NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 E 4.6016 8.4293 121.7370 56.3975 30.8186 173.6440 4 C 4.7425 8.4273 120.6654 53.4959 41.4625 171.5461 5 T 4.1516 9.2366 118.1489 61.9096 69.5825 174.3518 6 P 4.4044 0.0000 0.0000 64.5855 31.7700 176.3862 7 G 4.0015 9.0567 111.7350 45.2448 0.0000 173.9713 8 Q 4.4415 7.7233 118.6206 56.2721 29.9191 175.5610 9 T 5.5867 8.4659 110.5575 60.3828 72.3123 172.6198 10 K 4.5544 8.7977 121.1654 56.0512 36.7343 173.9326 11 K 4.9395 8.3641 121.1290 54.4729 34.9638 175.2827 12 Q 4.3625 8.6384 125.5873 55.0190 30.0880 176.8309 13 D 4.2944 8.2393 126.7367 55.8389 39.7140 174.9394 14 C 4.5583 9.1049 123.3800 56.5502 42.1695 172.6420 15 N 4.9416 7.8148 119.4387 52.4557 40.1556 174.4872 16 T 4.6681 8.1172 120.1005 63.4849 70.1618 173.0521 17 C 5.5407 9.3955 123.2889 55.4979 43.4835 172.9845 18 T 5.2737 9.1778 119.2867 61.8602 71.7838 172.5856 19 C 4.5387 9.0972 127.2327 55.9466 45.2676 173.5190 20 T 4.4698 8.4778 117.4758 60.0602 69.5321 173.9024 21 P 4.1894 0.0000 0.0000 65.7632 31.2861 177.5713 22 T 4.2108 7.4848 105.1591 61.3465 68.9307 174.8982 23 G 3.7597 8.3284 110.0807 47.4133 0.0000 173.2637 24 I 4.8241 7.1778 111.2330 58.2293 41.7613 173.9044 25 W 5.0934 8.7611 122.9721 55.9786 29.9881 176.1697 26 G 4.1341 9.2767 113.8055 45.2996 0.0000 171.7534 27 C 5.8132 8.7058 122.7212 54.9635 43.6988 174.1293 28 T 4.2348 8.2929 112.4571 61.3099 69.6907 173.9156 29 R 4.6905 8.0556 118.7591 55.7050 31.1279 176.6461 30 K 4.0994 8.0932 115.8569 56.1092 32.9163 176.8161 31 A 4.3187 8.3316 124.8862 51.4333 19.1788 177.7219 32 C 4.5982 8.5854 121.3775 55.8580 41.0981 172.5400 33 R 3.7248 8.1468 127.3467 58.0952 29.5765 175.8121 34 T 3.8826 8.1523 122.8684 62.9873 67.4882 174.1338 35 T 4.2014 8.1986 124.4261 63.5969 69.1795 174.3302 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 3 E 8.43 4.60 0.00 1.98 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 2.17 2.34 0.00 4 C 8.43 4.74 0.00 2.29 2.51 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 5 T 9.24 4.15 4.38 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 1.16 0.00 0.00 6 P 0.00 4.40 0.00 1.97 2.03 0.00 3.56 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 2.12 0.00 7 G 9.06 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 7.72 4.44 0.00 2.05 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.45 6.66 0.00 0.00 0.00 0.00 0.00 2.42 2.29 0.00 9 T 8.47 5.59 4.33 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 1.29 0.00 0.00 10 K 8.80 4.55 0.00 1.57 1.69 0.00 0.67 0.00 0.00 0.61 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.30 0.71 7.81 11 K 8.36 4.94 0.00 1.66 1.61 0.00 1.60 0.00 0.00 1.72 0.00 0.00 2.84 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.33 1.58 7.81 12 Q 8.64 4.36 0.00 2.16 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.01 5.64 0.00 0.00 0.00 0.00 0.00 2.13 2.22 0.00 13 D 8.24 4.29 0.00 2.81 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 0.00 0.00 0.00 0.00 14 C 9.10 4.56 0.00 3.06 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 15 N 7.81 4.94 0.00 2.87 2.74 0.00 0.00 6.93 6.49 0.00 0.00 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 T 8.12 4.67 4.25 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 1.24 0.00 0.00 17 C 9.40 5.54 0.00 2.50 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 18 T 9.18 5.27 4.32 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 1.25 0.00 0.00 19 C 9.10 4.54 0.00 2.04 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 20 T 8.48 4.47 4.22 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 1.27 0.00 0.00 21 P 0.00 4.19 0.00 2.03 2.14 0.00 3.64 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.06 0.00 22 T 7.48 4.21 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 1.19 0.00 0.00 23 G 8.33 3.76 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 0.00 0.00 0.00 24 I 7.18 4.82 1.88 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 1.21 0.95 0.00 0.00 25 W 8.76 5.09 0.00 3.20 3.12 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 26 G 9.28 4.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 C 8.71 5.81 0.00 2.84 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 28 T 8.29 4.23 4.25 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 1.22 0.00 0.00 29 R 8.06 4.69 0.00 1.77 1.93 0.00 3.21 0.00 0.00 3.23 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.61 0.00 30 K 8.09 4.10 0.00 1.74 1.73 0.00 1.73 0.00 0.00 1.71 0.00 0.00 2.93 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.44 1.43 7.81 31 A 8.33 4.32 1.23 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 32 C 8.59 4.60 0.00 2.95 3.02 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.15 3.72 0.00 1.76 1.73 0.00 3.24 0.00 0.00 3.15 7.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.60 0.00 34 T 8.15 3.88 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 1.20 0.00 0.00 35 T 8.20 4.20 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 1.20 0.00 0.00