 5.1639 9.1081 124.7101 49.6430 21.6138 175.9604 22 E 4.0024 9.2866 122.8274 58.3336 29.9058 177.5486 23 G 3.9804 9.2831 115.2622 44.9726 0.0000 173.4211 24 D 4.5032 7.9850 120.5794 54.5460 41.9084 175.8853 25 I 4.4005 8.2749 123.9157 61.2772 38.1001 175.5526 26 V 4.6817 8.5557 118.7907 59.5575 36.6684 174.3848 27 F 5.1363 9.0413 120.1654 55.8738 41.9412 174.7839 28 I 4.4831 8.8351 126.1524 61.1870 37.6966 177.0343 29 S 4.4480 9.0856 124.7540 60.7092 63.4756 173.9220 30 Y 4.6333 7.1115 114.7487 56.3084 39.8914 172.2275 31 K 4.5640 8.8031 121.6531 55.8501 33.1785 175.5803 32 H 4.6444 9.0546 127.0056 58.3469 30.3801 174.6506 33 G 3.9964 7.7409 105.0469 44.8053 0.0000 171.3239 34 Q 3.9789 8.8250 118.2625 58.2362 28.7304 177.9589 35 G 3.8077 9.5302 111.4187 44.7009 0.0000 172.1124 36 W 5.3092 8.1953 119.1402 54.7828 33.4807 174.3287 37 L 5.1634 8.8211 122.7887 52.9607 45.0846 175.3941 38 V 4.5577 8.2616 121.5794 61.6597 33.0213 174.7118 39 A 5.2307 8.9839 128.7564 50.3027 22.8463 174.3978 40 E 5.1465 9.1361 119.9949 54.5933 32.3744 176.0226 41 N 5.0430 8.8465 121.0287 52.3257 38.8676 175.5825 42 E 4.2212 8.9766 119.4046 59.3439 29.6915 177.8394 43 S 4.2680 8.1227 111.3281 58.9508 63.7009 175.0114 44 G 3.9146 8.0826 109.0655 45.8750 0.0000 174.2655 45 S 4.5409 7.7570 112.6108 58.4478 64.0775 174.3039 46 K 4.7991 8.3639 120.6945 54.8997 35.8798 175.3963 47 T 5.0739 8.3159 119.2442 61.8375 72.3555 173.2955 48 G 4.0113 8.4628 110.9759 45.8466 0.0000 172.1976 49 L 4.9313 8.2928 120.1867 55.0297 42.8367 177.3317 50 V 4.7374 8.8705 114.4951 58.9463 36.8698 173.0939 51 P 3.3840 0.0000 0.0000 61.6894 31.3370 177.2746 52 E 3.7476 8.3314 124.8035 59.3254 29.6013 178.4646 53 E 4.0876 7.5857 115.6712 57.9863 29.8814 177.1206 54 F 4.9130 7.8668 117.3567 57.4686 39.5852 175.0513 55 V 4.8236 7.2518 120.4978 60.9165 34.0038 174.6870 56 S 4.5914 8.5623 120.8956 56.4599 65.2834 172.6956 57 Y 4.4381 8.7388 124.9818 58.1479 38.6974 175.4302 58 I 4.4358 8.2516 125.1123 60.2621 38.3100 175.9911 59 Q 4.2142 8.4070 124.5218 56.7507 27.8421 174.0349 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 4.15 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 0.00 0.00 0.00 2 Q 8.77 4.65 0.00 2.27 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.69 6.93 0.00 0.00 0.00 0.00 0.00 2.38 2.47 0.00 3 R 9.18 3.80 0.00 2.01 1.79 0.00 3.15 0.00 0.00 3.47 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.86 0.00 4 A 8.47 5.06 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 V 8.55 4.76 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 0.77 0.00 0.00 0.92 0.00 0.00 6 A 8.96 4.67 1.33 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 0.00 0.00 0.00 7 L 8.74 4.44 0.00 1.46 1.37 0.86 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 8 Y 7.38 4.56 0.00 1.56 2.06 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 9 D 8.61 4.83 0.00 2.61 2.66 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 0.00 0.00 0.00 0.00 10 F 9.21 5.06 0.00 3.37 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 11 E 8.71 4.26 0.00 1.95 1.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.29 0.00 12 P 0.00 4.00 0.00 1.94 1.83 0.00 3.50 0.00 0.00 3.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 1.79 0.00 13 E 9.07 4.55 0.00 1.91 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.25 2.42 0.00 14 N 7.82 5.10 0.00 2.61 2.58 0.00 0.00 7.16 8.08 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 15 D 8.66 4.45 0.00 2.64 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 16 N 8.08 4.70 0.00 2.89 2.99 0.00 0.00 6.19 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 17 E 7.81 5.14 0.00 2.07 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 2.17 0.00 18 L 8.60 4.68 0.00 1.78 1.70 0.98 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 19 R 8.76 4.31 0.00 1.83 1.83 0.00 3.23 0.00 0.00 3.22 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.80 0.00 20 L 8.96 5.03 0.00 1.86 1.62 1.09 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 21 A 9.11 5.16 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 22 E 9.29 4.00 0.00 1.93 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 2.16 0.00 23 G 9.28 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 24 D 7.98 4.50 0.00 2.69 2.62 0.00 0.00 0.00 0.00 0.00 0.00 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 I 8.27 4.40 1.84 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.71 0.67 0.00 0.00 26 V 8.56 4.68 2.15 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 0.73 0.00 0.00 0.83 0.00 0.00 27 F 9.04 5.14 0.00 3.05 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 28 I 8.84 4.48 2.12 0.00 0.00 0.79 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 0.84 1.02 0.00 0.00 29 S 9.09 4.45 0.00 3.68 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 30 Y 7.11 4.63 0.00 3.18 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 31 K 8.80 4.56 0.00 1.84 1.87 0.00 1.82 0.00 0.00 1.69 0.00 0.00 2.81 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.47 1.66 7.81 32 H 9.05 4.64 0.00 3.16 3.42 0.00 6.04 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 G 7.74 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 Q 8.83 3.98 0.00 2.10 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.57 0.00 0.00 0.00 0.00 0.00 2.39 2.42 0.00 35 G 9.53 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 36 W 8.20 5.31 0.00 3.27 3.02 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.82 5.16 0.00 1.53 1.50 0.83 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 38 V 8.26 4.56 1.04 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 0.84 0.00 0.00 0.56 0.00 0.00 39 A 8.98 5.23 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 40 E 9.14 5.15 0.00 2.07 1.95 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 2.30 2.31 0.00 41 N 8.85 5.04 0.00 2.83 3.04 0.00 0.00 6.65 7.17 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 42 E 8.98 4.22 0.00 2.18 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.42 2.49 0.00 43 S 8.12 4.27 0.00 4.04 4.01 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 44 G 8.08 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 0.00 0.00 0.00 45 S 7.76 4.54 0.00 4.05 4.01 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 46 K 8.36 4.80 0.00 1.74 1.71 0.00 1.63 0.00 0.00 1.68 0.00 0.00 2.82 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.36 1.40 7.81 47 T 8.32 5.07 4.27 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 0.00 0.00 0.00 1.28 0.00 0.00 48 G 8.46 4.01 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 0.00 0.00 0.00 49 L 8.29 4.93 0.00 1.56 1.68 0.62 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 0.00 0.00 0.00 0.00 50 V 8.87 4.74 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.00 0.00 0.87 0.00 0.00 51 P 0.00 3.38 0.00 0.55 0.51 0.00 2.68 0.00 0.00 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.49 0.44 0.00 52 E 8.33 3.75 0.00 1.83 1.82 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 2.23 2.25 0.00 53 E 7.59 4.09 0.00 1.76 1.93 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 2.11 2.12 0.00 54 F 7.87 4.91 0.00 3.00 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 55 V 7.25 4.82 1.83 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 0.37 0.00 0.00 0.88 0.00 0.00 56 S 8.56 4.59 0.00 3.86 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 57 Y 8.74 4.44 0.00 2.90 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 58 I 8.25 4.44 1.86 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.52 0.92 0.00 0.00 59 Q 8.41 4.21 0.00 2.11 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.65 0.00 0.00 0.00 0.00 0.00 2.23 2.30 0.00