NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.9169 8.3393 109.7368 45.4745 0.0000 176.2902 2 S 4.5227 8.5121 120.3742 55.3484 66.0892 172.2655 3 H 3.8428 8.8155 118.7404 57.1058 29.8174 172.4338 4 M 4.5464 7.9961 114.9965 55.6935 35.3766 174.0670 5 A 3.6380 8.2990 118.1307 53.1357 15.1256 177.1707 6 E 4.5374 7.4748 121.7417 54.2366 32.1737 175.9409 7 P 4.8610 0.0000 0.0000 62.9636 30.8397 175.7499 8 Q 4.1358 7.4858 118.7400 57.0720 32.3887 177.3790 9 R 3.9583 7.3860 123.2185 57.1808 29.3268 174.5288 10 H 5.1469 9.0920 122.5048 53.6928 33.7922 172.9122 11 K 4.6516 8.3383 117.7098 55.4575 34.6114 176.6913 12 I 3.9539 8.5892 127.7257 59.5714 37.3801 174.6859 13 L 4.2675 8.3108 129.0998 55.7568 42.4721 174.6738 14 C 5.1766 8.9627 130.1104 57.6654 35.0611 172.5403 15 V 5.0224 8.2737 109.6029 59.5138 35.3006 175.3169 16 C 4.5625 9.2020 124.4208 59.4561 31.8682 174.2011 17 C 4.1533 8.6171 127.2537 61.6369 31.2971 174.3840 18 K 4.5352 7.7856 115.0514 56.7828 33.8867 176.8058 19 C 4.1621 8.2072 115.5692 60.1746 28.6744 172.5678 20 D 4.5047 7.7701 118.2403 55.2671 40.0334 173.0403 21 G 4.3550 7.6211 102.6485 43.7310 0.0000 172.7059 22 R 4.5021 8.8104 122.3747 56.8600 30.8657 175.6721 23 I 4.3159 8.6390 128.4685 59.6375 39.5482 175.0318 24 E 4.1274 8.7265 129.4658 54.9641 28.7057 174.4734 25 L 3.7571 8.6825 124.0662 54.6203 41.8671 175.6482 26 T 4.7295 8.1692 121.1595 62.3996 68.0479 173.6981 27 V 4.3771 8.5918 119.2315 59.3156 35.1378 174.6673 28 E 5.2408 8.5995 124.4605 54.1508 29.7712 174.8412 29 S 4.5908 8.0382 117.3161 56.7108 66.2953 173.5666 30 S 4.5640 8.9994 118.9781 58.1759 63.4081 175.4331 31 A 3.9256 9.0006 124.6538 55.6015 17.9815 179.6476 32 E 4.0279 8.0902 116.3715 58.4263 29.9008 178.0782 33 D 4.3193 8.0187 118.1431 57.0098 41.3459 177.4502 34 L 3.9361 8.1401 121.1475 58.2336 41.9801 179.0145 35 R 3.8553 8.0539 118.4347 59.6926 30.0602 178.3404 36 T 3.9005 8.1460 116.1745 66.7877 68.5643 176.4990 37 L 4.1409 8.0647 121.4231 58.9719 40.3529 179.0668 38 Q 4.0507 8.5173 120.7592 58.9765 28.8313 178.1884 39 Q 4.1566 8.4389 119.7334 58.5912 28.6134 178.3153 40 L 4.0153 8.0890 120.2086 57.9732 41.3024 179.5959 41 F 4.1800 8.4084 118.7745 60.1491 38.6925 177.8547 42 L 3.9170 8.3845 117.5475 57.6148 41.3656 179.2773 43 S 4.2927 8.1555 113.5030 60.7699 62.5487 174.4648 44 T 4.6516 8.1246 107.5379 62.2178 73.5290 174.4242 45 L 3.9360 7.2803 122.0428 54.1657 42.1775 175.5801 46 S 4.6827 7.7145 114.8385 56.5626 66.6058 172.4050 47 F 4.8848 8.9315 120.9907 56.5863 42.9232 174.1504 48 V 4.7444 7.6190 122.9664 60.7284 32.8774 174.5190 49 C 4.6960 8.8998 122.4770 57.3269 30.3809 173.5930 50 P 4.3936 0.0000 0.0000 66.1354 30.5948 177.6825 51 W 4.3916 8.5506 128.3982 60.9549 30.4718 177.3412 52 C 3.6406 7.8612 113.6580 60.9540 29.0376 175.6325 53 A 3.9231 8.1538 123.1881 55.1516 17.9657 179.5925 54 T 3.9828 7.7797 113.3624 67.0771 68.7827 176.7621 55 N 4.3582 8.1144 116.6955 53.9119 38.6344 175.0990 56 Q 3.6896 8.0738 125.7900 56.4719 30.7492 172.8414 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 G 8.34 3.92 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 0.00 0.00 0.00 2 S 8.51 4.52 0.00 4.04 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3 H 8.82 3.84 0.00 3.23 3.31 0.00 5.93 0.00 0.00 0.00 0.00 6.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 4 M 8.00 4.55 0.00 1.86 1.83 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.45 2.50 0.00 5 A 8.30 3.64 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 6 E 7.47 4.54 0.00 2.03 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 2.35 2.29 0.00 7 P 0.00 4.86 0.00 2.26 2.25 0.00 3.64 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 2.08 2.00 0.00 8 Q 7.49 4.14 0.00 1.95 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 7.13 0.00 0.00 0.00 0.00 0.00 2.30 2.17 0.00 9 R 7.39 3.96 0.00 1.94 1.85 0.00 3.35 0.00 0.00 3.20 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.85 0.00 10 H 9.09 5.15 0.00 3.20 3.10 0.00 5.65 0.00 0.00 0.00 0.00 6.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 K 8.34 4.65 0.00 1.54 1.65 0.00 1.71 0.00 0.00 1.69 0.00 0.00 2.80 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.29 1.44 7.81 12 I 8.59 3.95 1.57 0.00 0.00 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.58 0.62 0.00 0.00 13 L 8.31 4.27 0.00 1.61 1.57 0.90 0.89 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 14 C 8.96 5.18 0.00 2.81 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 15 V 8.27 5.02 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 0.78 0.00 0.00 0.99 0.00 0.00 16 C 9.20 4.56 0.00 3.10 2.89 0.00 0.00 0.00 0.00 0.00 0.00 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 C 8.62 4.15 0.00 2.94 2.96 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 18 K 7.79 4.54 0.00 1.77 1.80 0.00 1.53 0.00 0.00 1.62 0.00 0.00 2.94 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.24 1.29 7.81 19 C 8.21 4.16 0.00 3.11 3.20 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 20 D 7.77 4.50 0.00 2.77 2.69 0.00 0.00 0.00 0.00 0.00 0.00 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 G 7.62 4.35 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 0.00 22 R 8.81 4.50 0.00 1.85 1.90 0.00 3.36 0.00 0.00 3.22 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.62 0.00 23 I 8.64 4.32 1.83 0.00 0.00 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.91 0.81 0.00 0.00 24 E 8.73 4.13 0.00 1.93 1.83 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 2.21 2.28 0.00 25 L 8.68 3.76 0.00 1.40 1.20 0.50 -0.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 26 T 8.17 4.73 4.19 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 1.18 0.00 0.00 27 V 8.59 4.38 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 0.83 0.00 0.00 0.87 0.00 0.00 28 E 8.60 5.24 0.00 1.79 1.84 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 2.17 2.08 0.00 29 S 8.04 4.59 0.00 3.86 3.65 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 0.00 0.00 0.00 0.00 30 S 9.00 4.56 0.00 3.83 3.81 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 31 A 9.00 3.93 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 32 E 8.09 4.03 0.00 2.05 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 2.37 2.36 0.00 33 D 8.02 4.32 0.00 2.84 2.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 L 8.14 3.94 0.00 1.77 1.85 0.91 1.00 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 8.05 3.86 0.00 2.05 2.09 0.00 3.16 0.00 0.00 3.17 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.67 0.00 36 T 8.15 3.90 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 1.24 0.00 0.00 37 L 8.06 4.14 0.00 2.04 2.12 1.07 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 38 Q 8.52 4.05 0.00 2.18 2.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.23 6.80 0.00 0.00 0.00 0.00 0.00 2.37 2.35 0.00 39 Q 8.44 4.16 0.00 2.25 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.66 6.57 0.00 0.00 0.00 0.00 0.00 2.56 2.57 0.00 40 L 8.09 4.02 0.00 2.01 1.76 0.99 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 41 F 8.41 4.18 0.00 3.30 3.18 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 0.00 0.00 0.00 0.00 42 L 8.38 3.92 0.00 1.83 1.78 0.98 0.90 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 43 S 8.16 4.29 0.00 3.99 4.03 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 44 T 8.12 4.65 4.18 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 0.00 0.00 0.00 1.19 0.00 0.00 45 L 7.28 3.94 0.00 1.39 0.18 0.79 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 46 S 7.71 4.68 0.00 3.83 3.79 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 47 F 8.93 4.88 0.00 3.50 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 48 V 7.62 4.74 1.93 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 0.90 0.00 0.00 0.90 0.00 0.00 49 C 8.90 4.70 0.00 3.38 3.31 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 50 P 0.00 4.39 0.00 2.39 2.45 0.00 3.92 0.00 0.00 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.15 0.00 51 W 8.55 4.39 0.00 3.40 3.25 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 52 C 7.86 3.64 0.00 2.90 2.64 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.15 3.92 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 54 T 7.78 3.98 4.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 55 N 8.11 4.36 0.00 2.49 2.75 0.00 0.00 7.50 7.42 0.00 0.00 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 Q 8.07 3.69 0.00 2.06 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.94 6.52 0.00 0.00 0.00 0.00 0.00 2.22 2.22 0.00