NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 6 T 4.1492 8.1701 115.2252 61.3114 68.5238 173.3987 7 A 3.7243 8.4223 130.8282 51.9129 18.8688 176.3234 8 F 5.3230 8.0989 121.9589 56.0438 41.9124 175.0484 9 S 4.5031 9.1755 119.9088 57.7563 64.9930 175.6496 10 S 4.1320 8.5639 117.4245 61.8625 62.4529 176.4769 11 E 3.9035 8.0903 121.7005 59.0340 29.2271 179.0757 12 Q 3.7831 7.8576 117.7111 58.8330 28.7165 178.8129 13 L 3.6668 7.9817 120.9232 58.0082 42.1712 178.7751 14 A 3.9626 8.0835 120.8226 55.1941 18.3305 179.6123 15 R 3.7765 8.1279 117.4150 59.5022 30.1616 178.6861 16 L 3.7419 7.9570 121.6654 58.1382 41.3710 180.3396 17 K 4.3074 8.2375 124.0146 59.8847 31.4390 181.4640 18 R 4.1950 7.8269 118.4437 59.0813 30.2955 178.6755 19 E 4.2040 8.3070 118.3582 59.6021 29.1846 179.2100 20 F 4.1824 8.8440 120.9348 61.4746 39.1661 176.8479 21 N 4.4812 8.2558 115.0920 55.6130 38.3334 177.1030 22 E 4.2890 7.9111 119.7650 57.5306 29.9843 176.7804 23 N 4.7899 7.2187 115.7296 52.8695 41.7383 175.1161 24 R 3.4679 8.5083 123.9465 57.5261 29.8770 172.2746 25 Y 4.8118 8.5519 114.3575 56.6907 40.0446 174.7347 26 L 4.4455 8.3463 125.7760 53.3688 43.6542 176.8242 27 T 4.2604 8.1365 116.5973 60.8523 71.2622 175.0162 28 E 3.8768 8.6546 122.1754 59.8524 29.5465 179.3988 29 R 3.9272 7.8906 117.3386 59.1862 30.1377 178.9296 30 R 3.8387 7.8859 118.1945 59.2637 30.0019 178.4475 31 R 3.7977 8.2089 118.8899 59.6054 30.1606 178.5645 32 Q 3.9577 8.1238 117.7819 58.8339 28.6121 178.5090 33 Q 3.9232 8.2491 120.6857 59.2704 29.0912 178.2997 34 L 3.9246 8.2724 120.4459 57.6830 41.6841 179.3209 35 S 4.2238 8.2335 114.8027 60.9845 62.0632 176.5977 36 S 4.1240 7.7109 116.2502 61.6887 62.6789 176.2744 37 E 4.0934 8.2830 120.3703 58.5836 29.3051 178.4121 38 L 4.4060 8.0615 117.1573 53.6789 42.4067 176.8944 39 G 3.8417 7.9108 106.4188 46.5254 0.0000 173.2566 40 L 4.7369 7.4613 118.2763 51.8319 44.6393 175.8942 41 N 4.3992 8.6251 120.7349 53.7676 39.7176 175.4168 42 E 3.9916 9.0120 123.8176 59.6746 29.5378 179.5434 43 A 4.0796 8.9700 121.0467 55.3350 18.4036 179.7690 44 Q 4.1551 8.0938 116.3542 59.1541 28.7654 178.9368 45 I 3.9363 7.8203 120.5255 64.2227 37.1583 178.1962 46 K 4.0660 8.6118 120.9735 59.6257 31.9674 178.9479 47 I 3.7949 8.1357 120.1490 64.0559 36.9548 178.1433 48 W 4.1091 8.5542 129.2342 60.6600 30.5336 178.0105 49 F 4.0885 9.0925 117.8213 60.6857 37.8390 177.7283 50 Q 4.0525 8.6568 117.9936 59.0447 28.5623 178.5361 51 N 4.2090 8.4134 117.5705 56.1271 38.3245 177.2184 52 A 3.2753 7.3142 121.1061 55.0585 18.3680 179.8049 53 R 4.0973 7.9819 114.5194 58.5956 30.0921 178.4839 54 A 4.2668 7.1583 119.1232 54.1867 19.1100 177.8204 55 K 4.1418 7.6929 120.5368 56.8096 32.2340 176.8513 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 6 T 8.17 4.15 4.27 0.00 0.00 0.00 0.00 0.00 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 0.00 0.00 7 A 8.42 3.72 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 8 F 8.10 5.32 0.00 2.99 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 9 S 9.18 4.50 0.00 4.19 4.02 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 10 S 8.56 4.13 0.00 4.07 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 0.00 11 E 8.09 3.90 0.00 2.04 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 2.38 2.45 0.00 12 Q 7.86 3.78 0.00 2.27 1.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.81 0.00 0.00 0.00 0.00 0.00 2.20 2.28 0.00 13 L 7.98 3.67 0.00 1.96 1.77 1.25 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 14 A 8.08 3.96 1.37 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 0.00 0.00 0.00 15 R 8.13 3.78 0.00 1.84 1.94 0.00 3.12 0.00 0.00 3.13 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.62 0.00 16 L 7.96 3.74 0.00 0.65 0.13 -0.35 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.00 0.00 0.00 0.00 0.00 0.00 17 K 8.24 4.31 0.00 1.73 1.82 0.00 1.81 0.00 0.00 1.65 0.00 0.00 2.88 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.37 1.35 7.81 18 R 7.83 4.20 0.00 1.80 2.05 0.00 3.15 0.00 0.00 3.23 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.90 0.00 19 E 8.31 4.20 0.00 2.35 2.29 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 2.54 2.52 0.00 20 F 8.84 4.18 0.00 3.16 3.30 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 21 N 8.26 4.48 0.00 3.06 2.91 0.00 0.00 7.08 7.02 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 22 E 7.91 4.29 0.00 2.13 2.02 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 2.36 2.59 0.00 23 N 7.22 4.79 0.00 2.73 2.71 0.00 0.00 7.22 7.53 0.00 0.00 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 R 8.51 3.47 0.00 1.87 1.82 0.00 3.28 0.00 0.00 3.22 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.22 0.00 25 Y 8.55 4.81 0.00 3.01 2.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 L 8.35 4.45 0.00 1.05 1.33 0.59 0.26 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 27 T 8.14 4.26 4.23 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 0.00 0.00 0.00 1.21 0.00 0.00 28 E 8.65 3.88 0.00 2.04 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 2.50 2.41 0.00 29 R 7.89 3.93 0.00 1.88 1.95 0.00 3.17 0.00 0.00 3.26 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.67 0.00 30 R 7.89 3.84 0.00 1.89 2.00 0.00 3.10 0.00 0.00 3.04 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.62 0.00 31 R 8.21 3.80 0.00 1.91 2.02 0.00 3.34 0.00 0.00 3.11 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.61 0.00 32 Q 8.12 3.96 0.00 2.28 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.58 0.00 0.00 0.00 0.00 0.00 2.58 2.53 0.00 33 Q 8.25 3.92 0.00 2.21 2.21 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 2.34 2.54 0.00 34 L 8.27 3.92 0.00 1.79 1.65 0.95 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 35 S 8.23 4.22 0.00 3.90 4.05 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 0.00 0.00 0.00 36 S 7.71 4.12 0.00 4.06 3.89 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 37 E 8.28 4.09 0.00 1.89 1.97 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 2.32 2.47 0.00 38 L 8.06 4.41 0.00 1.57 1.52 0.69 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 39 G 7.91 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 40 L 7.46 4.74 0.00 1.58 1.49 0.20 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 0.00 0.00 0.00 0.00 41 N 8.63 4.40 0.00 2.76 2.75 0.00 0.00 7.18 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 42 E 9.01 3.99 0.00 2.06 2.01 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 2.40 2.39 0.00 43 A 8.97 4.08 1.36 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 0.00 0.00 44 Q 8.09 4.16 0.00 2.45 2.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.76 0.00 0.00 0.00 0.00 0.00 2.49 2.70 0.00 45 I 7.82 3.94 2.06 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.54 0.99 0.00 0.00 46 K 8.61 4.07 0.00 1.91 2.04 0.00 1.67 0.00 0.00 1.70 0.00 0.00 2.99 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.52 1.56 7.81 47 I 8.14 3.79 2.15 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 1.47 0.77 0.97 0.00 0.00 48 W 8.55 4.11 0.00 3.90 3.62 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 0.00 0.00 0.00 0.00 49 F 9.09 4.09 0.00 3.52 3.26 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 0.00 50 Q 8.66 4.05 0.00 2.27 2.18 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 2.47 2.64 0.00 51 N 8.41 4.21 0.00 2.62 2.62 0.00 0.00 6.94 7.26 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 52 A 7.31 3.28 -0.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 7.98 4.10 0.00 1.94 2.02 0.00 2.71 0.00 0.00 2.63 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.99 0.00 54 A 7.16 4.27 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 55 K 7.69 4.14 0.00 1.67 1.60 0.00 1.46 0.00 0.00 1.58 0.00 0.00 2.80 0.00 0.00 2.65 0.00 0.00 0.00 0.00 1.34 1.40 7.81