NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 27 M 4.3493 8.3044 120.3265 55.3020 33.3686 174.1643 28 D 4.6221 8.4407 119.5251 52.4058 42.2901 174.7067 29 L 4.3984 8.7347 128.1812 54.9035 42.9815 177.7676 30 A 3.9774 7.9504 121.8873 54.8647 18.3804 177.7419 31 P 4.1681 0.0000 0.0000 65.9686 31.4553 178.6256 32 Q 3.9750 8.0091 117.6520 59.4032 29.0458 177.8680 33 M 4.0754 8.3367 120.0629 58.2209 31.9398 178.4726 34 L 3.9552 8.1979 120.7140 58.2884 42.3095 179.2779 35 R 4.2001 7.8724 119.2146 58.6885 29.9425 178.9688 36 E 3.9842 8.2283 118.4650 59.3843 29.5014 179.3287 37 L 4.0174 8.0674 119.0422 57.9443 41.6147 179.6378 38 Q 4.0069 8.2839 118.0708 58.9323 28.5627 178.4555 39 E 4.0664 8.3590 120.3503 59.4146 29.5303 179.0641 40 T 3.8762 7.8947 116.0656 66.6717 68.5049 176.4888 41 N 4.3308 8.2398 118.2126 55.9844 38.4715 177.4302 42 A 3.9657 8.1104 122.1689 55.1403 18.5014 179.5678 43 A 3.9697 8.2311 119.4754 55.2849 18.3591 179.8764 44 L 3.9609 8.2314 117.7586 58.0321 41.6712 179.7692 45 Q 3.9933 8.2908 118.0957 58.9097 28.5199 178.5788 46 D 4.3381 7.8722 119.6414 57.3098 40.8737 178.8820 47 V 3.5578 7.9057 118.7847 66.0070 31.4802 178.0052 48 R 3.8819 8.2177 118.5886 59.3135 29.9875 178.0512 49 E 3.9111 8.2794 119.0554 59.3421 29.5842 178.8225 50 L 4.0002 8.1237 119.1496 57.7214 41.6919 179.2815 51 L 3.9563 8.4034 120.9983 58.1013 41.6899 179.2433 52 R 3.9428 8.2353 116.2358 59.1976 29.3766 178.6963 53 Q 3.9623 8.0092 119.9727 58.8639 28.9905 177.7257 54 Q 3.9531 8.3953 121.0412 59.2299 29.0912 178.4189 55 V 3.5515 7.9221 119.2186 65.9745 31.4826 178.1602 56 K 3.7573 7.6669 117.8750 59.3242 31.8340 179.2615 57 E 4.2189 8.1265 118.8486 59.5817 29.3622 179.4174 58 I 3.7582 8.0003 120.0009 64.6251 37.1240 178.6817 59 T 3.8053 7.9881 116.6456 66.5997 68.2644 176.7367 60 F 4.4106 7.9531 119.7446 60.5334 39.0104 177.4610 61 L 4.0243 8.2594 120.0410 57.8734 41.8736 178.9046 62 K 3.9025 8.3373 119.7433 59.7951 32.1036 178.5044 63 N 4.3865 8.2856 116.6360 56.7302 38.2006 177.5776 64 T 3.9257 7.9029 116.3527 66.6080 68.7065 176.6289 65 V 3.7672 7.8349 120.0838 66.1238 31.3112 178.0750 66 M 4.1958 7.9995 118.1632 57.3462 31.7462 177.4150 67 E 4.8054 7.5350 115.5195 55.3516 30.6318 175.7891 68 C 4.3179 7.6947 121.2458 59.0114 30.7485 173.4854 69 D 4.3383 8.8703 128.0156 57.7356 40.5072 178.5488 70 A 4.2970 7.9852 117.3649 52.8238 18.2819 176.9094 71 C 4.4333 8.2767 121.3109 60.3840 28.5734 173.8850 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 27 M 8.30 4.35 0.00 2.02 2.08 0.00 0.00 0.00 0.00 0.00 -0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.54 0.00 28 D 8.44 4.62 0.00 2.66 2.55 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.73 4.40 0.00 1.72 1.67 0.92 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 30 A 7.95 3.98 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.17 0.00 2.17 2.12 0.00 3.70 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.15 0.00 32 Q 8.01 3.97 0.00 2.11 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.90 0.00 0.00 0.00 0.00 0.00 2.42 2.45 0.00 33 M 8.34 4.08 0.00 2.09 2.23 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.78 2.55 0.00 34 L 8.20 3.96 0.00 1.85 1.80 0.92 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 35 R 7.87 4.20 0.00 2.09 1.96 0.00 3.19 0.00 0.00 3.26 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.70 0.00 36 E 8.23 3.98 0.00 2.18 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 2.52 2.49 0.00 37 L 8.07 4.02 0.00 1.85 1.72 0.92 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 38 Q 8.28 4.01 0.00 2.24 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.80 0.00 0.00 0.00 0.00 0.00 2.38 2.57 0.00 39 E 8.36 4.07 0.00 2.09 2.12 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 2.30 2.39 0.00 40 T 7.89 3.88 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 1.21 0.00 0.00 41 N 8.24 4.33 0.00 2.89 2.86 0.00 0.00 6.92 7.11 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 42 A 8.11 3.97 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 43 A 8.23 3.97 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 44 L 8.23 3.96 0.00 1.87 1.73 0.92 1.30 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 45 Q 8.29 3.99 0.00 2.26 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.81 0.00 0.00 0.00 0.00 0.00 2.38 2.69 0.00 46 D 7.87 4.34 0.00 2.88 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 47 V 7.91 3.56 2.22 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 1.00 0.00 0.00 0.98 0.00 0.00 48 R 8.22 3.88 0.00 1.99 2.06 0.00 3.15 0.00 0.00 3.09 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.63 0.00 49 E 8.28 3.91 0.00 2.15 2.12 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 2.31 2.36 0.00 50 L 8.12 4.00 0.00 1.88 1.70 0.92 0.63 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 51 L 8.40 3.96 0.00 1.90 1.66 0.92 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 52 R 8.24 3.94 0.00 2.07 2.16 0.00 2.82 0.00 0.00 3.09 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.73 0.00 53 Q 8.01 3.96 0.00 2.22 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.12 6.84 0.00 0.00 0.00 0.00 0.00 2.38 2.44 0.00 54 Q 8.40 3.95 0.00 2.25 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.57 0.00 0.00 0.00 0.00 0.00 2.36 2.38 0.00 55 V 7.92 3.55 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 0.00 0.00 0.95 0.00 0.00 56 K 7.67 3.76 0.00 2.05 1.74 0.00 1.73 0.00 0.00 1.65 0.00 0.00 2.95 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.33 1.63 7.81 57 E 8.13 4.22 0.00 2.19 2.07 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 2.63 2.55 0.00 58 I 8.00 3.76 1.98 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.80 0.91 0.00 0.00 59 T 7.99 3.81 4.09 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 0.00 0.00 0.00 1.04 0.00 0.00 60 F 7.95 4.41 0.00 3.29 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 61 L 8.26 4.02 0.00 1.91 1.92 0.95 0.22 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 62 K 8.34 3.90 0.00 1.94 1.98 0.00 1.69 0.00 0.00 1.64 0.00 0.00 2.92 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.44 1.49 7.81 63 N 8.29 4.39 0.00 3.04 2.91 0.00 0.00 7.13 6.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 T 7.90 3.93 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 1.22 0.00 0.00 65 V 7.83 3.77 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 1.04 0.00 0.00 1.05 0.00 0.00 66 M 8.00 4.20 0.00 2.05 2.27 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.89 2.55 0.00 67 E 7.53 4.81 0.00 2.08 2.03 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 2.52 2.30 0.00 68 C 7.69 4.32 0.00 3.10 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 69 D 8.87 4.34 0.00 2.68 2.77 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 70 A 7.99 4.30 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 71 C 8.28 4.43 0.00 3.01 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