NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 T 4.3161 8.1631 117.3743 63.0603 69.7633 173.4627 2 G 3.5027 8.3526 115.0706 44.9615 0.0000 172.7555 3 A 4.1293 8.1187 124.7701 52.9716 21.1474 176.7274 4 G 4.4172 7.0892 112.2573 44.6232 0.0000 176.0334 5 T 3.8826 9.1065 121.3983 65.9253 68.1433 174.0473 6 P 4.2492 0.0000 0.0000 65.7822 30.9618 177.7623 7 S 4.3110 8.0527 113.0267 59.3222 63.4292 175.9274 8 Q 4.1149 8.2326 120.7132 58.2590 28.7302 178.3624 9 G 3.7464 7.4791 105.8471 47.5701 0.0000 174.3776 10 K 4.2580 7.8360 117.5100 57.2939 32.7408 178.2512 11 K 4.4138 7.5700 119.4586 55.7943 29.5091 176.1311 12 N 5.0498 7.9955 117.9944 52.4763 38.3173 175.2191 13 T 4.4661 7.9227 114.3534 63.2476 70.1601 174.2111 14 T 4.4932 8.3117 121.7044 62.2290 69.5620 172.6218 15 T 4.3033 7.5682 115.1412 63.0035 71.3978 173.0392 16 H 4.9112 8.0933 119.1117 55.1734 30.0480 174.7388 17 T 4.8339 9.2369 113.0370 59.0547 72.9920 173.0258 18 K 4.3010 8.7894 123.0341 57.4430 32.7603 175.3406 19 C 4.2802 9.1082 128.5915 58.5566 32.1930 174.3583 20 R 3.7196 8.4698 126.5382 59.1967 30.0686 177.4393 21 R 3.7295 7.3198 116.7872 58.1331 30.2548 176.4702 22 C 4.3954 7.9205 109.2143 57.4269 30.9366 174.6961 23 G 3.9310 8.2152 108.4289 45.1798 0.0000 173.3455 24 E 4.2641 7.6622 119.4251 54.9815 31.0418 176.7458 25 K 4.5780 8.1946 125.3558 56.0999 29.7523 176.5647 26 S 4.7681 7.8114 113.6149 58.0379 66.8820 174.4484 27 Y 4.8224 8.8934 123.8121 57.1353 39.3052 174.2798 28 H 4.5454 8.9624 129.0147 56.1812 30.0406 175.6828 29 T 3.5447 8.7545 122.4422 64.1516 67.0393 175.2115 30 K 4.2646 8.1343 119.3343 58.8367 32.9630 177.9866 31 K 3.9834 7.8527 116.0297 56.6543 32.4823 176.7900 32 K 3.2487 8.5243 118.6019 56.9605 29.9671 175.2858 33 V 4.6251 6.7902 116.0807 61.1734 34.9631 173.0570 34 C 5.0296 9.2716 127.9711 58.3792 31.8952 174.5148 35 S 4.3340 8.8392 122.5323 60.5604 63.1837 175.5687 36 S 4.3974 8.2962 115.5953 60.5407 62.6122 174.2860 37 C 4.5132 8.1326 112.3213 57.3416 30.5873 174.9230 38 G 4.1243 8.6501 109.4425 45.6492 0.0000 173.1346 39 F 4.5671 8.1077 122.6445 59.7585 39.6186 175.8796 40 G 3.7756 8.8106 115.9898 46.0347 0.0000 173.4664 41 K 4.3773 8.3358 119.3351 57.2538 33.6388 176.1965 42 S 4.7198 7.6320 109.6334 56.1694 66.1061 173.6945 43 A 4.1667 8.6741 124.9949 55.1949 18.4555 178.9290 44 K 4.2274 7.7182 113.4055 56.1549 32.8462 176.7907 45 R 4.3080 8.2292 120.9840 55.7247 30.8110 176.5593 46 R 3.7965 8.4244 125.2390 56.8280 30.5066 175.2462 47 D 4.4130 7.4362 123.5187 53.5922 44.4399 173.9705 48 Y 4.5621 8.5819 121.6658 55.9359 41.6990 176.5404 49 E 4.0048 8.6111 122.1835 58.8376 29.8149 178.6652 50 W 4.5754 7.5825 113.5636 57.5826 28.4370 176.7855 51 Q 4.3395 7.5511 117.8210 57.4409 28.2974 175.5087 52 S 4.7320 7.5525 111.3168 56.1537 66.4344 173.9781 53 K 4.1238 8.4830 119.7837 56.1946 32.3733 178.2008 54 A 3.9509 8.8036 125.0482 55.3950 18.3155 178.8150 55 G 4.0152 8.0042 101.8061 45.7956 0.0000 173.4891 56 E 4.2304 8.2893 125.4249 56.4606 30.6456 175.1566 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 8.16 4.32 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 2 G 8.35 3.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.12 4.13 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 4 G 7.09 4.42 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 0.00 5 T 9.11 3.88 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 6 P 0.00 4.25 0.00 2.21 2.31 0.00 3.58 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 2.25 1.99 0.00 7 S 8.05 4.31 0.00 4.13 3.93 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 8 Q 8.23 4.11 0.00 2.21 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 6.81 0.00 0.00 0.00 0.00 0.00 2.58 2.45 0.00 9 G 7.48 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 10 K 7.84 4.26 0.00 1.76 1.87 0.00 1.75 0.00 0.00 1.70 0.00 0.00 2.97 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.41 1.45 7.81 11 K 7.57 4.41 0.00 1.87 1.78 0.00 1.64 0.00 0.00 1.76 0.00 0.00 3.06 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.48 1.38 7.81 12 N 8.00 5.05 0.00 2.77 2.83 0.00 0.00 6.30 7.71 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 13 T 7.92 4.47 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 14 T 8.31 4.49 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 15 T 7.57 4.30 3.60 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 1.13 0.00 0.00 16 H 8.09 4.91 0.00 3.08 3.51 0.00 5.64 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 T 9.24 4.83 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 1.33 0.00 0.00 18 K 8.79 4.30 0.00 1.80 1.81 0.00 1.67 0.00 0.00 1.64 0.00 0.00 2.81 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.42 1.52 7.81 19 C 9.11 4.28 0.00 3.19 2.85 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 20 R 8.47 3.72 0.00 1.60 1.60 0.00 3.23 0.00 0.00 3.14 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.54 0.00 21 R 7.32 3.73 0.00 0.67 1.33 0.00 3.20 0.00 0.00 3.21 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 1.27 0.00 22 C 7.92 4.40 0.00 3.07 2.98 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 23 G 8.22 3.93 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 0.00 0.00 0.00 24 E 7.66 4.26 0.00 1.95 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.39 2.27 0.00 25 K 8.19 4.58 0.00 1.80 1.78 0.00 1.74 0.00 0.00 1.73 0.00 0.00 3.08 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.48 1.52 7.81 26 S 7.81 4.77 0.00 3.87 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 27 Y 8.89 4.82 0.00 3.11 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 28 H 8.96 4.55 0.00 3.12 2.99 0.00 5.66 0.00 0.00 0.00 0.00 6.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 T 8.75 3.54 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 1.19 0.00 0.00 30 K 8.13 4.26 0.00 1.81 1.82 0.00 1.81 0.00 0.00 1.70 0.00 0.00 2.96 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.39 1.43 7.81 31 K 7.85 3.98 0.00 1.53 1.71 0.00 1.63 0.00 0.00 1.56 0.00 0.00 2.55 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.23 0.93 7.81 32 K 8.52 3.25 0.00 1.79 1.86 0.00 1.72 0.00 0.00 1.51 0.00 0.00 2.86 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.28 1.48 7.81 33 V 6.79 4.63 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 1.11 0.00 0.00 0.94 0.00 0.00 34 C 9.27 5.03 0.00 3.41 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 35 S 8.84 4.33 0.00 4.12 4.11 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 36 S 8.30 4.40 0.00 3.91 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 37 C 8.13 4.51 0.00 3.14 3.15 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 0.00 0.00 0.00 0.00 38 G 8.65 4.12 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 39 F 8.11 4.57 0.00 3.07 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 40 G 8.81 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 0.00 0.00 0.00 41 K 8.34 4.38 0.00 1.67 1.99 0.00 1.81 0.00 0.00 1.82 0.00 0.00 2.93 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.38 1.36 7.81 42 S 7.63 4.72 0.00 3.96 3.77 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.67 4.17 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 44 K 7.72 4.23 0.00 1.74 1.72 0.00 1.73 0.00 0.00 1.68 0.00 0.00 2.95 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.43 1.45 7.81 45 R 8.23 4.31 0.00 1.64 1.81 0.00 3.36 0.00 0.00 3.15 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.53 0.00 46 R 8.42 3.80 0.00 1.86 1.93 0.00 3.45 0.00 0.00 3.38 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.61 0.00 47 D 7.44 4.41 0.00 2.49 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 0.00 0.00 0.00 0.00 48 Y 8.58 4.56 0.00 1.43 1.43 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 49 E 8.61 4.00 0.00 2.04 2.03 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 2.39 2.25 0.00 50 W 7.58 4.58 0.00 3.47 3.21 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 0.00 51 Q 7.55 4.34 0.00 2.08 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.72 0.00 0.00 0.00 0.00 0.00 2.24 1.54 0.00 52 S 7.55 4.73 0.00 3.93 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 53 K 8.48 4.12 0.00 1.83 1.80 0.00 1.73 0.00 0.00 1.86 0.00 0.00 2.94 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.56 1.41 7.81 54 A 8.80 3.95 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 55 G 8.00 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 0.00 0.00 0.00 56 E 8.29 4.23 0.00 2.01 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 2.24 2.24 0.00