NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.7403 8.3044 120.2777 55.3731 33.1375 173.8217 2 L 4.8704 8.7138 125.5730 51.0382 46.4724 173.4057 3 K 5.0274 8.4124 117.7428 54.8952 36.7492 174.3631 4 L 5.0107 8.8332 124.4829 53.2275 45.2239 175.2549 5 K 4.7107 9.2269 126.1619 55.7405 33.7609 175.9142 6 V 4.9172 8.8525 124.2258 61.2876 34.6645 174.1697 7 E 4.6976 9.5931 125.7164 54.1667 34.7344 176.3038 8 G 4.1908 9.0033 107.5310 45.0006 0.0000 178.6607 9 M 4.4017 8.6903 121.3514 55.1223 29.2029 175.8939 10 T 4.2127 7.7363 112.9850 61.4222 66.6704 174.0351 11 C 4.8939 7.5141 126.2245 57.9142 33.1214 175.1401 12 N 4.1675 8.6706 118.3410 56.9844 38.1841 177.3947 13 H 4.3616 8.2288 118.6901 59.0826 29.9362 176.8105 14 C 4.1547 7.6047 118.7755 62.7518 27.8177 175.8824 15 V 3.5483 7.7135 120.0105 66.0838 31.0396 177.7629 16 M 3.9924 7.8488 117.7759 58.4916 32.1398 177.9622 17 A 3.9898 7.8888 120.2793 55.4162 18.6392 179.8638 18 V 3.6386 7.8965 110.7850 64.7709 31.6369 178.7261 19 T 3.8256 8.0292 112.7981 65.0979 67.0395 176.3613 20 K 3.9331 8.1700 120.0652 59.5453 31.9512 179.3172 21 A 4.0148 8.2982 119.9392 54.9301 18.3749 179.5879 22 L 4.1195 8.1604 117.9445 57.7856 41.7195 179.3412 23 K 4.1440 7.7707 115.6527 57.8458 32.5785 178.2544 24 K 3.9846 7.5610 121.2076 59.1864 32.6835 177.5725 25 V 3.9283 6.7821 118.5572 59.3655 32.3989 173.9220 26 P 4.3121 0.0000 0.0000 63.4068 32.0166 174.1604 27 G 3.7453 8.3369 121.0571 46.2682 0.0000 174.3108 28 V 3.5457 8.9597 119.9244 65.5686 32.7166 176.9937 29 E 3.8980 8.1921 120.7297 56.4872 29.8833 173.3677 30 K 4.4513 7.5908 119.8184 54.8996 33.1928 175.4805 31 V 4.8620 8.1571 120.0119 59.6267 35.3220 175.0188 32 E 4.8267 9.3088 124.2161 54.4773 33.5366 174.9940 33 V 4.8386 8.1931 121.6041 60.9668 34.7713 175.0004 34 S 4.3589 8.9025 122.2507 57.9265 63.0993 174.2693 35 L 4.1403 8.5592 127.7864 58.0740 41.6176 178.4503 36 E 4.1872 8.0459 115.6293 57.8101 29.8684 176.5507 37 K 4.7325 7.8383 116.6088 54.4190 36.0471 175.1792 38 G 4.1981 8.6305 105.1135 46.3014 0.0000 172.7762 39 E 5.1496 8.2377 117.7056 54.2414 32.4141 174.5712 40 A 5.1714 8.8325 122.9822 50.2395 23.0330 174.8232 41 L 5.1984 8.8037 119.5942 53.0533 45.9463 176.2107 42 V 4.8033 8.8601 114.7688 59.6113 36.1795 174.3772 43 E 4.6939 8.9930 125.2779 55.6959 31.3053 174.9683 44 G 3.9466 7.5982 115.0634 46.3993 0.0000 171.7722 45 T 4.4602 8.4150 110.2415 61.0569 69.1799 174.0520 46 A 4.1828 7.8028 124.3018 52.1994 19.1271 178.2957 47 D 4.5974 8.3919 119.7111 53.3826 42.9409 176.3654 48 P 4.2043 0.0000 0.0000 66.2804 31.6007 178.8354 49 K 3.8867 8.1326 118.4062 58.7845 31.9618 178.6841 50 A 3.9960 8.0689 120.3812 55.2894 18.2444 179.6016 51 L 3.8930 7.4855 116.6466 57.9199 41.8254 179.5256 52 V 3.5738 7.7358 118.0893 66.2651 31.5426 177.7429 53 Q 3.9262 8.6583 118.9406 59.1515 28.7152 177.9202 54 A 4.0094 7.7626 120.3318 55.5959 18.6029 179.8126 55 V 3.8031 7.9514 110.6625 64.2298 31.5774 178.2943 56 E 3.9545 8.3122 119.3139 59.4689 29.1756 178.6214 57 E 3.9066 7.8257 117.1492 59.4923 29.5942 178.6755 58 E 3.8963 7.7064 117.6732 57.2247 29.7400 177.4293 59 G 3.8726 7.8003 106.0859 45.1731 0.0000 173.0303 60 Y 4.8214 7.1942 116.8541 57.6313 39.4282 174.5589 61 K 4.8593 8.7141 118.8818 55.2188 35.5039 175.5400 62 A 5.0823 8.3185 122.8382 51.7328 22.7933 175.2368 63 E 4.7014 8.8277 119.0919 55.2317 33.4438 174.6904 64 V 4.1375 8.4860 127.0986 61.4125 32.9730 175.7894 65 L 4.6094 8.6561 125.0854 53.1306 43.7661 176.2816 66 A 4.2214 8.3727 127.0861 52.0854 18.7074 177.1906 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 M 8.30 4.74 0.00 1.92 2.12 0.00 0.00 0.00 0.00 0.00 -0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.55 0.00 2 L 8.71 4.87 0.00 1.64 1.46 0.95 0.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 3 K 8.41 5.03 0.00 2.02 1.83 0.00 1.30 0.00 0.00 1.57 0.00 0.00 2.81 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.42 1.35 7.81 4 L 8.83 5.01 0.00 1.74 1.51 0.95 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 5 K 9.23 4.71 0.00 1.80 1.70 0.00 1.65 0.00 0.00 1.57 0.00 0.00 2.81 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.42 1.38 7.81 6 V 8.85 4.92 2.12 0.00 0.00 0.00 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 0.96 0.00 0.00 7 E 9.59 4.70 0.00 1.87 1.76 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 2.21 2.40 0.00 8 G 9.00 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 0.00 0.00 0.00 9 M 8.69 4.40 0.00 2.06 2.07 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.69 2.78 0.00 10 T 7.74 4.21 4.21 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 1.22 0.00 0.00 11 C 7.51 4.89 0.00 2.92 2.80 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 12 N 8.67 4.17 0.00 2.74 2.86 0.00 0.00 6.45 8.15 0.00 0.00 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 H 8.23 4.36 0.00 3.24 3.33 0.00 5.87 0.00 0.00 0.00 0.00 6.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 C 7.60 4.15 0.00 2.83 2.42 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 0.00 0.00 0.00 0.00 15 V 7.71 3.55 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 0.97 0.00 0.00 0.96 0.00 0.00 16 M 7.85 3.99 0.00 2.22 2.10 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.68 0.00 17 A 7.89 3.99 1.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 V 7.90 3.64 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 0.91 0.00 0.00 1.00 0.00 0.00 19 T 8.03 3.83 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 1.29 0.00 0.00 20 K 8.17 3.93 0.00 1.91 1.84 0.00 1.75 0.00 0.00 1.66 0.00 0.00 2.97 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.54 1.61 7.81 21 A 8.30 4.01 1.34 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 0.00 0.00 0.00 22 L 8.16 4.12 0.00 1.92 1.73 0.93 0.72 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 23 K 7.77 4.14 0.00 2.08 1.94 0.00 1.63 0.00 0.00 1.93 0.00 0.00 3.10 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.73 1.45 7.81 24 K 7.56 3.98 0.00 1.90 2.22 0.00 1.60 0.00 0.00 1.86 0.00 0.00 3.07 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.54 1.47 7.81 25 V 6.78 3.93 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 0.89 0.00 0.00 0.93 0.00 0.00 26 P 0.00 4.31 0.00 2.20 2.13 0.00 3.82 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.96 0.00 27 G 8.34 3.75 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 0.00 0.00 0.00 28 V 8.96 3.55 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 0.83 0.00 0.00 0.93 0.00 0.00 29 E 8.19 3.90 0.00 2.12 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 0.00 2.18 2.34 0.00 30 K 7.59 4.45 0.00 1.91 1.88 0.00 1.60 0.00 0.00 1.82 0.00 0.00 2.96 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.43 1.51 7.81 31 V 8.16 4.86 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 0.78 0.00 0.00 0.98 0.00 0.00 32 E 9.31 4.83 0.00 1.86 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 2.21 2.21 0.00 33 V 8.19 4.84 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 0.74 0.00 0.00 0.92 0.00 0.00 34 S 8.90 4.36 0.00 3.83 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 35 L 8.56 4.14 0.00 1.67 1.70 0.92 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 36 E 8.05 4.19 0.00 1.95 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 2.30 2.32 0.00 37 K 7.84 4.73 0.00 1.67 1.64 0.00 1.57 0.00 0.00 1.70 0.00 0.00 3.07 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.35 1.38 7.81 38 G 8.63 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 39 E 8.24 5.15 0.00 2.03 2.05 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 2.26 2.28 0.00 40 A 8.83 5.17 1.27 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 41 L 8.80 5.20 0.00 1.61 1.52 0.92 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 42 V 8.86 4.80 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 0.89 0.00 0.00 0.95 0.00 0.00 43 E 8.99 4.69 0.00 1.94 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 2.20 2.22 0.00 44 G 7.60 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 45 T 8.42 4.46 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 1.21 0.00 0.00 46 A 7.80 4.18 1.26 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 0.00 0.00 47 D 8.39 4.60 0.00 2.70 2.60 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.20 0.00 2.26 2.30 0.00 3.71 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.05 0.00 49 K 8.13 3.89 0.00 1.79 1.91 0.00 1.70 0.00 0.00 1.82 0.00 0.00 2.95 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.54 1.47 7.81 50 A 8.07 4.00 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 51 L 7.49 3.89 0.00 2.05 1.73 0.99 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 52 V 7.74 3.57 2.19 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 0.96 0.00 0.00 0.99 0.00 0.00 53 Q 8.66 3.93 0.00 2.32 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.61 0.00 0.00 0.00 0.00 0.00 2.36 2.42 0.00 54 A 7.76 4.01 1.42 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 0.00 0.00 0.00 0.00 0.00 0.00 55 V 7.95 3.80 2.20 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 1.19 0.00 0.00 1.08 0.00 0.00 56 E 8.31 3.95 0.00 2.26 2.05 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 2.31 2.37 0.00 57 E 7.83 3.91 0.00 2.11 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 2.33 2.52 0.00 58 E 7.71 3.90 0.00 1.71 1.24 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 1.80 1.82 0.00 59 G 7.80 3.87 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 0.00 0.00 0.00 60 Y 7.19 4.82 0.00 2.89 2.78 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 61 K 8.71 4.86 0.00 1.86 1.69 0.00 1.72 0.00 0.00 1.67 0.00 0.00 2.84 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.38 1.41 7.81 62 A 8.32 5.08 1.24 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 0.00 0.00 0.00 63 E 8.83 4.70 0.00 2.09 1.76 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 2.22 2.30 0.00 64 V 8.49 4.14 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 0.68 0.00 0.00 0.98 0.00 0.00 65 L 8.66 4.61 0.00 1.72 1.55 0.92 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 66 A 8.37 4.22 1.24 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 0.00 0.00 0.00