NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 5002 A 4.2393 8.2644 123.5808 54.4279 19.6855 176.0531 5003 R 4.2860 7.8967 107.5136 56.0531 31.1107 174.2044 5004 R 4.2991 8.1882 121.8272 56.0601 31.5304 175.2914 5005 T 4.6950 8.2875 106.2541 60.2852 72.4698 174.0816 5006 W 4.3666 8.7741 131.8234 60.9437 30.7741 177.8063 5007 L 3.4839 8.2845 119.7031 58.1737 42.1004 178.8412 5008 G 3.8225 7.8897 105.0429 47.8877 0.0000 175.3491 5009 D 4.3139 8.2150 121.1079 57.1431 40.8787 178.6603 5010 I 3.6843 7.1598 117.9484 63.0571 37.1609 177.1326 5011 L 4.4613 7.2883 119.3913 55.6228 42.6797 178.9186 5012 R 3.7107 7.5991 119.3451 58.8338 30.2579 175.7979 5013 P 4.4912 0.0000 0.0000 63.3722 31.4778 176.3188 5014 L 4.3322 8.4737 119.5729 56.4022 43.2828 177.2438 5015 N 4.8121 7.3188 117.4745 52.6553 37.1797 174.3909 5016 S 4.6240 7.5792 113.7707 58.8260 66.1186 174.9427 5017 E 4.2463 7.9804 120.5864 56.7119 29.8449 177.3575 5018 Y 3.8515 7.9985 113.1878 62.0197 39.2105 176.8526 5019 G 3.2674 8.7932 115.9069 48.3273 0.0000 174.4290 5020 K 4.0625 6.9327 119.0574 54.1063 31.8712 181.2066 5021 V 4.3350 7.9895 122.3931 59.1178 34.0195 173.9988 5022 A 4.1558 8.4686 126.9845 51.7228 19.0296 174.7180 5023 P 4.6940 0.0000 0.0000 62.5201 33.6616 177.2901 5024 G 3.9562 8.1222 110.0632 47.3648 0.0000 174.0838 5025 W 4.4988 9.7635 123.7141 58.0401 30.2490 178.1282 5026 G 3.8507 7.3005 105.9541 44.8434 0.0000 178.4216 5027 T 4.2730 8.6882 124.5279 63.8738 68.3466 175.3383 5028 T 3.9025 7.6327 119.7952 66.6560 68.4353 174.1438 5029 P 4.3774 0.0000 0.0000 65.0544 31.4406 178.4307 5030 L 4.1288 8.3175 120.1466 58.0777 41.9005 178.6016 5031 M 4.0577 8.0111 117.6791 58.6637 32.3526 177.9124 5032 A 4.0502 8.4052 121.0879 54.9314 18.4603 179.9512 5033 V 3.5530 7.6682 116.8422 66.2654 31.6481 178.2463 5034 F 3.8966 8.3662 117.5270 61.1619 38.7337 176.9158 5035 M 4.3471 8.6484 118.2785 58.8426 31.8557 178.7577 5036 G 3.9696 8.3848 105.1009 47.9953 0.0000 175.2589 5037 L 3.9402 7.9953 122.2230 58.0176 42.1901 178.5699 5038 F 4.5090 9.1075 121.2420 61.5486 39.4125 176.2716 5039 L 3.6894 8.6530 120.0331 58.6855 41.7813 179.1586 5040 V 3.5981 7.8269 117.4738 65.9480 31.3157 177.8322 5041 F 4.3181 8.1720 120.0740 61.3536 39.1710 177.1292 5042 L 3.1578 7.2919 118.5675 57.3734 41.2684 179.2783 5043 L 3.5850 7.5936 119.7978 57.9981 41.7189 179.1929 5044 I 3.7552 7.3666 119.3029 64.7691 37.0463 177.8647 5045 I 3.7647 8.0152 121.2216 63.4121 36.9554 178.1488 5046 L 3.9048 8.8757 121.6289 58.5177 42.2966 179.0401 5047 E 4.2611 8.4197 116.7278 57.7278 29.5871 178.7325 5048 I 4.0674 8.7721 121.6683 63.9923 37.3882 177.3408 5049 Y 4.2135 7.8907 118.7982 60.6273 38.8457 176.7386 5050 N 4.4910 8.0565 114.8240 53.5896 39.1700 174.9804 5051 S 3.8718 7.7184 113.8578 60.8537 60.9707 171.9886 5052 T 4.4236 7.7008 114.6727 63.0562 68.0439 175.7229 5053 L 4.3361 7.2051 121.7734 54.8019 42.9110 173.4537 5054 I 4.2310 7.9319 124.7052 60.0701 38.5900 175.6378 5055 L 4.7883 7.9937 122.4218 52.4542 45.3428 175.6718 5056 D 4.4056 8.6529 121.7261 56.6642 40.7397 177.1440 5057 G 3.9332 8.9717 113.5840 45.1852 0.0000 173.4172 5058 V 3.4120 6.9965 119.7458 59.7577 31.5902 172.0312 5059 N 4.0254 8.1965 129.2587 53.6157 39.3469 175.3166 5060 V 4.0510 8.2135 123.6411 60.4145 30.6938 175.5628 5061 S 4.7791 7.5306 118.8291 55.2712 66.8293 176.0054 5062 W 4.3342 8.7547 118.2603 60.2277 28.9592 177.5538 5063 K 4.0927 7.7308 117.1266 55.7612 32.5842 175.2867 5064 A 4.4694 8.4300 135.0000 54.0674 19.5429 176.8178 5065 L 4.2348 8.7418 121.0550 53.2491 41.0254 179.5350 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 5002 A 8.26 4.24 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 5003 R 7.90 4.29 0.00 1.81 1.81 0.00 3.25 0.00 0.00 3.26 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 1.70 0.00 5004 R 8.19 4.30 0.00 1.87 1.70 0.00 3.36 0.00 0.00 3.28 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.18 0.00 5005 T 8.29 4.70 4.34 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 1.30 0.00 0.00 5006 W 8.77 4.37 0.00 3.42 3.32 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 5007 L 8.28 3.48 0.00 1.88 1.73 0.87 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 5008 G 7.89 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 0.00 0.00 0.00 5009 D 8.21 4.31 0.00 2.80 2.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5010 I 7.16 3.68 1.42 0.00 0.00 -1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.05 0.64 0.00 0.00 5011 L 7.29 4.46 0.00 1.68 1.61 0.86 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 5012 R 7.60 3.71 0.00 2.08 1.88 0.00 3.11 0.00 0.00 3.19 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.65 0.00 5013 P 0.00 4.49 0.00 2.19 2.12 0.00 3.32 0.00 0.00 3.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.89 0.00 5014 L 8.47 4.33 0.00 1.69 1.72 0.88 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 5015 N 7.32 4.81 0.00 2.49 2.73 0.00 0.00 7.05 7.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5016 S 7.58 4.62 0.00 3.99 4.19 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 0.00 0.00 0.00 5017 E 7.98 4.25 0.00 2.05 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 2.35 2.28 0.00 5018 Y 8.00 3.85 0.00 2.86 2.81 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 5019 G 8.79 3.27 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 0.00 0.00 0.00 0.00 5020 K 6.93 4.06 0.00 1.85 1.63 0.00 1.83 0.00 0.00 1.75 0.00 0.00 2.96 0.00 0.00 2.71 0.00 0.00 0.00 0.00 1.40 1.31 7.81 5021 V 7.99 4.34 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 0.78 0.00 0.00 0.87 0.00 0.00 5022 A 8.47 4.16 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 5023 P 0.00 4.69 0.00 2.21 1.98 0.00 3.76 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 2.08 2.07 0.00 5024 G 8.12 3.96 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 0.00 5025 W 9.76 4.50 0.00 3.40 3.32 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 5026 G 7.30 3.85 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 0.00 0.00 0.00 0.00 0.00 0.00 5027 T 8.69 4.27 4.23 0.00 0.00 0.00 0.00 0.00 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 5028 T 7.63 3.90 4.59 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 1.29 0.00 0.00 5029 P 0.00 4.38 0.00 2.23 2.17 0.00 3.66 0.00 0.00 4.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.32 0.00 5030 L 8.32 4.13 0.00 1.81 1.84 1.12 0.80 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 5031 M 8.01 4.06 0.00 2.36 2.05 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.67 2.64 0.00 5032 A 8.41 4.05 1.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5033 V 7.67 3.55 2.33 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 0.94 0.00 0.00 1.02 0.00 0.00 5034 F 8.37 3.90 0.00 3.20 3.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5035 M 8.65 4.35 0.00 2.16 2.37 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 2.83 2.66 0.00 5036 G 8.38 3.97 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 0.00 5037 L 8.00 3.94 0.00 2.01 1.87 0.86 0.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 5038 F 9.11 4.51 0.00 3.24 3.38 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 5039 L 8.65 3.69 0.00 1.79 1.90 0.86 0.95 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 5040 V 7.83 3.60 2.12 0.00 0.00 0.00 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 0.94 0.00 0.00 5041 F 8.17 4.32 0.00 3.10 3.33 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 5042 L 7.29 3.16 0.00 1.47 1.28 0.25 -0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.64 0.00 0.00 0.00 0.00 0.00 0.00 5043 L 7.59 3.58 0.00 1.70 1.79 0.90 1.12 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 5044 I 7.37 3.76 2.19 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.92 0.97 0.00 0.00 5045 I 8.02 3.76 1.79 0.00 0.00 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.72 0.87 0.00 0.00 5046 L 8.88 3.90 0.00 1.65 1.66 0.86 0.26 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 5047 E 8.42 4.26 0.00 2.16 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 2.30 2.47 0.00 5048 I 8.77 4.07 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 1.22 0.87 0.00 0.00 5049 Y 7.89 4.21 0.00 2.89 2.80 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 0.00 0.00 0.00 5050 N 8.06 4.49 0.00 2.90 2.81 0.00 0.00 7.29 7.28 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 5051 S 7.72 3.87 0.00 4.09 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 5052 T 7.70 4.42 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 5053 L 7.21 4.34 0.00 1.53 1.68 0.92 1.12 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 5054 I 7.93 4.23 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 1.42 0.54 0.91 0.00 0.00 5055 L 7.99 4.79 0.00 1.64 1.49 0.92 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 5056 D 8.65 4.41 0.00 2.66 2.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5057 G 8.97 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 5058 V 7.00 3.41 2.17 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 0.72 0.00 0.00 0.92 0.00 0.00 5059 N 8.20 4.03 0.00 2.88 2.80 0.00 0.00 6.87 7.71 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 5060 V 8.21 4.05 2.03 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 0.71 0.00 0.00 0.99 0.00 0.00 5061 S 7.53 4.78 0.00 3.59 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 5062 W 8.75 4.33 0.00 3.30 3.35 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 5063 K 7.73 4.09 0.00 1.87 1.80 0.00 1.87 0.00 0.00 1.77 0.00 0.00 3.02 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.58 1.60 7.81 5064 A 8.43 4.47 1.22 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 0.00 0.00 0.00 0.00 0.00 0.00 5065 L 8.74 4.23 0.00 1.68 1.45 0.92 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00