NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 4.0088 8.3393 109.7363 45.7424 0.0000 174.7247 2 S 4.3817 8.1660 118.9635 56.2228 63.1602 171.5960 3 G 3.8593 7.8872 117.4464 46.0271 0.0000 171.6935 4 S 4.5460 7.9172 109.3194 57.8739 64.7674 176.5647 5 G 3.9510 8.9481 113.0859 46.6955 0.0000 173.8418 6 S 4.7050 7.6812 111.5158 56.7544 67.2564 172.6611 7 G 3.5885 8.9834 111.9131 45.8939 0.0000 176.3868 8 S 4.2950 9.1803 117.3857 58.4242 64.3191 172.2866 9 N 4.1833 8.5986 127.5509 53.5604 35.6538 175.0006 10 V 3.5949 7.8801 119.9902 64.5687 31.9801 176.0827 11 I 3.0521 7.4967 121.8119 60.3980 38.0859 172.4119 12 D 4.9673 8.2692 121.2525 55.0644 41.3133 177.0403 13 T 3.7890 7.3400 109.3694 61.6242 68.4298 174.0802 14 D 4.5354 7.7984 118.3764 54.8646 41.1885 176.6570 15 F 4.7668 6.7534 112.8011 56.8994 39.5978 176.0690 16 I 4.0059 6.1703 120.2794 60.7461 38.4341 174.0314 17 D 4.8679 8.3424 124.2482 52.4964 42.1190 177.1114 18 E 4.1560 8.7060 124.5594 58.3851 29.5616 178.5872 19 E 3.9287 7.9035 118.6941 58.8394 30.0555 178.5893 20 V 3.5506 7.5846 119.3857 65.8056 31.6274 178.0452 21 L 4.0422 7.8984 118.9590 58.7026 40.2141 178.6784 22 M 3.9550 7.4355 119.0976 58.8364 32.2127 178.1306 23 S 4.1320 7.8772 112.7489 61.3963 62.5988 176.0825 24 L 4.0902 7.7522 121.4202 57.2878 41.2098 179.6326 25 V 3.5866 7.9488 118.9591 66.0884 31.8296 178.2135 26 I 4.1848 7.6075 120.4668 63.6535 36.7008 177.9932 27 E 3.8158 8.0087 119.6506 59.2701 29.5306 178.0575 28 M 4.2483 7.6763 116.8557 57.7018 32.8769 176.7631 29 G 4.2985 7.2468 106.2138 46.2024 0.0000 174.7637 30 L 4.1924 8.7176 122.2133 55.9971 42.3918 177.9157 31 D 4.8053 8.0112 116.9386 53.0874 39.9024 176.6922 32 R 4.5927 7.5185 116.1105 56.0303 29.9733 175.1280 33 I 4.1872 7.8600 118.8988 61.5111 38.3748 175.8551 34 K 4.1961 8.6038 125.2100 56.9382 33.1403 175.6903 35 E 4.3753 7.8150 118.3400 53.8210 31.3567 174.6148 36 L 4.1471 8.4946 129.5906 53.3226 41.7745 174.5320 37 P 4.4133 0.0000 0.0000 62.7460 31.7963 175.4818 38 E 4.0326 8.2872 118.1737 55.4258 30.3095 176.8477 39 L 4.3625 7.0690 122.3406 52.4496 42.6648 175.6246 40 W 5.5007 7.7751 122.2756 54.4285 32.8446 173.3523 41 L 4.0740 8.6439 123.8440 54.8955 39.7741 176.8129 42 G 3.7417 7.9580 110.8166 46.3601 0.0000 172.9364 43 Q 4.1730 7.8847 122.0515 55.7952 30.0195 176.2425 44 N 4.8491 8.4727 115.6317 53.5788 39.9946 175.6848 45 E 4.3473 8.2068 116.8114 56.9023 30.3182 176.2040 46 F 5.1419 7.9777 115.4360 58.0675 40.4623 176.0302 47 D 4.6345 8.3811 121.5110 56.3675 41.0611 177.7523 48 F 4.2753 8.2664 116.3003 60.4060 38.9594 175.4162 49 M 4.4325 7.8452 119.7885 55.6684 31.8872 177.6033 50 T 3.8612 7.7765 110.8056 64.3778 69.0505 175.5004 51 D 4.4154 8.1425 118.8952 53.6049 40.0277 173.2577 52 F 4.1048 7.7851 123.5904 58.5958 39.2835 174.6967 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 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.17 4.38 0.00 4.01 3.83 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 3 G 7.89 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 4 S 7.92 4.55 0.00 3.93 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5 G 8.95 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 0.00 0.00 0.00 6 S 7.68 4.70 0.00 3.93 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 7 G 8.98 3.59 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 0.00 0.00 0.00 8 S 9.18 4.29 0.00 3.79 3.74 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 9 N 8.60 4.18 0.00 2.87 2.83 0.00 0.00 7.19 7.69 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 10 V 7.88 3.59 2.08 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 0.64 0.00 0.00 0.94 0.00 0.00 11 I 7.50 3.05 1.84 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.70 0.86 0.00 0.00 12 D 8.27 4.97 0.00 2.76 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 13 T 7.34 3.79 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 1.08 0.00 0.00 14 D 7.80 4.54 0.00 2.67 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 15 F 6.75 4.77 0.00 3.06 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 16 I 6.17 4.01 1.46 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 1.18 0.90 0.86 0.00 0.00 17 D 8.34 4.87 0.00 2.74 2.52 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.71 4.16 0.00 2.22 2.17 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 2.36 2.36 0.00 19 E 7.90 3.93 0.00 2.35 2.24 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 2.27 2.31 0.00 20 V 7.58 3.55 2.21 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 1.15 0.00 0.00 0.95 0.00 0.00 21 L 7.90 4.04 0.00 1.95 1.91 0.91 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 22 M 7.44 3.96 0.00 2.17 2.33 0.00 0.00 0.00 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.59 0.00 23 S 7.88 4.13 0.00 3.91 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 24 L 7.75 4.09 0.00 1.85 1.70 0.93 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 25 V 7.95 3.59 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 1.01 0.00 0.00 0.98 0.00 0.00 26 I 7.61 4.18 1.87 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 1.39 1.45 0.91 0.00 0.00 27 E 8.01 3.82 0.00 2.18 1.98 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 2.32 2.36 0.00 28 M 7.68 4.25 0.00 2.08 2.22 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 2.57 2.54 0.00 29 G 7.25 4.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.72 4.19 0.00 1.58 1.72 0.91 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 31 D 8.01 4.81 0.00 2.81 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 32 R 7.52 4.59 0.00 1.88 1.98 0.00 3.02 0.00 0.00 3.22 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.69 0.00 33 I 7.86 4.19 1.86 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.65 0.93 0.00 0.00 34 K 8.60 4.20 0.00 1.70 1.81 0.00 1.71 0.00 0.00 1.63 0.00 0.00 2.96 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.34 1.40 7.81 35 E 7.81 4.38 0.00 1.90 1.78 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 2.17 2.25 0.00 36 L 8.49 4.15 0.00 1.60 1.56 0.87 0.98 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 37 P 0.00 4.41 0.00 2.15 2.02 0.00 3.77 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 1.96 0.00 38 E 8.29 4.03 0.00 1.95 1.71 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 2.31 2.34 0.00 39 L 7.07 4.36 0.00 1.11 1.34 0.82 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 40 W 7.78 5.50 0.00 3.35 2.93 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 41 L 8.64 4.07 0.00 1.73 1.77 0.97 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 42 G 7.96 3.74 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 0.00 0.00 0.00 43 Q 7.88 4.17 0.00 2.02 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.58 6.74 0.00 0.00 0.00 0.00 0.00 2.34 2.39 0.00 44 N 8.47 4.85 0.00 2.76 2.87 0.00 0.00 6.85 7.68 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 45 E 8.21 4.35 0.00 1.94 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 2.29 2.34 0.00 46 F 7.98 5.14 0.00 3.04 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 47 D 8.38 4.63 0.00 3.06 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 48 F 8.27 4.28 0.00 2.86 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 49 M 7.85 4.43 0.00 2.06 2.13 0.00 0.00 0.00 0.00 0.00 2.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.29 0.00 50 T 7.78 3.86 4.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 51 D 8.14 4.42 0.00 2.83 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 52 F 7.79 4.10 0.00 3.05 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