NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.3149 8.2649 123.5822 52.4451 19.8398 175.7269 2 V 4.0886 8.1862 109.0363 61.3644 32.7589 175.4078 3 C 5.1745 7.6016 116.1061 53.8292 38.9898 171.5304 4 P 4.5331 0.0000 0.0000 62.5151 31.6264 175.9761 5 T 4.4226 8.0421 109.8199 61.5129 68.9539 173.4073 6 G 3.8775 8.5019 105.7302 44.0728 0.0000 173.5831 7 L 4.0260 8.8500 118.9061 57.7359 42.6746 178.9503 8 F 4.7646 7.6219 115.1676 57.0884 38.2990 176.0290 9 S 5.2220 7.7808 112.5764 57.6948 64.7109 174.7036 10 N 4.8339 8.1029 120.1091 51.1747 40.0961 172.5817 11 P 4.9666 0.0000 0.0000 62.5114 31.9027 175.9651 12 L 5.1019 9.4276 124.0048 53.1943 46.5457 174.8122 13 C 5.2258 9.2724 119.3263 56.0085 38.6008 172.2319 14 C 5.5703 9.0366 121.5822 54.8499 42.7200 175.1243 15 A 3.9828 8.7313 125.3503 55.5422 18.7674 176.8141 16 T 4.6451 7.8817 107.7175 61.7522 71.2435 171.9282 17 N 5.4730 8.4521 117.6617 51.6330 40.8469 174.1537 18 V 4.1839 8.4864 119.5972 61.5534 34.8118 175.2530 19 L 3.5197 9.3704 126.7439 55.5898 39.2952 174.6109 20 D 4.5929 8.4019 113.6392 55.2188 38.5075 174.0803 21 L 4.9659 7.5440 119.6465 53.1766 44.7057 175.8705 22 I 5.0691 8.0893 119.1832 59.4870 40.9640 174.6594 23 G 4.4276 9.1577 113.2995 44.4787 0.0000 172.3272 24 V 4.7003 8.4657 122.8945 61.3856 34.5546 174.1472 25 D 4.4227 8.9030 126.9420 55.2659 39.5443 170.9029 26 C 5.4768 8.5910 118.6572 55.2508 42.0228 174.0770 27 K 5.0005 9.0244 121.3861 54.7626 36.3328 176.0594 28 T 4.4569 8.5212 119.2924 62.6679 69.2187 173.0596 29 P 4.5589 0.0000 0.0000 63.3934 31.9401 176.3659 30 T 4.5673 8.6823 109.6647 61.2111 69.0385 173.7996 31 I 4.6155 7.0954 113.4807 58.8875 40.7994 174.5238 32 A 3.9698 8.4066 124.1780 52.2224 18.6663 178.0141 33 V 4.2041 8.0113 115.9377 59.8951 31.8947 175.3220 34 D 4.5945 8.4815 125.1560 55.6662 41.7055 177.4416 35 T 4.8700 7.4933 108.5154 58.8503 73.1430 174.8089 36 G 3.7142 8.7017 108.2459 47.9083 0.0000 175.7203 37 A 4.0318 8.0569 122.7385 55.1773 18.3815 179.6952 38 I 3.7175 7.5788 117.9955 64.2876 37.1752 178.4038 39 F 4.4524 8.4311 121.5670 61.5111 39.1915 176.8975 40 Q 3.7322 8.3882 119.0604 59.1510 28.8402 178.1752 41 A 3.9822 8.2310 121.8452 55.2391 17.1801 179.0346 42 H 4.0789 8.6977 117.1455 59.8367 30.0153 176.9283 43 C 4.4304 8.3983 118.0251 59.9314 40.0809 175.9732 44 A 3.9591 8.3985 123.0546 55.0449 17.7332 179.6352 45 S 4.1235 7.9676 111.5955 60.4409 63.0132 175.7510 46 K 4.4599 7.2032 117.6630 55.6437 32.4308 176.9466 47 G 3.8787 8.2363 107.9867 45.3721 0.0000 173.3554 48 S 4.8810 7.8203 114.8986 56.7016 65.8219 173.3796 49 K 4.5808 8.9443 120.6354 54.2278 34.5570 174.4544 50 P 4.4264 0.0000 0.0000 61.8223 31.7029 174.9643 51 L 5.0112 8.9620 124.5893 52.9359 45.9908 175.2387 52 C 5.3891 9.2262 118.8442 55.9863 40.5518 172.5952 53 C 5.5999 9.2846 121.2732 55.0195 43.8748 175.1954 54 V 4.4237 8.5226 111.3655 61.4236 31.4554 176.7397 55 A 4.6772 7.6381 122.8803 49.8883 21.9299 173.6190 56 P 4.7919 0.0000 0.0000 62.5940 31.7357 175.6444 57 V 4.5007 7.3185 110.0941 59.6841 35.6942 174.9383 58 A 4.2247 8.3631 124.1874 52.7901 18.8572 176.2092 59 D 4.5122 8.2372 119.9231 53.5971 45.2395 175.8611 60 Q 4.1662 8.7470 121.4750 58.4928 30.3918 175.4941 61 A 5.1292 7.7121 119.9529 50.6950 21.9740 175.6296 62 L 4.8793 8.9708 121.9614 52.5060 46.9024 176.0793 63 L 4.7367 8.3681 121.3166 55.3418 42.2240 176.8833 64 C 5.8171 9.5739 121.1052 55.6308 45.5691 173.1646 65 Q 4.9189 9.4404 120.3377 53.8517 31.7627 174.5769 66 K 4.3681 8.4747 121.3618 56.1365 33.1353 176.6147 67 A 4.2494 8.4875 128.4394 52.5604 18.4926 177.1761 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 A 8.26 4.31 1.33 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 0.00 0.00 0.00 2 V 8.19 4.09 2.23 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 0.76 0.00 0.00 0.52 0.00 0.00 3 C 7.60 5.17 0.00 3.01 3.14 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.53 0.00 2.25 2.20 0.00 3.76 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 2.16 0.00 5 T 8.04 4.42 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 6 G 8.50 3.88 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 0.00 0.00 0.00 7 L 8.85 4.03 0.00 1.77 1.74 0.85 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 8 F 7.62 4.76 0.00 2.96 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 9 S 7.78 5.22 0.00 3.87 4.14 0.00 0.00 0.00 0.00 0.00 0.00 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 N 8.10 4.83 0.00 2.89 2.77 0.00 0.00 6.96 8.17 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 11 P 0.00 4.97 0.00 1.35 0.71 0.00 3.50 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.77 0.00 12 L 9.43 5.10 0.00 1.63 1.68 1.01 1.13 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 13 C 9.27 5.23 0.00 2.91 3.03 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 0.00 0.00 0.00 0.00 14 C 9.04 5.57 0.00 2.83 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 15 A 8.73 3.98 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.88 4.65 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 1.21 0.00 0.00 17 N 8.45 5.47 0.00 2.79 2.72 0.00 0.00 5.61 7.68 0.00 0.00 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 V 8.49 4.18 2.09 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 0.98 0.00 0.00 0.94 0.00 0.00 19 L 9.37 3.52 0.00 1.88 1.69 0.93 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 20 D 8.40 4.59 0.00 2.78 2.70 0.00 0.00 0.00 0.00 0.00 0.00 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 L 7.54 4.97 0.00 1.86 1.61 1.02 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 22 I 8.09 5.07 1.90 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 1.20 0.63 0.98 0.00 0.00 23 G 9.16 4.43 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 0.00 24 V 8.47 4.70 2.09 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 0.99 0.00 0.00 0.94 0.00 0.00 25 D 8.90 4.42 0.00 2.89 2.61 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 26 C 8.59 5.48 0.00 3.06 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 27 K 9.02 5.00 0.00 1.66 1.65 0.00 1.67 0.00 0.00 1.66 0.00 0.00 2.83 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.36 1.41 7.81 28 T 8.52 4.46 4.26 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.56 0.00 2.13 2.04 0.00 3.64 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 2.22 0.00 30 T 8.68 4.57 4.28 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 1.25 0.00 0.00 31 I 7.10 4.62 1.81 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.81 0.54 0.89 0.00 0.00 32 A 8.41 3.97 1.22 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 0.00 0.00 33 V 8.01 4.20 1.98 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 0.82 0.00 0.00 0.49 0.00 0.00 34 D 8.48 4.59 0.00 2.66 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 35 T 7.49 4.87 4.27 0.00 0.00 0.00 0.00 0.00 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 G 8.70 3.71 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 0.00 0.00 0.00 37 A 8.06 4.03 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 I 7.58 3.72 1.92 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 1.44 0.66 0.95 0.00 0.00 39 F 8.43 4.45 0.00 3.12 3.23 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 40 Q 8.39 3.73 0.00 2.06 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.58 0.00 0.00 0.00 0.00 0.00 2.31 2.28 0.00 41 A 8.23 3.98 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 H 8.70 4.08 0.00 3.38 3.62 0.00 5.79 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 43 C 8.40 4.43 0.00 2.90 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 44 A 8.40 3.96 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 S 7.97 4.12 0.00 4.05 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 46 K 7.20 4.46 0.00 1.79 1.83 0.00 1.66 0.00 0.00 1.68 0.00 0.00 2.98 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.34 1.48 7.81 47 G 8.24 3.88 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 0.00 0.00 0.00 48 S 7.82 4.88 0.00 3.85 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 49 K 8.94 4.58 0.00 1.67 1.62 0.00 1.63 0.00 0.00 1.66 0.00 0.00 2.86 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.32 1.32 7.81 50 P 0.00 4.43 0.00 0.49 0.90 0.00 3.52 0.00 0.00 3.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.62 0.00 51 L 8.96 5.01 0.00 1.66 1.75 0.95 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 52 C 9.23 5.39 0.00 2.98 3.41 0.00 0.00 0.00 0.00 0.00 0.00 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 C 9.28 5.60 0.00 2.82 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 54 V 8.52 4.42 1.80 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 -0.21 0.00 0.00 0.80 0.00 0.00 55 A 7.64 4.68 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 P 0.00 4.79 0.00 2.17 2.29 0.00 3.69 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 1.95 0.00 57 V 7.32 4.50 2.08 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 0.74 0.00 0.00 0.92 0.00 0.00 58 A 8.36 4.22 1.25 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 59 D 8.24 4.51 0.00 2.68 2.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 60 Q 8.75 4.17 0.00 2.15 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.60 0.00 0.00 0.00 0.00 0.00 2.43 2.31 0.00 61 A 7.71 5.13 1.19 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 0.00 0.00 0.00 62 L 8.97 4.88 0.00 1.57 1.50 0.93 0.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 63 L 8.37 4.74 0.00 1.45 1.59 0.89 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 64 C 9.57 5.82 0.00 2.96 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 65 Q 9.44 4.92 0.00 1.83 1.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 7.01 0.00 0.00 0.00 0.00 0.00 2.43 2.23 0.00 66 K 8.47 4.37 0.00 1.77 1.73 0.00 1.75 0.00 0.00 1.69 0.00 0.00 2.89 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.40 1.42 7.81 67 A 8.49 4.25 1.39 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 0.00 0.00