NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 19 E 4.3949 8.4293 121.4862 55.8986 31.6330 176.1998 20 I 4.4185 7.7339 107.5585 59.7682 40.8002 173.0009 21 D 5.1280 7.8348 118.3760 52.3325 45.1532 175.5526 22 Y 4.5220 8.5912 120.8867 58.5526 39.0931 177.2642 23 K 3.7014 6.7133 118.1906 58.9003 33.2515 176.5291 24 D 4.6055 8.5201 122.7567 52.8542 40.1904 176.8476 25 I 3.6547 7.6144 116.4721 64.4691 37.4962 177.5875 26 A 3.9741 7.9693 120.9724 55.0224 18.3921 179.1524 27 T 4.1389 8.0889 114.1111 66.4464 68.8683 177.3577 28 L 4.1570 7.8497 120.2736 57.7339 41.4093 179.4429 29 K 3.9180 7.8962 117.7273 59.5534 31.9779 178.6574 30 N 4.4102 7.7977 115.8106 55.1143 38.8629 175.5750 31 Y 5.0416 7.8630 118.8755 56.4386 39.5193 175.2581 32 I 4.9180 7.1475 119.1868 59.9127 41.3552 176.1136 33 T 4.2294 8.5829 115.4350 61.4350 69.6434 174.4106 34 E 3.8848 8.5689 119.3377 58.9709 29.9799 178.4328 35 S 5.2453 7.9254 115.2941 59.6062 63.1791 175.2945 36 G 3.9947 7.4371 109.4285 45.7367 0.0000 174.9228 37 K 4.1812 8.0422 119.4602 56.1008 33.3867 176.2135 38 I 4.2615 8.1021 115.3114 61.2128 38.1551 176.0741 39 V 3.9382 8.0128 118.0731 60.5901 31.9880 174.4659 40 P 4.4787 0.0000 0.0000 63.0018 32.2168 177.4898 41 S 4.4949 8.9388 117.3863 60.6424 63.0183 176.7457 42 R 3.9063 7.8729 118.6326 59.0453 29.3303 178.6351 43 I 3.8756 7.6129 119.3717 64.4617 37.4032 178.0963 44 T 4.0779 7.3335 108.0511 63.1390 68.6577 174.7315 45 G 4.0630 8.6226 109.3749 45.2576 0.0000 173.6793 46 T 3.8946 7.6662 112.2868 62.3503 67.8372 173.9768 47 R 4.0884 8.6386 125.3330 55.9418 32.0350 178.0791 48 A 3.8692 8.2594 122.0669 55.3680 18.1336 179.6998 49 K 3.6362 7.9189 117.6299 60.2578 31.9288 178.2012 50 Y 4.3714 7.4386 116.0433 60.9616 37.7452 177.5528 51 Q 3.8568 8.1444 120.6254 59.3243 29.1834 178.7831 52 R 3.9171 8.0740 118.8545 59.5008 29.7384 178.8631 53 Q 4.0051 7.7821 118.5815 58.9223 28.8575 178.2944 54 L 3.9173 8.1060 121.4231 57.9580 42.1953 178.3744 55 A 3.9592 8.2173 121.2195 55.5424 18.2397 179.7887 56 R 3.7601 7.8052 115.4397 59.2724 30.1153 179.1979 57 A 3.9614 7.6526 119.8401 55.1955 18.4427 179.7153 58 I 3.6119 8.0478 118.6412 64.4211 37.0693 178.5945 59 K 3.6100 8.2440 119.8278 59.5546 31.6684 179.6745 60 R 3.3740 7.6009 115.5285 58.6684 29.2012 178.6735 61 A 4.1341 7.7371 122.0660 55.2161 18.3660 179.7983 62 R 4.1838 7.8811 117.9609 59.0999 29.8364 178.9072 63 Y 4.5113 7.8397 115.6328 60.2895 37.7988 177.2041 64 L 4.6344 7.4538 118.2891 53.5952 42.1829 176.0892 65 S 3.9174 7.8322 111.2897 59.3932 61.2834 172.9612 66 L 4.4803 8.0430 117.0121 54.8742 41.7521 176.5284 67 L 4.6613 7.3274 117.7175 52.6773 45.7082 173.0930 68 P 4.6765 0.0000 0.0000 62.6462 32.6909 175.9154 69 Y 4.2774 8.8015 117.1400 60.2114 38.9863 175.2495 70 T 4.8896 7.3780 108.8507 60.2820 70.6715 173.0089 71 D 4.5734 8.8488 117.1754 57.2958 41.8137 178.7099 72 R 3.8832 8.0374 116.5101 59.0479 30.2917 176.2946 73 H 4.3934 7.7324 116.8792 56.2905 30.0316 173.4308 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 19 E 8.43 4.39 0.00 2.13 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 0.00 2.06 2.20 0.00 20 I 7.73 4.42 1.88 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.90 0.88 0.00 0.00 21 D 7.83 5.13 0.00 2.60 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 22 Y 8.59 4.52 0.00 3.15 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 23 K 6.71 3.70 0.00 1.62 1.39 0.00 1.31 0.00 0.00 1.50 0.00 0.00 2.96 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.11 1.70 7.81 24 D 8.52 4.61 0.00 2.70 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 25 I 7.61 3.65 1.86 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.60 0.95 0.00 0.00 26 A 7.97 3.97 1.28 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 0.00 0.00 0.00 27 T 8.09 4.14 4.37 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 1.21 0.00 0.00 28 L 7.85 4.16 0.00 1.71 1.78 1.01 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 29 K 7.90 3.92 0.00 1.75 1.84 0.00 1.68 0.00 0.00 1.69 0.00 0.00 3.00 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.47 1.59 7.81 30 N 7.80 4.41 0.00 2.07 2.54 0.00 0.00 6.95 7.48 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 31 Y 7.86 5.04 0.00 3.12 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 32 I 7.15 4.92 1.89 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 1.50 0.62 1.00 0.00 0.00 33 T 8.58 4.23 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 1.29 0.00 0.00 34 E 8.57 3.88 0.00 1.97 2.05 0.00 0.00 0.00 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 2.39 0.00 35 S 7.93 5.25 0.00 3.87 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 36 G 7.44 3.99 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 0.00 0.00 0.00 37 K 8.04 4.18 0.00 1.97 1.98 0.00 1.53 0.00 0.00 1.89 0.00 0.00 3.12 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.51 1.45 7.81 38 I 8.10 4.26 1.89 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 1.35 0.86 0.91 0.00 0.00 39 V 8.01 3.94 2.14 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 0.71 0.00 0.00 1.09 0.00 0.00 40 P 0.00 4.48 0.00 2.08 2.00 0.00 3.61 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.11 0.00 41 S 8.94 4.49 0.00 4.02 4.20 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 42 R 7.87 3.91 0.00 1.99 2.11 0.00 3.04 0.00 0.00 3.23 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.72 0.00 43 I 7.61 3.88 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 1.71 0.55 0.94 0.00 0.00 44 T 7.33 4.08 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 1.40 0.00 0.00 45 G 8.62 4.06 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 0.00 0.00 0.00 46 T 7.67 3.89 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 1.07 0.00 0.00 47 R 8.64 4.09 0.00 1.59 1.56 0.00 3.14 0.00 0.00 3.06 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.76 0.00 48 A 8.26 3.87 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 49 K 7.92 3.64 0.00 1.62 1.38 0.00 1.50 0.00 0.00 1.42 0.00 0.00 2.92 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.40 1.47 7.81 50 Y 7.44 4.37 0.00 3.16 2.79 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 8.14 3.86 0.00 2.19 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.80 0.00 0.00 0.00 0.00 0.00 2.32 2.42 0.00 52 R 8.07 3.92 0.00 2.01 1.95 0.00 3.16 0.00 0.00 3.07 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.76 0.00 53 Q 7.78 4.01 0.00 2.18 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.83 0.00 0.00 0.00 0.00 0.00 2.38 2.40 0.00 54 L 8.11 3.92 0.00 1.75 1.83 1.09 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 55 A 8.22 3.96 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 7.81 3.76 0.00 1.99 1.92 0.00 3.10 0.00 0.00 3.14 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.61 0.00 57 A 7.65 3.96 1.48 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 0.00 0.00 58 I 8.05 3.61 1.97 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.08 0.88 0.00 0.00 59 K 8.24 3.61 0.00 1.61 1.40 0.00 1.58 0.00 0.00 1.62 0.00 0.00 2.99 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.35 1.56 7.81 60 R 7.60 3.37 0.00 1.68 1.84 0.00 2.21 0.00 0.00 2.25 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.57 0.00 61 A 7.74 4.13 1.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 7.88 4.18 0.00 1.75 1.47 0.00 3.00 0.00 0.00 2.81 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.68 0.00 63 Y 7.84 4.51 0.00 2.99 3.04 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 0.00 0.00 0.00 0.00 64 L 7.45 4.63 0.00 1.84 1.78 1.08 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 65 S 7.83 3.92 0.00 4.05 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 66 L 8.04 4.48 0.00 1.91 1.73 1.02 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 67 L 7.33 4.66 0.00 1.65 1.49 0.93 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 68 P 0.00 4.68 0.00 2.46 2.09 0.00 3.77 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.00 0.00 69 Y 8.80 4.28 0.00 3.12 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 70 T 7.38 4.89 4.29 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 1.30 0.00 0.00 71 D 8.85 4.57 0.00 2.74 2.74 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 72 R 8.04 3.88 0.00 1.84 2.02 0.00 3.24 0.00 0.00 3.24 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.68 0.00 73 H 7.73 4.39 0.00 3.20 3.11 0.00 5.69 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00