NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 F 4.5145 8.3093 122.8221 57.6746 40.4432 174.8399 2 V 3.3949 6.6967 125.0148 60.8186 30.9693 175.3528 3 N 4.8370 9.1313 130.8888 52.6587 38.6407 174.3653 4 Q 4.4016 7.2656 114.5541 56.2868 32.0017 175.7365 5 H 4.9407 8.0975 116.3616 55.3888 33.6647 174.1041 6 L 4.5307 7.9735 120.6708 54.5801 43.2025 173.4585 7 C 5.0075 8.0514 119.3787 58.3218 32.5496 176.4007 8 G 4.0725 8.3217 110.0657 47.1504 0.0000 177.6211 9 S 3.9200 8.5419 119.0243 60.7310 63.1097 175.6062 10 H 4.3633 8.0387 119.5750 58.3883 28.1710 177.1750 11 L 3.9778 7.2475 121.6927 58.0182 41.7083 178.7928 12 V 3.3816 7.3930 117.8253 65.5729 31.3896 177.4803 13 E 3.8971 8.5668 119.4277 59.1639 29.3652 178.7114 14 A 4.0557 7.9975 120.8765 54.9173 17.9705 179.4291 15 L 3.7336 7.3358 116.0073 57.2071 40.9644 178.6004 16 Y 4.2824 7.4112 119.7306 59.4668 38.4901 176.9297 17 L 4.0338 7.5943 120.2762 57.6360 42.7011 178.0573 18 V 3.6710 7.6729 116.9001 66.9757 31.5301 177.2114 19 C 4.2586 7.6235 114.4921 58.5731 28.1597 176.0596 20 G 3.5281 8.2925 110.3335 46.2060 0.0000 173.9103 21 E 4.3103 8.7656 118.9961 56.7402 30.6347 177.4521 22 R 4.2748 7.9442 118.4466 55.7768 32.0360 177.4018 23 G 4.1181 9.0806 101.1536 45.1965 0.0000 171.9527 24 F 4.9371 7.6332 112.2276 54.7487 40.8411 173.7405 25 F 4.9065 8.1532 117.3706 55.2596 39.4835 174.5723 26 Y 4.6291 8.8309 124.9250 55.9558 40.0315 174.6229 27 T 4.4431 8.2594 117.8336 59.3988 70.2383 171.9900 28 P 4.3115 0.0000 0.0000 62.7397 32.3316 176.5390 29 K 3.6831 8.5079 121.0685 56.9899 31.7950 181.9714 30 T 4.0903 7.6071 117.6989 60.2205 67.8571 172.3793 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 F 8.31 4.51 0.00 2.96 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 2 V 6.70 3.39 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 -0.01 0.00 0.00 0.78 0.00 0.00 3 N 9.13 4.84 0.00 2.73 2.80 0.00 0.00 7.00 7.08 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 4 Q 7.27 4.40 0.00 2.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.37 6.51 0.00 0.00 0.00 0.00 0.00 2.24 2.32 0.00 5 H 8.10 4.94 0.00 3.09 3.12 0.00 5.74 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 6 L 7.97 4.53 0.00 1.59 1.56 0.91 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 7 C 8.05 5.01 0.00 2.98 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 8 G 8.32 4.07 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 0.00 0.00 0.00 9 S 8.54 3.92 0.00 3.94 4.04 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 10 H 8.04 4.36 0.00 3.29 3.37 0.00 5.62 0.00 0.00 0.00 0.00 6.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 L 7.25 3.98 0.00 1.60 1.87 1.07 1.19 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 12 V 7.39 3.38 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 0.97 0.00 0.00 0.26 0.00 0.00 13 E 8.57 3.90 0.00 2.08 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 0.00 2.30 2.27 0.00 14 A 8.00 4.06 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 15 L 7.34 3.73 0.00 0.75 0.55 0.84 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 16 Y 7.41 4.28 0.00 3.04 3.11 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 17 L 7.59 4.03 0.00 1.74 1.84 0.97 0.99 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 18 V 7.67 3.67 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 0.73 0.00 0.00 0.83 0.00 0.00 19 C 7.62 4.26 0.00 3.14 2.96 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 20 G 8.29 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 21 E 8.77 4.31 0.00 1.94 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 2.28 2.28 0.00 22 R 7.94 4.27 0.00 1.76 1.97 0.00 3.16 0.00 0.00 3.24 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.52 0.00 23 G 9.08 4.12 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 F 7.63 4.94 0.00 2.98 2.91 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 25 F 8.15 4.91 0.00 3.16 3.10 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 0.00 0.00 0.00 26 Y 8.83 4.63 0.00 3.15 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 27 T 8.26 4.44 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 1.34 0.00 0.00 28 P 0.00 4.31 0.00 2.15 2.01 0.00 3.75 0.00 0.00 2.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 1.97 0.00 29 K 8.51 3.68 0.00 1.79 1.69 0.00 1.82 0.00 0.00 1.63 0.00 0.00 2.91 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.37 1.02 7.81 30 T 7.61 4.09 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 1.21 0.00 0.00