NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 25 A 4.1688 8.2649 123.5809 52.6449 19.2155 176.5509 26 T 3.2974 8.1169 119.8285 63.5663 65.7866 170.5918 27 L 4.7176 8.2352 122.5996 53.7412 43.6491 175.4427 28 K 3.9517 7.9918 119.8812 55.8937 33.9717 176.6436 29 Y 4.9984 7.9477 116.0948 56.7727 42.3576 174.7525 30 I 5.3385 8.7467 119.9800 59.3518 40.5085 175.1732 31 C 4.8134 8.8224 120.8865 57.2686 32.2233 172.4654 32 A 4.6579 8.2538 121.9720 51.1696 20.7333 177.7718 33 E 3.9422 8.7944 115.9232 57.4332 27.6992 175.3072 34 C 4.6530 7.6944 113.0545 58.1191 31.1248 174.2051 35 S 3.6712 7.2165 111.3916 59.5622 60.3467 171.1902 36 S 4.7587 7.3086 114.8627 56.1780 66.5635 173.6925 37 K 4.4178 8.7291 125.5060 55.8697 32.3854 175.9339 38 L 4.7878 8.7707 125.9539 52.7808 44.5325 175.8286 39 S 4.9889 8.7442 117.6268 56.6099 64.5415 173.3367 40 L 4.6995 8.5777 127.1648 53.3477 45.3966 176.4717 41 S 4.7408 8.4361 121.1426 57.2010 65.3241 173.9740 42 R 3.9619 8.4804 116.1059 57.7984 30.2490 176.0684 43 T 3.4502 8.3769 113.6430 64.3484 65.5548 172.6486 44 D 4.4725 7.7241 112.5015 53.9523 44.9334 176.3474 45 A 3.5739 7.9573 119.8900 53.0712 17.3590 174.7625 46 V 4.2121 8.0474 113.6789 62.8594 33.8485 175.6025 47 R 4.2863 9.6075 115.0566 56.2525 29.2749 175.2261 48 C 4.6364 8.0581 117.9701 56.7605 34.4806 172.2225 49 K 3.8182 8.9463 127.2336 57.6003 31.6317 175.4116 50 D 4.4620 8.8037 127.8081 55.4082 39.7583 173.7166 51 C 4.5703 8.2598 109.5780 59.2330 32.5611 174.5073 52 G 4.1133 8.5440 106.8648 45.7661 0.0000 173.9095 53 H 4.2444 8.2351 116.4191 56.3148 29.1431 175.7269 54 R 4.6916 8.4273 119.8554 55.6064 31.3647 176.0783 55 I 4.0559 7.6037 111.8903 60.7484 38.4576 175.4208 56 L 4.7676 8.1121 121.2757 53.6483 45.8758 175.4630 57 L 4.9000 9.0295 123.8023 53.1653 44.2703 176.8998 58 K 4.2497 8.2503 119.0516 55.5013 33.2175 176.5338 59 A 3.6933 8.1635 119.3693 52.0423 17.1937 179.6238 60 R 4.4277 7.6490 117.4308 55.2055 33.7624 173.3314 61 T 4.7311 8.0994 113.9977 61.4062 71.5864 174.7250 62 K 4.0068 8.7093 124.2926 59.3660 32.2641 177.8635 63 R 4.0887 7.7918 116.2260 55.6537 29.1693 176.0088 64 L 4.4448 8.2582 123.0195 53.8882 42.9346 176.6716 65 V 4.4348 8.1417 113.8504 59.7549 33.7198 175.3180 66 Q 4.8543 8.4358 123.8044 54.4913 31.1270 174.3987 67 F 4.7689 8.4111 120.0537 55.6182 43.3038 174.0490 68 E 4.3881 8.6114 121.4939 55.5816 30.1451 176.9102 69 A 4.2579 8.6749 126.0349 52.5006 18.4819 177.3206 70 R 4.2518 7.8136 123.9164 57.6877 30.4084 176.1303 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 25 A 8.26 4.17 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 T 8.12 3.30 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 1.20 0.00 0.00 27 L 8.24 4.72 0.00 1.70 1.61 0.91 0.49 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 28 K 7.99 3.95 0.00 1.78 1.44 0.00 1.70 0.00 0.00 1.73 0.00 0.00 2.77 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.30 1.43 7.81 29 Y 7.95 5.00 0.00 2.94 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 30 I 8.75 5.34 1.91 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 1.03 0.93 0.00 0.00 31 C 8.82 4.81 0.00 3.00 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 32 A 8.25 4.66 1.21 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 0.00 0.00 0.00 33 E 8.79 3.94 0.00 2.10 2.10 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 2.22 2.29 0.00 34 C 7.69 4.65 0.00 2.85 2.91 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 0.00 0.00 0.00 35 S 7.22 3.67 0.00 3.90 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 36 S 7.31 4.76 0.00 3.86 3.66 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 0.00 0.00 0.00 0.00 37 K 8.73 4.42 0.00 1.69 1.77 0.00 1.76 0.00 0.00 1.70 0.00 0.00 2.83 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.42 1.47 7.81 38 L 8.77 4.79 0.00 1.70 1.60 1.00 0.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 39 S 8.74 4.99 0.00 3.86 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 40 L 8.58 4.70 0.00 1.61 1.61 0.91 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 41 S 8.44 4.74 0.00 4.01 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 R 8.48 3.96 0.00 1.93 2.00 0.00 3.23 0.00 0.00 3.23 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.73 0.00 43 T 8.38 3.45 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 44 D 7.72 4.47 0.00 2.71 2.59 0.00 0.00 0.00 0.00 0.00 0.00 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 A 7.96 3.57 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 V 8.05 4.21 2.04 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 0.80 0.00 0.00 0.88 0.00 0.00 47 R 9.61 4.29 0.00 1.85 2.26 0.00 3.23 0.00 0.00 3.14 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.54 0.00 48 C 8.06 4.64 0.00 2.76 2.83 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 49 K 8.95 3.82 0.00 1.74 1.79 0.00 1.87 0.00 0.00 1.64 0.00 0.00 2.85 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.44 1.54 7.81 50 D 8.80 4.46 0.00 2.79 2.66 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 0.00 0.00 0.00 0.00 51 C 8.26 4.57 0.00 3.12 2.97 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 0.00 0.00 0.00 52 G 8.54 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 0.00 0.00 0.00 53 H 8.24 4.24 0.00 3.21 3.22 0.00 5.56 0.00 0.00 0.00 0.00 6.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 R 8.43 4.69 0.00 1.75 1.89 0.00 3.19 0.00 0.00 3.26 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.71 0.00 55 I 7.60 4.06 1.87 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 1.35 0.50 0.93 0.00 0.00 56 L 8.11 4.77 0.00 1.52 1.54 0.84 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 57 L 9.03 4.90 0.00 1.67 1.63 0.93 0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 58 K 8.25 4.25 0.00 1.71 1.71 0.00 1.95 0.00 0.00 1.67 0.00 0.00 2.81 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.08 1.29 7.81 59 A 8.16 3.69 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 60 R 7.65 4.43 0.00 1.69 1.78 0.00 3.24 0.00 0.00 3.23 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.64 0.00 61 T 8.10 4.73 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 1.20 0.00 0.00 62 K 8.71 4.01 0.00 1.71 1.86 0.00 1.61 0.00 0.00 1.73 0.00 0.00 3.07 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.43 1.48 7.81 63 R 7.79 4.09 0.00 1.92 1.97 0.00 3.02 0.00 0.00 3.22 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.65 0.00 64 L 8.26 4.44 0.00 1.68 1.66 0.93 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 65 V 8.14 4.43 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 0.73 0.00 0.00 1.18 0.00 0.00 66 Q 8.44 4.85 0.00 2.02 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.81 0.00 0.00 0.00 0.00 0.00 2.31 2.39 0.00 67 F 8.41 4.77 0.00 2.91 2.92 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 68 E 8.61 4.39 0.00 2.10 1.88 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 2.32 2.30 0.00 69 A 8.67 4.26 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 70 R 7.81 4.25 0.00 1.83 1.83 0.00 3.21 0.00 0.00 3.27 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.55 0.00