NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 F 4.6172 8.3244 122.8235 57.9490 40.4800 173.8873 2 V 3.9488 7.0307 125.5325 59.5016 33.1662 173.8678 3 N 4.5367 9.5339 127.9653 53.4679 40.6056 174.8440 4 Q 3.9373 8.6926 127.7158 59.2832 28.7288 178.2636 5 H 4.2439 8.3734 118.9850 59.0520 29.7164 177.0687 6 L 4.0183 8.2012 120.6097 57.3023 41.4874 178.4690 7 C 4.2880 8.5026 118.9894 59.6328 44.1156 175.6527 8 G 3.6394 8.3771 107.9482 47.9946 0.0000 175.5855 9 S 4.1092 7.8039 116.6110 61.6131 62.8715 176.4109 10 H 4.0969 7.8400 119.4053 58.4494 28.3549 177.5667 11 L 3.9689 8.0575 122.3874 58.0072 41.9052 179.1415 12 V 3.5620 7.8759 118.3136 65.7352 31.4214 177.9345 13 E 3.9460 8.0056 118.2701 59.3188 29.3732 178.9212 14 A 4.0341 8.0406 120.6912 55.4971 18.4451 179.7926 15 L 3.9770 8.3577 117.6550 57.8227 41.5849 178.9633 16 Y 4.1538 8.1075 119.8272 60.5599 38.4273 178.0115 17 L 3.7827 7.4606 119.5505 58.1536 42.3272 178.9494 18 V 3.7309 7.5994 116.3857 66.2244 31.9515 176.9476 19 C 4.5012 9.0027 116.4521 56.0373 41.5314 177.4162 20 G 3.5144 8.4504 107.4627 46.8553 0.0000 175.8374 21 E 4.2864 9.0942 123.7988 57.2244 29.9639 177.5355 22 R 3.9985 8.0629 118.4148 57.1838 31.1438 178.7640 23 G 3.8156 8.2050 107.9179 46.2830 0.0000 171.8584 24 F 5.0569 7.9170 116.3356 56.0953 40.4330 173.6578 25 F 4.4971 8.7386 123.5803 56.2362 39.2514 174.3045 26 Y 4.3415 8.0650 130.2882 57.5653 39.3245 175.6162 27 T 4.6190 7.5903 116.4481 58.9626 73.3070 174.2059 28 D 4.2608 8.7473 123.5022 57.7855 40.9276 179.4227 29 K 3.9057 7.9854 118.9514 59.5253 32.2066 178.5975 30 A 4.1065 8.0573 120.8763 54.8966 17.9810 179.5053 31 A 3.7604 7.9640 119.6830 55.1964 18.4180 179.8438 32 K 4.0933 8.2581 118.3692 59.3268 32.2519 179.3525 33 G 3.6099 8.1519 106.2500 47.8560 0.0000 175.5946 34 I 3.6169 7.9632 121.5324 63.5414 38.0205 178.0806 35 V 3.5789 7.4350 117.8141 65.4139 29.7362 177.9374 36 E 3.8991 8.3017 118.7450 59.4828 29.4009 179.0307 37 Q 4.1729 8.2183 119.4342 58.9010 29.0311 176.6696 38 C 4.9015 8.1260 115.7694 56.5915 40.8485 173.9801 39 C 4.5348 7.8482 117.3247 56.9946 40.3939 173.8692 40 T 4.3137 7.3292 109.2379 61.6842 70.3249 174.6047 41 S 4.7835 7.8728 115.2240 55.6625 65.7931 173.2708 42 I 3.9362 8.2167 123.2143 61.5715 37.5043 176.3347 43 C 4.7357 8.5096 122.6747 55.7322 36.5748 174.4263 44 S 4.5567 8.2982 118.7479 57.6408 65.3215 175.3069 45 L 4.1072 8.3585 120.9205 57.8451 41.0559 178.9898 46 Y 4.0277 7.5118 118.7818 60.4103 39.0252 177.2900 47 Q 4.3332 8.3570 118.9435 58.9269 28.8997 178.4432 48 L 4.2686 7.9822 119.9475 57.6930 41.6631 178.9623 49 E 4.0030 8.4959 119.3359 59.1798 29.1795 178.4289 50 N 4.1916 7.4577 115.0521 56.2048 38.6088 175.8238 51 Y 4.3903 7.9231 115.4873 57.9204 38.5156 174.9120 52 C 4.8599 7.6242 117.5665 56.8198 41.2442 173.2249 53 N 4.6040 8.8466 118.8328 53.9135 38.5844 173.9722 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 8.32 4.62 0.00 2.91 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 2 V 7.03 3.95 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 0.77 0.00 0.00 0.86 0.00 0.00 3 N 9.53 4.54 0.00 3.03 2.79 0.00 0.00 7.16 7.42 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 4 Q 8.69 3.94 0.00 2.11 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.13 6.69 0.00 0.00 0.00 0.00 0.00 2.37 2.31 0.00 5 H 8.37 4.24 0.00 3.22 3.56 0.00 5.86 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6 L 8.20 4.02 0.00 1.93 1.72 0.97 0.60 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 7 C 8.50 4.29 0.00 3.03 3.22 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 8 G 8.38 3.64 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 0.00 0.00 0.00 9 S 7.80 4.11 0.00 3.90 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 7.84 4.10 0.00 3.41 3.36 0.00 5.62 0.00 0.00 0.00 0.00 6.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 L 8.06 3.97 0.00 1.91 1.75 0.86 0.68 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 12 V 7.88 3.56 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 0.00 0.00 0.88 0.00 0.00 13 E 8.01 3.95 0.00 2.13 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 2.41 2.43 0.00 14 A 8.04 4.03 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 15 L 8.36 3.98 0.00 1.75 1.66 0.69 0.56 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 16 Y 8.11 4.15 0.00 3.08 3.17 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 0.00 0.00 0.00 0.00 17 L 7.46 3.78 0.00 1.89 1.82 0.90 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 18 V 7.60 3.73 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.90 0.00 0.00 0.97 0.00 0.00 19 C 9.00 4.50 0.00 3.12 3.31 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 0.00 20 G 8.45 3.51 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 E 9.09 4.29 0.00 1.96 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 2.31 2.32 0.00 22 R 8.06 4.00 0.00 1.99 2.20 0.00 3.31 0.00 0.00 3.23 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.59 0.00 23 G 8.21 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 24 F 7.92 5.06 0.00 3.26 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 25 F 8.74 4.50 0.00 2.96 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 8.07 4.34 0.00 3.10 2.76 0.00 0.00 0.00 0.00 0.00 0.00 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 7.59 4.62 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 1.41 0.00 0.00 28 D 8.75 4.26 0.00 2.72 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 29 K 7.99 3.91 0.00 1.82 1.80 0.00 1.73 0.00 0.00 1.84 0.00 0.00 2.99 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.52 1.52 7.81 30 A 8.06 4.11 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 31 A 7.96 3.76 1.17 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 0.00 0.00 0.00 0.00 0.00 0.00 32 K 8.26 4.09 0.00 1.84 1.89 0.00 1.64 0.00 0.00 1.74 0.00 0.00 2.95 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.43 1.45 7.81 33 G 8.15 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 I 7.96 3.62 1.21 0.00 0.00 -0.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 1.13 0.71 0.00 0.00 35 V 7.44 3.58 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 0.94 0.00 0.00 0.88 0.00 0.00 36 E 8.30 3.90 0.00 2.15 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 2.31 2.37 0.00 37 Q 8.22 4.17 0.00 2.16 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 6.73 0.00 0.00 0.00 0.00 0.00 2.39 2.43 0.00 38 C 8.13 4.90 0.00 3.08 3.07 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 39 C 7.85 4.53 0.00 3.03 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 40 T 7.33 4.31 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 1.18 0.00 0.00 41 S 7.87 4.78 0.00 3.99 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 42 I 8.22 3.94 1.87 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 1.40 0.53 0.91 0.00 0.00 43 C 8.51 4.74 0.00 2.97 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 44 S 8.30 4.56 0.00 4.10 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 45 L 8.36 4.11 0.00 1.77 1.80 0.94 0.71 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 Y 7.51 4.03 0.00 2.84 2.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 Q 8.36 4.33 0.00 2.42 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.69 0.00 0.00 0.00 0.00 0.00 2.58 2.62 0.00 48 L 7.98 4.27 0.00 1.93 1.76 0.93 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 49 E 8.50 4.00 0.00 1.94 1.76 0.00 0.00 0.00 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 2.33 0.00 50 N 7.46 4.19 0.00 2.90 2.56 0.00 0.00 6.99 7.34 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 51 Y 7.92 4.39 0.00 3.07 3.01 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 52 C 7.62 4.86 0.00 3.07 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 53 N 8.85 4.60 0.00 2.77 2.89 0.00 0.00 7.04 8.43 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