NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 H 4.8273 8.3027 116.4671 54.8702 30.7492 172.0099 2 E 4.0815 8.8193 119.9469 55.8159 29.8624 174.2474 3 C 4.5089 9.4452 127.9030 58.7304 33.0121 172.6834 4 Q 4.6711 8.4857 125.3817 55.6297 29.6861 175.4255 5 C 4.3961 8.2233 115.1007 60.4894 28.5495 173.6976 6 Q 4.5800 8.3053 119.9275 55.5184 29.5876 175.9263 7 C 4.4990 7.7031 113.2897 57.7614 29.9885 175.1256 8 G 3.6226 8.7009 109.5034 48.8321 0.0000 176.3313 9 S 4.2228 8.8620 116.0625 60.8179 63.1864 174.9882 10 C 4.4986 7.4739 113.6413 60.0866 29.4264 173.9579 11 K 4.2454 7.9470 121.5143 57.6319 31.9910 175.6489 12 N 4.1065 8.8343 121.8079 53.9968 36.4079 173.6732 13 N 4.6141 8.0543 117.5709 52.4247 38.0939 175.6031 14 E 3.9983 8.6930 126.8508 59.1475 29.9090 179.5359 15 Q 4.0496 8.5134 119.8721 58.1883 29.2043 176.3248 16 C 4.9627 7.6917 110.0061 56.8054 30.3247 175.5582 17 Q 4.0358 7.9094 120.6678 58.7351 28.3459 177.7714 18 K 4.9416 7.7428 115.7968 55.5857 33.3162 177.1332 19 S 4.5176 7.8189 111.9832 57.8570 63.3576 173.0630 20 C 4.3031 7.9293 122.0577 59.8306 31.8658 173.1297 21 S 4.6605 8.3834 119.7687 58.1362 63.1865 174.0238 22 C 4.4157 7.6898 118.6293 58.7810 28.6072 171.6770 23 P 4.4206 0.0000 0.0000 62.6818 31.5057 176.2692 24 T 3.8480 8.1839 114.4473 63.5220 67.7565 173.8856 25 G 3.7735 8.7036 114.0422 46.6624 0.0000 173.9449 26 C 4.3352 7.8975 121.3861 58.4736 30.0758 172.9464 27 N 5.1492 8.4814 120.7554 52.5696 39.5077 174.9705 28 S 4.6792 7.6260 114.8138 56.4983 66.8948 174.6191 29 D 4.4112 8.9309 125.1197 57.3910 40.8390 178.5418 30 D 4.4348 8.1441 117.3721 55.4517 39.4310 177.0692 31 K 4.5039 7.6839 117.4548 55.9176 32.7840 174.9263 32 C 4.3822 7.7873 120.3711 58.1247 32.0452 171.5031 33 P 4.6328 0.0000 0.0000 62.4994 31.5371 174.8144 34 C 4.2777 7.8747 120.3282 61.0508 31.6626 173.5065 35 G 3.9248 8.9396 114.2805 45.9218 0.0000 172.9937 36 N 4.5031 8.0982 122.3634 53.3799 38.4455 174.9024 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 H 8.30 4.83 0.00 3.27 3.53 0.00 5.63 0.00 0.00 0.00 0.00 6.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2 E 8.82 4.08 0.00 2.05 1.94 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 2.32 2.37 0.00 3 C 9.45 4.51 0.00 3.15 2.98 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 4 Q 8.49 4.67 0.00 2.04 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.56 6.75 0.00 0.00 0.00 0.00 0.00 2.25 2.35 0.00 5 C 8.22 4.40 0.00 2.96 2.95 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 6 Q 8.31 4.58 0.00 2.10 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.93 0.00 0.00 0.00 0.00 0.00 2.28 2.32 0.00 7 C 7.70 4.50 0.00 3.34 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 8 G 8.70 3.62 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 0.00 0.00 0.00 9 S 8.86 4.22 0.00 3.87 3.94 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 10 C 7.47 4.50 0.00 3.02 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 11 K 7.95 4.25 0.00 1.78 1.82 0.00 1.95 0.00 0.00 1.70 0.00 0.00 3.02 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.45 1.41 7.81 12 N 8.83 4.11 0.00 2.87 2.85 0.00 0.00 7.03 8.00 0.00 0.00 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 N 8.05 4.61 0.00 2.85 2.82 0.00 0.00 7.25 7.10 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 14 E 8.69 4.00 0.00 2.03 1.99 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 2.40 2.24 0.00 15 Q 8.51 4.05 0.00 2.06 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.96 0.00 0.00 0.00 0.00 0.00 2.37 2.34 0.00 16 C 7.69 4.96 0.00 3.03 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 17 Q 7.91 4.04 0.00 2.14 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.92 0.00 0.00 0.00 0.00 0.00 2.52 2.48 0.00 18 K 7.74 4.94 0.00 1.68 1.75 0.00 1.77 0.00 0.00 1.76 0.00 0.00 3.03 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.32 1.38 7.81 19 S 7.82 4.52 0.00 3.91 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 20 C 7.93 4.30 0.00 3.13 2.84 0.00 0.00 0.00 0.00 0.00 0.00 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 S 8.38 4.66 0.00 4.00 3.90 0.00 0.00 0.00 0.00 0.00 0.00 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 C 7.69 4.42 0.00 3.02 2.93 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 23 P 0.00 4.42 0.00 2.18 2.06 0.00 3.79 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.96 0.00 24 T 8.18 3.85 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 1.20 0.00 0.00 25 G 8.70 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 C 7.90 4.34 0.00 3.14 2.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27 N 8.48 5.15 0.00 2.72 2.79 0.00 0.00 6.94 7.57 0.00 0.00 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 S 7.63 4.68 0.00 3.82 3.84 0.00 0.00 0.00 0.00 0.00 0.00 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 D 8.93 4.41 0.00 2.74 2.73 0.00 0.00 0.00 0.00 0.00 0.00 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 D 8.14 4.43 0.00 2.78 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 31 K 7.68 4.50 0.00 1.67 1.81 0.00 1.71 0.00 0.00 1.63 0.00 0.00 2.93 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.35 1.47 7.81 32 C 7.79 4.38 0.00 3.11 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 33 P 0.00 4.63 0.00 2.25 2.25 0.00 3.76 0.00 0.00 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 1.94 0.00 34 C 7.87 4.28 0.00 2.95 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 35 G 8.94 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 N 8.10 4.50 0.00 2.83 2.75 0.00 0.00 6.73 6.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00