NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 T 3.9781 8.1749 110.9132 62.4472 69.9551 170.2986 2 T 3.0926 8.0977 122.9466 62.9763 64.6752 169.2580 3 Y 5.4716 8.4074 124.2826 55.8107 42.5302 174.5157 4 K 5.3494 8.9122 122.0184 55.3068 35.9354 174.5339 5 L 4.6715 8.3333 124.6176 53.1496 44.7338 175.1304 6 V 4.4724 8.4777 125.6692 61.3709 33.9047 174.5902 7 I 4.2886 8.4600 130.7146 59.6121 37.9935 176.0372 8 N 4.9889 8.7599 130.9046 51.7197 36.7486 174.6186 9 G 4.1967 8.0834 110.3311 42.9437 0.0000 171.6944 10 K 3.9206 8.5973 118.9618 58.4838 32.2622 177.0990 11 T 3.4256 8.5620 112.8528 61.7547 68.0128 172.5528 12 L 4.1425 7.4283 120.2698 55.7280 43.7758 172.5230 13 K 5.2775 8.5225 125.2401 52.8464 34.9130 176.5590 14 G 4.0977 7.8011 108.7943 47.0730 0.0000 170.3981 15 E 5.7269 8.1406 115.6907 56.1025 32.4933 174.3485 16 T 4.8788 8.0873 116.5687 62.7377 73.6167 172.3241 17 T 5.5793 8.4545 111.8466 60.8438 72.2931 173.3638 18 T 4.6463 8.9341 118.0212 62.1826 73.5440 172.5627 19 E 4.6208 8.7334 126.5221 55.6357 30.3176 175.1484 20 A 4.4123 8.1348 127.1157 52.1966 22.7352 176.0168 21 V 3.3904 8.7850 121.6877 64.8571 30.3501 177.5240 22 D 4.8057 8.9898 116.4768 52.3758 41.5755 178.0682 23 A 3.7025 8.6978 121.2088 55.1805 18.3668 179.8078 24 A 3.9520 8.0135 118.6229 54.7992 18.1227 178.3457 25 T 4.4281 7.6919 112.9759 63.7917 69.5810 175.6065 26 A 4.3987 7.9030 122.7818 53.7593 20.6895 178.5265 27 E 3.2461 8.0387 117.0632 59.6776 29.3265 179.1983 28 K 3.9662 7.5339 116.3627 59.8828 32.3295 178.8348 29 V 3.6217 7.4833 118.5773 65.0043 31.4377 177.4851 30 F 4.4887 8.1180 117.1220 61.1679 38.9515 177.9003 31 K 4.0381 8.4155 117.9728 59.9315 31.6821 179.0643 32 Q 4.0067 8.2603 119.5551 59.2250 29.0036 177.1497 33 Y 4.0473 8.2830 119.9687 60.9909 38.6425 177.8738 34 A 4.2645 9.0122 121.8450 55.2773 18.3200 178.7769 35 N 4.5946 7.7960 112.4827 54.8176 39.1419 176.9039 36 D 4.4859 8.1741 119.7845 56.0309 41.0256 177.0324 37 N 4.8144 7.8715 114.4893 52.0468 39.7519 175.0894 38 G 3.8098 8.0800 107.8274 46.1722 0.0000 173.3563 39 V 4.8160 7.7484 118.1498 60.7118 32.5426 175.1977 40 D 4.6285 8.3398 124.6322 53.7441 44.0249 173.3977 41 G 4.2873 8.2496 117.1781 45.6508 0.0000 171.3573 42 E 4.8867 8.1082 120.2518 54.7954 32.0753 175.5316 43 W 6.1895 9.1162 121.1211 54.7764 32.7988 174.7888 44 T 4.7539 8.6352 110.0730 61.0013 71.5335 172.2458 45 Y 5.3324 9.5472 123.4086 57.4208 40.3111 175.0742 46 D 5.0666 7.7289 120.3280 53.6914 41.3972 176.9808 47 D 3.6745 7.8717 123.3402 56.7945 41.9264 178.3613 48 A 4.0827 7.3973 120.9403 54.7683 18.2776 178.1698 49 T 4.3532 8.5696 103.3682 60.4006 70.0246 174.1076 50 K 3.5224 7.1654 120.1136 58.3755 30.4549 174.2717 51 T 4.9603 6.8805 112.3771 61.7973 72.9123 173.8881 52 F 6.0965 8.7567 120.4141 55.3459 43.6287 174.6422 53 T 4.8600 8.4546 115.5603 62.1164 72.5899 172.9374 54 V 3.9351 8.7386 127.5823 61.4414 33.4275 174.6788 55 T 4.8341 8.0374 124.2847 61.2048 70.9188 174.0816 56 E 4.5795 8.4084 125.1849 55.9402 29.6011 177.1849 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 T 8.17 3.98 4.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 2 T 8.10 3.09 4.14 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 1.21 0.00 0.00 3 Y 8.41 5.47 0.00 3.26 3.36 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 4 K 8.91 5.35 0.00 2.00 2.00 0.00 1.27 0.00 0.00 1.59 0.00 0.00 2.80 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.35 1.34 7.81 5 L 8.33 4.67 0.00 0.27 0.13 0.78 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 6 V 8.48 4.47 2.06 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 0.65 0.00 0.00 0.90 0.00 0.00 7 I 8.46 4.29 1.81 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 1.05 0.75 0.84 0.00 0.00 8 N 8.76 4.99 0.00 2.65 2.69 0.00 0.00 6.51 7.58 0.00 0.00 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 8.08 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 0.00 0.00 0.00 10 K 8.60 3.92 0.00 1.74 1.78 0.00 1.98 0.00 0.00 1.75 0.00 0.00 3.06 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.44 1.56 7.81 11 T 8.56 3.43 4.24 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 0.00 0.00 1.20 0.00 0.00 12 L 7.43 4.14 0.00 1.67 1.54 0.95 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 13 K 8.52 5.28 0.00 1.63 1.65 0.00 1.97 0.00 0.00 2.61 0.00 0.00 2.72 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.30 1.22 7.81 14 G 7.80 4.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.14 5.73 0.00 1.91 1.80 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 2.15 2.15 0.00 16 T 8.09 4.88 3.94 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 1.30 0.00 0.00 17 T 8.45 5.58 4.34 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 1.27 0.00 0.00 18 T 8.93 4.65 3.69 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 1.04 0.00 0.00 19 E 8.73 4.62 0.00 1.93 1.82 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 2.24 2.33 0.00 20 A 8.13 4.41 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 21 V 8.79 3.39 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 0.87 0.00 0.00 0.94 0.00 0.00 22 D 8.99 4.81 0.00 2.99 2.83 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 23 A 8.70 3.70 0.95 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 24 A 8.01 3.95 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 25 T 7.69 4.43 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 1.19 0.00 0.00 26 A 7.90 4.40 1.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.04 3.25 0.00 2.09 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 2.08 2.10 0.00 28 K 7.53 3.97 0.00 1.72 1.80 0.00 1.70 0.00 0.00 1.58 0.00 0.00 2.97 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.40 1.36 7.81 29 V 7.48 3.62 1.85 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 0.84 0.00 0.00 0.86 0.00 0.00 30 F 8.12 4.49 0.00 2.91 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 31 K 8.42 4.04 0.00 1.55 1.70 0.00 0.61 0.00 0.00 0.92 0.00 0.00 2.52 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.99 0.21 7.81 32 Q 8.26 4.01 0.00 2.25 2.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.13 6.74 0.00 0.00 0.00 0.00 0.00 2.37 2.45 0.00 33 Y 8.28 4.05 0.00 3.21 3.35 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 34 A 9.01 4.26 1.82 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 0.00 0.00 35 N 7.80 4.59 0.00 2.75 2.92 0.00 0.00 7.09 7.86 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 36 D 8.17 4.49 0.00 2.75 2.57 0.00 0.00 0.00 0.00 0.00 0.00 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 N 7.87 4.81 0.00 2.68 2.81 0.00 0.00 7.07 8.72 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 38 G 8.08 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 0.00 0.00 0.00 39 V 7.75 4.82 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 0.77 0.00 0.00 0.96 0.00 0.00 40 D 8.34 4.63 0.00 2.71 2.48 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 41 G 8.25 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 0.00 0.00 0.00 0.00 42 E 8.11 4.89 0.00 1.93 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 0.00 2.29 2.28 0.00 43 W 9.12 6.19 0.00 3.04 3.19 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 0.00 44 T 8.64 4.75 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 1.27 0.00 0.00 45 Y 9.55 5.33 0.00 2.55 2.67 0.00 0.00 0.00 0.00 0.00 0.00 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 D 7.73 5.07 0.00 2.67 2.43 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 0.00 47 D 7.87 3.67 0.00 2.92 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 48 A 7.40 4.08 1.32 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 0.00 0.00 0.00 49 T 8.57 4.35 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 1.17 0.00 0.00 50 K 7.17 3.52 0.00 2.12 2.34 0.00 1.64 0.00 0.00 1.68 0.00 0.00 3.05 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.66 1.60 7.81 51 T 6.88 4.96 4.10 0.00 0.00 0.00 0.00 0.00 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 52 F 8.76 6.10 0.00 2.97 3.13 0.00 0.00 0.00 0.00 0.00 0.00 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 T 8.45 4.86 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 1.16 0.00 0.00 54 V 8.74 3.94 1.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.68 0.00 0.00 0.50 0.00 0.00 55 T 8.04 4.83 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 1.16 0.00 0.00 56 E 8.41 4.58 0.00 1.90 1.82 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 2.51 2.03 0.00