NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 4 R 4.3893 8.1127 119.6572 56.1522 32.5529 173.4243 5 E 4.6946 8.3500 119.7243 53.2363 32.3886 172.7628 6 C 4.1522 9.6201 127.6788 60.0217 32.4892 173.4619 7 D 4.4110 8.7582 126.2971 55.8252 39.6666 176.0747 8 Y 4.3294 7.0862 118.9853 58.9009 40.9988 176.2341 9 C 4.0115 8.2090 115.4384 59.3956 30.7501 175.8643 10 G 3.8778 8.3548 107.8439 44.8621 0.0000 173.0458 11 T 4.3365 7.5293 110.1001 61.0984 70.9156 173.0639 12 D 4.9911 8.4806 121.5601 54.1114 41.7974 176.8657 13 I 4.1341 8.1381 124.4119 59.8471 37.3055 175.3387 14 E 3.8229 8.9820 128.9753 55.5761 29.5962 174.6223 15 P 4.3112 0.0000 0.0000 64.8101 31.4390 176.2110 16 G 3.9000 10.0565 108.5807 46.0967 0.0000 172.7380 17 T 4.5378 7.3235 113.9596 62.5204 72.7739 174.4928 18 G 4.1590 9.0452 107.7007 45.9064 0.0000 172.6249 19 T 4.8304 8.2805 113.9409 61.7032 72.8973 173.0182 20 M 5.0730 8.7157 123.4800 53.8734 34.5229 174.3583 21 F 4.9348 9.5743 129.7913 56.9535 41.3046 174.4881 22 V 4.2049 7.8464 126.7454 61.6489 32.3074 175.4373 23 H 4.0213 8.6894 126.0521 54.8494 29.5634 176.7168 24 K 3.8660 8.7002 121.7604 59.8000 31.8864 177.8937 25 D 4.3811 7.9840 116.0897 54.5289 39.3075 176.6662 26 G 3.9186 7.7940 105.7179 44.9872 0.0000 174.0511 27 A 4.2105 10.3630 122.1569 52.8037 19.7995 176.6892 28 T 4.9035 8.3273 114.9982 62.1168 72.1391 173.6028 29 T 4.6407 8.9607 123.7391 62.0547 71.2552 173.0343 30 H 5.0163 9.5419 125.3923 55.0301 30.1870 174.6394 31 F 5.2819 9.4931 122.7232 55.9695 41.2264 176.5869 32 C 4.3813 9.0936 116.5569 60.0894 30.4766 173.6997 33 S 4.6531 7.6561 114.0938 56.1101 66.7612 174.9254 34 S 4.6023 8.4412 117.8493 60.5547 62.6939 175.9799 35 K 3.7077 8.0461 122.9122 59.7364 31.8041 178.2549 36 C 4.0835 7.7632 115.4232 62.8468 28.2244 175.6345 37 E 2.7027 7.3338 120.0927 59.3046 28.9395 179.4801 38 N 4.1683 8.4233 116.2943 56.3630 38.4902 177.2630 39 N 4.3609 8.3130 117.8879 56.1356 38.6371 177.2847 40 A 4.2901 8.0729 122.3839 55.5264 18.3199 179.4110 41 D 4.4702 8.0302 116.1950 57.4116 40.9394 178.6116 42 L 4.2189 7.7206 117.6083 55.5525 41.6193 178.1109 43 G 3.9784 8.4450 107.7187 45.4200 0.0000 174.0099 44 R 4.4023 7.5138 118.2341 55.3902 31.3395 175.6160 45 E 4.6701 8.3816 118.7886 54.1495 32.0740 177.0911 46 A 3.4498 8.0573 125.6224 55.3866 18.5537 180.0816 47 R 3.7891 7.7805 113.5418 59.5760 30.1207 177.7734 48 N 4.3843 7.8739 112.3448 54.3260 38.8318 174.8992 49 L 4.4427 7.2341 120.0797 52.6703 41.9563 176.9154 50 E 3.8963 8.8717 124.9263 58.9672 29.4979 178.7258 51 W 4.4644 7.7137 113.5415 57.9525 29.0655 176.5210 52 T 3.9808 7.2198 117.8941 62.8751 68.5729 175.3354 53 D 4.3026 8.7730 125.9007 57.8918 41.1804 177.8638 54 T 3.8742 7.9913 115.0189 66.8523 68.6900 175.2241 55 A 4.0123 7.8333 121.8927 55.2170 18.6430 177.5190 56 R 4.0760 8.3309 118.2907 56.6314 30.0049 176.6349 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 4 R 8.11 4.39 0.00 1.78 1.91 0.00 3.01 0.00 0.00 3.16 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.61 0.00 5 E 8.35 4.69 0.00 1.93 1.75 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 2.18 2.43 0.00 6 C 9.62 4.15 0.00 3.10 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 7 D 8.76 4.41 0.00 2.63 2.64 0.00 0.00 0.00 0.00 0.00 0.00 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 Y 7.09 4.33 0.00 3.01 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 9 C 8.21 4.01 0.00 3.20 3.41 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.35 3.88 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 0.00 0.00 0.00 11 T 7.53 4.34 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 1.34 0.00 0.00 12 D 8.48 4.99 0.00 2.61 2.66 0.00 0.00 0.00 0.00 0.00 0.00 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 I 8.14 4.13 1.91 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.61 0.97 0.00 0.00 14 E 8.98 3.82 0.00 2.06 1.91 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 2.41 2.41 0.00 15 P 0.00 4.31 0.00 2.23 2.08 0.00 3.86 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.00 0.00 16 G 10.06 3.90 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 0.00 0.00 0.00 0.00 0.00 0.00 17 T 7.32 4.54 4.59 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 1.25 0.00 0.00 18 G 9.05 4.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 T 8.28 4.83 4.52 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 1.29 0.00 0.00 20 M 8.72 5.07 0.00 1.96 1.79 0.00 0.00 0.00 0.00 0.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.40 0.00 21 F 9.57 4.93 0.00 3.32 3.22 0.00 0.00 0.00 0.00 0.00 0.00 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 V 7.85 4.20 1.89 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 0.73 0.00 0.00 0.85 0.00 0.00 23 H 8.69 4.02 0.00 3.25 3.18 0.00 5.68 0.00 0.00 0.00 0.00 6.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 K 8.70 3.87 0.00 1.74 1.86 0.00 1.81 0.00 0.00 1.78 0.00 0.00 3.03 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.43 1.44 7.81 25 D 7.98 4.38 0.00 2.81 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 26 G 7.79 3.92 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 0.00 0.00 0.00 27 A 10.36 4.21 1.20 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 28 T 8.33 4.90 4.25 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 1.21 0.00 0.00 29 T 8.96 4.64 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 0.61 0.00 0.00 30 H 9.54 5.02 0.00 3.07 3.25 0.00 5.77 0.00 0.00 0.00 0.00 6.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31 F 9.49 5.28 0.00 3.01 3.07 0.00 0.00 0.00 0.00 0.00 0.00 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 C 9.09 4.38 0.00 3.16 3.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 S 7.66 4.65 0.00 4.03 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 34 S 8.44 4.60 0.00 3.96 4.08 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 0.00 0.00 0.00 0.00 35 K 8.05 3.71 0.00 1.75 1.85 0.00 1.43 0.00 0.00 1.44 0.00 0.00 2.13 0.00 0.00 2.47 0.00 0.00 0.00 0.00 1.43 1.38 7.81 36 C 7.76 4.08 0.00 3.23 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.33 2.70 0.00 1.61 1.18 0.00 0.00 0.00 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 2.21 0.00 38 N 8.42 4.17 0.00 2.71 2.77 0.00 0.00 7.09 7.19 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 39 N 8.31 4.36 0.00 3.04 3.11 0.00 0.00 6.95 7.91 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 40 A 8.07 4.29 1.23 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 0.00 0.00 0.00 41 D 8.03 4.47 0.00 2.69 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 42 L 7.72 4.22 0.00 1.92 1.76 0.94 0.84 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 43 G 8.44 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 0.00 0.00 0.00 44 R 7.51 4.40 0.00 2.07 1.98 0.00 3.24 0.00 0.00 3.37 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.67 0.00 45 E 8.38 4.67 0.00 1.93 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 2.32 2.27 0.00 46 A 8.06 3.45 0.62 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 0.00 0.00 47 R 7.78 3.79 0.00 1.73 1.91 0.00 3.15 0.00 0.00 3.17 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.56 0.00 48 N 7.87 4.38 0.00 2.71 2.85 0.00 0.00 7.01 7.87 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 49 L 7.23 4.44 0.00 0.93 0.94 1.10 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 50 E 8.87 3.90 0.00 2.02 2.09 0.00 0.00 0.00 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 2.32 0.00 51 W 7.71 4.46 0.00 3.58 3.22 0.00 0.00 0.00 0.00 0.00 0.00 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 T 7.22 3.98 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 0.99 0.00 0.00 53 D 8.77 4.30 0.00 2.81 2.72 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 0.00 0.00 0.00 0.00 54 T 7.99 3.87 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 1.04 0.00 0.00 55 A 7.83 4.01 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 56 R 8.33 4.08 0.00 1.86 1.85 0.00 3.22 0.00 0.00 3.28 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.78 0.00