NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.4333 8.1233 122.4793 51.8201 20.8955 175.0777 2 K 5.1603 8.3579 117.6065 54.0733 35.7470 173.8454 3 W 5.3650 9.4785 123.6872 54.8734 33.6708 174.2737 4 V 4.9021 9.0117 123.8208 60.0694 33.8911 174.5425 5 C 3.4413 9.0962 124.9169 58.4375 31.5108 174.2879 6 K 3.9350 8.7282 127.5939 59.4782 31.7306 179.2354 7 I 3.8940 7.8683 120.4448 63.8272 37.2522 176.4788 8 C 4.6155 8.1899 110.5954 57.4515 30.8008 174.6585 9 G 3.9628 8.3631 109.3030 44.9616 0.0000 173.2270 10 Y 4.3056 7.9016 121.3658 58.0330 40.1672 174.6584 11 I 4.8858 7.5354 126.1659 59.6383 39.3619 174.3790 12 Y 4.3710 9.5782 130.1302 56.9719 40.1731 173.4652 13 D 4.7625 7.9466 126.9953 52.4017 42.6558 176.4643 14 E 3.9650 8.8622 126.8928 59.5411 29.9956 179.5619 15 D 4.4685 8.2816 118.2101 56.3828 41.1241 177.1546 16 A 4.2576 7.7638 121.0580 51.5741 20.2344 179.0406 17 G 3.9321 7.9478 103.7876 45.9782 0.0000 174.3318 18 D 4.9768 8.6004 111.2901 52.5352 42.8590 174.5458 19 P 4.3576 0.0000 0.0000 65.7949 31.9835 178.8176 20 D 4.5225 8.2208 115.5356 56.3784 40.8366 176.5616 21 N 4.9174 8.1872 115.5951 52.9437 39.2889 174.8914 22 G 3.8372 8.4959 104.9797 45.8378 0.0000 174.0436 23 I 4.3591 7.9494 121.3591 58.8430 37.9974 175.6485 24 S 4.5643 8.3625 120.5407 56.8890 63.8670 172.0661 25 P 4.2973 0.0000 0.0000 64.6724 31.4200 176.8990 26 G 3.9764 9.1539 111.1437 45.3455 0.0000 173.5320 27 T 4.1794 7.1972 116.4450 62.5729 69.1542 175.0354 28 K 4.4346 8.8659 126.4602 55.8764 33.1743 177.8676 29 F 3.1805 9.2508 124.2911 61.4716 38.7699 177.6981 30 E 3.8870 7.9739 116.2539 58.6487 29.4135 178.0652 31 E 4.1194 7.7379 116.8529 56.0323 30.2420 176.8829 32 L 3.6770 6.4131 119.7959 53.5019 42.3613 175.3756 33 P 4.3065 0.0000 0.0000 62.7846 31.8781 177.2885 34 D 4.3352 8.5706 120.4449 57.0754 40.8624 177.1539 35 D 4.6692 7.8850 116.1479 52.7293 39.9162 176.1558 36 W 4.1819 7.8138 130.5922 57.4747 31.1912 175.4880 37 V 4.2704 6.6753 116.6878 58.7177 35.3358 174.8317 38 C 3.6118 8.5438 121.9124 59.3380 31.5046 173.0658 39 P 4.1120 0.0000 0.0000 64.6254 31.4720 177.3785 40 I 3.9939 7.3738 119.5659 63.2838 37.6487 176.3095 41 C 4.4366 8.0345 111.1321 57.5649 30.7237 174.6411 42 G 3.7786 8.1472 108.6682 44.8706 0.0000 173.7562 43 A 4.0958 7.5793 122.9468 51.4359 19.2033 175.7433 44 P 4.8422 0.0000 0.0000 61.8648 32.4665 177.8525 45 K 4.3846 8.7717 118.9837 59.6617 32.0431 179.6883 46 S 4.3880 8.3333 112.2757 60.7198 63.0215 174.5922 47 E 4.5821 8.6722 120.2784 56.2390 29.3960 175.0183 48 F 5.3610 8.3482 117.9245 56.0398 41.4212 174.9573 49 E 4.7752 9.0792 121.5970 54.2108 33.0643 174.5692 50 K 3.2458 8.0220 127.6604 55.9823 33.0009 176.8771 51 L 4.3739 8.1689 128.3753 53.4348 40.9091 175.2320 52 E 4.5688 7.9634 121.3730 54.0473 33.7038 175.4896 53 D 4.4613 8.6555 121.4111 53.6629 39.5479 176.0610 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 8.12 4.43 1.41 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 0.00 0.00 2 K 8.36 5.16 0.00 1.74 1.70 0.00 1.58 0.00 0.00 1.79 0.00 0.00 2.83 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.39 1.53 7.81 3 W 9.48 5.37 0.00 3.33 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 4 V 9.01 4.90 2.11 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 0.80 0.00 0.00 0.97 0.00 0.00 5 C 9.10 3.44 0.00 2.51 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 6 K 8.73 3.94 0.00 1.80 1.84 0.00 1.92 0.00 0.00 1.90 0.00 0.00 2.97 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.47 1.40 7.81 7 I 7.87 3.89 1.82 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 1.43 0.72 0.90 0.00 0.00 8 C 8.19 4.62 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 9 G 8.36 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 0.00 0.00 0.00 10 Y 7.90 4.31 0.00 3.20 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 11 I 7.54 4.89 1.72 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 1.32 0.99 0.95 0.00 0.00 12 Y 9.58 4.37 0.00 3.58 3.21 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 13 D 7.95 4.76 0.00 2.70 2.33 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 14 E 8.86 3.96 0.00 2.02 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 0.00 2.77 2.67 0.00 15 D 8.28 4.47 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 16 A 7.76 4.26 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 17 G 7.95 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 0.00 0.00 0.00 18 D 8.60 4.98 0.00 3.24 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 19 P 0.00 4.36 0.00 2.26 2.14 0.00 3.74 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.17 0.00 20 D 8.22 4.52 0.00 2.72 2.76 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 21 N 8.19 4.92 0.00 3.04 2.83 0.00 0.00 7.03 7.65 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 22 G 8.50 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 0.00 0.00 0.00 23 I 7.95 4.36 2.10 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.85 0.88 0.00 0.00 24 S 8.36 4.56 0.00 4.01 4.00 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.30 0.00 2.06 2.24 0.00 3.65 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 2.04 2.24 0.00 26 G 9.15 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 27 T 7.20 4.18 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 1.08 0.00 0.00 28 K 8.87 4.43 0.00 1.93 1.77 0.00 1.71 0.00 0.00 1.63 0.00 0.00 2.88 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.53 1.40 7.81 29 F 9.25 3.18 0.00 2.21 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 0.00 0.00 0.00 30 E 7.97 3.89 0.00 1.94 1.96 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 2.38 2.51 0.00 31 E 7.74 4.12 0.00 1.94 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 2.25 2.27 0.00 32 L 6.41 3.68 0.00 0.82 0.76 -1.75 -0.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 33 P 0.00 4.31 0.00 2.26 1.97 0.00 3.43 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 2.11 2.07 0.00 34 D 8.57 4.34 0.00 2.64 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 D 7.88 4.67 0.00 2.76 2.75 0.00 0.00 0.00 0.00 0.00 0.00 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 W 7.81 4.18 0.00 3.08 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 37 V 6.68 4.27 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 0.81 0.00 0.00 0.62 0.00 0.00 38 C 8.54 3.61 0.00 3.21 2.88 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 39 P 0.00 4.11 0.00 2.02 1.96 0.00 3.00 0.00 0.00 3.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 1.79 0.00 40 I 7.37 3.99 1.83 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 1.08 0.99 0.92 0.00 0.00 41 C 8.03 4.44 0.00 3.02 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 42 G 8.15 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.58 4.10 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.84 0.00 2.28 2.04 0.00 3.67 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.13 0.00 45 K 8.77 4.38 0.00 1.86 1.93 0.00 1.47 0.00 0.00 1.69 0.00 0.00 2.42 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.22 1.68 7.81 46 S 8.33 4.39 0.00 4.07 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 47 E 8.67 4.58 0.00 2.22 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.36 2.46 0.00 48 F 8.35 5.36 0.00 3.31 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 49 E 9.08 4.78 0.00 2.03 1.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.19 0.00 50 K 8.02 3.25 0.00 0.79 0.91 0.00 1.15 0.00 0.00 1.29 0.00 0.00 2.78 0.00 0.00 2.94 0.00 0.00 0.00 0.00 0.77 0.21 7.81 51 L 8.17 4.37 0.00 1.53 1.53 0.90 0.89 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 52 E 7.96 4.57 0.00 1.73 1.68 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 0.00 1.96 2.04 0.00 53 D 8.66 4.46 0.00 2.75 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