NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.8566 8.3549 109.7373 44.7280 0.0000 173.3661 2 I 4.1770 7.5070 122.0214 59.3423 38.1273 174.3369 3 G 4.5021 8.3513 113.3432 43.6541 0.0000 170.3927 4 D 4.8621 7.7428 118.2297 50.0298 43.5937 174.0808 5 P 4.2376 0.0000 0.0000 65.6067 31.3532 179.2777 6 V 3.5578 7.7820 116.6130 66.3997 31.3594 178.0135 7 T 3.8622 8.1966 114.2479 66.6374 68.6561 175.4615 8 C 4.3980 8.1814 120.2955 59.8545 38.6571 175.7174 9 L 4.1984 8.0461 121.9843 57.2786 40.9697 179.6635 10 K 4.0401 8.2919 118.1780 59.0980 32.0394 178.5295 11 S 4.5204 7.7159 111.7573 58.1816 63.2782 174.7715 12 G 3.7409 7.8726 109.9354 46.1969 0.0000 173.2247 13 A 4.8050 7.3013 121.8056 50.1646 22.1909 176.2032 14 I 4.6011 8.5312 118.4250 59.5253 41.0891 173.7421 15 C 5.0630 8.7447 126.2041 56.6791 38.1815 172.4752 16 H 5.0282 9.1092 122.9379 53.3554 33.3871 170.4852 17 P 4.4039 0.0000 0.0000 63.9251 31.4208 176.1570 18 V 3.8878 8.7548 129.1601 63.4595 31.9855 171.8891 19 F 5.0339 7.1026 110.3424 55.1148 40.7393 174.2412 20 C 4.2677 8.6794 119.8552 55.7093 40.6514 172.3342 21 P 4.7157 0.0000 0.0000 61.7430 31.8672 175.7898 22 R 4.2811 8.3134 115.7967 58.2170 29.6200 175.7545 23 R 4.3508 9.0367 118.5405 56.4353 28.2811 176.1632 24 Y 4.4892 7.8766 114.3857 57.3428 38.9164 174.7275 25 K 4.6350 8.6453 123.3124 54.8373 34.5334 175.5639 26 Q 4.7238 8.7435 126.2904 56.0997 29.2993 175.3186 27 I 4.3998 9.1159 118.9997 60.0835 39.0826 176.1960 28 G 3.9112 6.8381 109.3050 46.4800 0.0000 171.1995 29 T 5.1611 7.5993 108.8853 59.4276 71.5003 173.2592 30 C 4.7009 8.2729 115.3906 56.8221 40.5420 175.6536 31 G 4.2316 8.3732 113.6243 45.4052 0.0000 174.8827 32 L 4.0691 7.4994 120.2898 53.3371 42.3324 175.3151 33 P 4.4225 0.0000 0.0000 64.0986 31.9164 176.9799 34 G 4.0873 8.9678 110.6312 45.6472 0.0000 173.4684 35 T 4.5108 7.5151 109.9353 61.5044 70.3273 173.9463 36 K 4.8365 9.1414 123.0727 54.7881 36.0206 174.2073 37 C 5.0029 8.8765 124.6908 55.7729 45.8995 171.5813 38 C 5.5152 9.2222 123.6859 55.0865 44.7011 172.7513 39 K 4.8038 8.9650 125.7437 54.2868 33.8609 176.2136 40 K 3.2414 8.4930 127.3901 56.3910 32.0826 176.2045 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 3.86 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 0.00 0.00 0.00 2 I 7.51 4.18 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 1.35 0.77 0.92 0.00 0.00 3 G 8.35 4.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 D 7.74 4.86 0.00 2.82 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 5 P 0.00 4.24 0.00 2.17 2.12 0.00 3.59 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.32 0.00 6 V 7.78 3.56 2.18 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 1.15 0.00 0.00 0.93 0.00 0.00 7 T 8.20 3.86 4.30 0.00 0.00 0.00 0.00 0.00 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 8 C 8.18 4.40 0.00 3.07 3.25 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 9 L 8.05 4.20 0.00 1.72 1.70 0.92 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 10 K 8.29 4.04 0.00 1.84 1.88 0.00 1.71 0.00 0.00 1.76 0.00 0.00 3.07 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.64 1.56 7.81 11 S 7.72 4.52 0.00 4.07 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 12 G 7.87 3.74 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 0.00 0.00 0.00 13 A 7.30 4.81 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 14 I 8.53 4.60 1.95 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 1.20 1.54 0.81 0.00 0.00 15 C 8.74 5.06 0.00 2.86 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 16 H 9.11 5.03 0.00 2.88 2.83 0.00 5.58 0.00 0.00 0.00 0.00 6.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 P 0.00 4.40 0.00 2.01 1.93 0.00 3.31 0.00 0.00 3.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.74 0.00 18 V 8.75 3.89 2.38 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 0.93 0.00 0.00 1.00 0.00 0.00 19 F 7.10 5.03 0.00 3.13 2.94 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 20 C 8.68 4.27 0.00 3.04 3.09 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 0.00 0.00 0.00 0.00 21 P 0.00 4.72 0.00 2.12 1.96 0.00 3.08 0.00 0.00 3.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 1.33 0.00 22 R 8.31 4.28 0.00 2.00 2.06 0.00 3.06 0.00 0.00 3.26 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.75 0.00 23 R 9.04 4.35 0.00 1.92 2.34 0.00 3.16 0.00 0.00 3.20 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.64 0.00 24 Y 7.88 4.49 0.00 3.03 2.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 K 8.65 4.64 0.00 1.69 1.73 0.00 1.69 0.00 0.00 1.60 0.00 0.00 2.78 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.40 1.52 7.81 26 Q 8.74 4.72 0.00 2.10 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.49 6.80 0.00 0.00 0.00 0.00 0.00 2.36 2.48 0.00 27 I 9.12 4.40 1.88 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 1.31 0.87 0.98 0.00 0.00 28 G 6.84 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 29 T 7.60 5.16 4.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 30 C 8.27 4.70 0.00 3.00 3.09 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 0.00 0.00 0.00 0.00 31 G 8.37 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 0.00 0.00 0.00 0.00 32 L 7.50 4.07 0.00 1.75 1.60 0.96 1.02 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 33 P 0.00 4.42 0.00 2.04 1.99 0.00 3.70 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.09 0.00 34 G 8.97 4.09 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 T 7.52 4.51 4.21 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 1.22 0.00 0.00 36 K 9.14 4.84 0.00 1.60 1.69 0.00 1.66 0.00 0.00 1.78 0.00 0.00 2.78 0.00 0.00 3.31 0.00 0.00 0.00 0.00 1.35 1.35 7.81 37 C 8.88 5.00 0.00 3.15 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 38 C 9.22 5.52 0.00 2.89 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 39 K 8.96 4.80 0.00 1.90 1.69 0.00 1.52 0.00 0.00 1.59 0.00 0.00 2.90 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.34 1.38 7.81 40 K 8.49 3.24 0.00 0.99 1.38 0.00 1.18 0.00 0.00 0.78 0.00 0.00 2.96 0.00 0.00 2.59 0.00 0.00 0.00 0.00 0.95 1.20 7.81