NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.9812 8.3549 109.7366 45.6920 0.0000 173.3974 2 S 4.3808 8.4731 120.7622 56.7057 67.0038 172.8468 3 S 4.2323 9.0408 122.6713 60.1841 63.7670 174.4946 4 G 3.9759 7.5493 104.1402 45.2515 0.0000 172.2450 5 S 4.1333 8.8734 113.6212 59.2670 62.9152 174.7556 6 S 4.7782 8.3755 118.7172 57.0574 63.3585 174.5518 7 G 3.8539 8.1383 109.1258 47.3202 0.0000 173.4831 8 E 4.5152 8.5009 119.8302 55.7119 31.7005 175.4372 9 K 4.3157 9.2156 123.5525 56.0927 31.4470 174.4083 10 P 4.2218 0.0000 0.0000 65.6960 31.8258 176.0934 11 Y 4.7778 7.4399 117.6156 56.9358 40.3241 174.8474 12 G 4.2504 8.5947 107.3589 45.8341 0.0000 171.6545 13 C 4.9117 9.2699 121.1421 57.6609 32.9369 174.2056 14 N 4.4454 9.0800 125.4433 56.2111 39.2603 175.6062 15 E 4.0928 8.4186 117.2796 59.2297 29.6596 177.3567 16 C 4.5593 8.0766 109.9629 60.3797 31.3331 174.6691 17 G 4.6511 8.0893 108.7847 45.4208 0.0000 173.1237 18 K 4.4860 8.2209 120.3772 54.6006 35.1821 174.4146 19 D 5.0640 7.7289 121.2247 51.5706 41.8804 174.7764 20 F 4.9236 8.8359 119.6426 55.3872 43.0589 175.3961 21 S 4.9491 8.7074 116.3357 58.4091 62.7307 174.2897 22 S 4.5733 7.7105 113.2398 56.3796 66.4263 176.7947 23 K 3.1627 7.6317 124.2613 59.2641 31.6918 179.0335 24 S 3.8552 7.6301 113.2263 61.2974 62.3638 175.1835 25 Y 4.2960 7.5340 118.7290 61.5551 37.5941 178.6076 26 L 2.4400 7.2763 120.0204 57.3756 42.0136 178.6421 27 I 3.5796 7.4975 119.5537 64.8008 37.6163 178.2000 28 V 3.6691 7.9492 118.9746 66.0212 31.2795 177.6129 29 H 4.2075 7.8294 117.6511 59.5763 29.9015 177.2891 30 Q 4.0938 8.4045 120.2956 59.1108 26.9987 180.0986 31 R 3.9048 7.5800 118.2145 59.2325 29.9518 178.7698 32 I 3.6854 7.8825 111.0530 63.9363 36.7883 175.9111 33 H 4.4157 7.2579 118.3236 56.9770 29.1814 176.0339 34 T 3.8224 7.2758 115.9194 63.0701 67.9330 173.7256 35 G 3.8946 8.9078 109.1131 46.1381 0.0000 173.9754 36 E 4.4779 7.6890 120.7882 53.0873 29.0596 175.1063 37 K 4.1873 7.9489 123.6283 55.5871 33.4458 176.7619 38 L 4.0191 8.4155 122.9181 58.3396 40.8539 176.4276 39 S 3.9864 7.9732 114.9459 58.7404 61.4891 173.0708 40 G 4.1681 8.0636 115.0025 43.9372 0.0000 171.2222 41 P 4.3347 0.0000 0.0000 64.5080 31.6397 176.8211 42 S 4.7388 7.0090 114.8971 58.0519 62.6593 175.1911 43 S 4.1541 8.1447 115.3720 60.9091 62.5358 173.9785 44 G 3.7584 7.9238 111.6157 45.5432 0.0000 173.1320 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 3.98 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 0.00 0.00 0.00 2 S 8.47 4.38 0.00 3.91 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 3 S 9.04 4.23 0.00 3.86 3.96 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 4 G 7.55 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 0.00 0.00 0.00 5 S 8.87 4.13 0.00 3.99 3.93 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 6 S 8.38 4.78 0.00 3.96 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 7 G 8.14 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8 E 8.50 4.52 0.00 2.05 1.91 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 2.18 2.30 0.00 9 K 9.22 4.32 0.00 2.10 2.10 0.00 1.67 0.00 0.00 1.82 0.00 0.00 2.94 0.00 0.00 3.18 0.00 0.00 0.00 0.00 1.43 1.38 7.81 10 P 0.00 4.22 0.00 1.67 2.06 0.00 3.93 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 1.70 1.94 0.00 11 Y 7.44 4.78 0.00 3.28 2.99 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 0.00 0.00 0.00 12 G 8.59 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 0.00 0.00 0.00 0.00 13 C 9.27 4.91 0.00 3.32 3.08 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 0.00 0.00 0.00 0.00 14 N 9.08 4.45 0.00 2.76 2.85 0.00 0.00 7.24 7.66 0.00 0.00 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 E 8.42 4.09 0.00 1.88 1.64 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 2.23 2.31 0.00 16 C 8.08 4.56 0.00 3.14 3.20 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.09 4.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.22 4.49 0.00 1.75 1.60 0.00 1.48 0.00 0.00 1.58 0.00 0.00 2.82 0.00 0.00 2.78 0.00 0.00 0.00 0.00 0.30 0.98 7.81 19 D 7.73 5.06 0.00 2.58 2.52 0.00 0.00 0.00 0.00 0.00 0.00 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 F 8.84 4.92 0.00 3.25 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 21 S 8.71 4.95 0.00 4.01 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 22 S 7.71 4.57 0.00 3.96 3.50 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 23 K 7.63 3.16 0.00 0.79 1.36 0.00 1.41 0.00 0.00 1.58 0.00 0.00 3.08 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.32 1.31 7.81 24 S 7.63 3.86 0.00 3.66 3.39 0.00 0.00 0.00 0.00 0.00 0.00 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 Y 7.53 4.30 0.00 3.06 3.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 L 7.28 2.44 0.00 1.48 1.55 0.98 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 27 I 7.50 3.58 1.85 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.70 0.85 0.00 0.00 28 V 7.95 3.67 2.19 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 1.09 0.00 0.00 0.90 0.00 0.00 29 H 7.83 4.21 0.00 3.26 3.11 0.00 5.88 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 30 Q 8.40 4.09 0.00 2.23 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.53 6.61 0.00 0.00 0.00 0.00 0.00 2.61 2.47 0.00 31 R 7.58 3.90 0.00 2.01 1.95 0.00 3.12 0.00 0.00 3.25 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.84 0.00 32 I 7.88 3.69 1.77 0.00 0.00 0.67 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 0.08 0.84 0.00 0.00 33 H 7.26 4.42 0.00 3.45 3.26 0.00 5.69 0.00 0.00 0.00 0.00 7.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 T 7.28 3.82 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 1.29 0.00 0.00 35 G 8.91 3.89 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 0.00 0.00 0.00 36 E 7.69 4.48 0.00 1.91 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 2.25 0.00 37 K 7.95 4.19 0.00 1.75 1.70 0.00 1.82 0.00 0.00 1.76 0.00 0.00 3.03 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.42 1.43 7.81 38 L 8.42 4.02 0.00 1.78 1.78 0.92 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 39 S 7.97 3.99 0.00 3.85 3.89 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 40 G 8.06 4.17 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 0.00 41 P 0.00 4.33 0.00 2.19 2.19 0.00 3.73 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.95 0.00 42 S 7.01 4.74 0.00 4.01 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 S 8.14 4.15 0.00 3.87 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 44 G 7.92 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