NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 27 M 4.3674 8.3044 118.1943 54.9678 32.5344 174.4024 28 D 4.4004 8.4757 120.9339 53.2966 41.8883 175.4194 29 L 4.2395 8.8806 127.8929 55.6140 42.8578 177.9831 30 A 3.9744 8.2349 121.7413 55.0998 18.2019 177.7002 31 P 4.2177 0.0000 0.0000 65.8619 31.4914 178.8888 32 Q 4.0288 8.0392 116.3782 59.1476 28.6703 178.5972 33 M 4.0555 8.0287 119.7159 58.2865 32.0345 178.5109 34 L 3.9787 7.9620 120.4970 58.2246 42.2453 179.2354 35 R 3.9414 7.9494 118.0520 59.3147 29.8961 178.9217 36 E 4.0050 8.1741 118.2656 59.3465 29.4371 179.3760 37 L 3.9929 8.0224 119.0819 57.9582 41.6912 179.6398 38 Q 4.0649 8.1136 117.9375 58.8391 28.6074 178.5114 39 E 4.0605 8.2379 119.8000 59.3315 29.4184 179.4332 40 T 3.8703 8.1296 116.3969 66.7000 68.5202 176.4218 41 N 4.3179 8.2258 118.1785 56.1827 38.6421 177.3404 42 A 3.9687 8.1215 121.9377 55.1873 18.4975 179.5619 43 A 3.9780 8.0345 119.2835 55.3148 18.4252 179.8327 44 L 4.0708 8.0999 117.3894 57.6649 41.4490 179.5857 45 Q 4.0827 8.1789 118.2606 58.6999 28.7090 178.2690 46 D 4.3609 7.9148 119.8678 57.1013 40.8028 178.7851 47 V 3.6060 7.7392 118.8584 66.1229 31.5132 178.3032 48 R 3.8995 7.9906 117.8025 59.3057 30.0148 178.7040 49 E 3.9932 8.0010 118.8119 58.8040 29.5838 178.9763 50 L 3.9868 7.7235 118.9977 57.7214 41.7166 179.2117 51 L 4.0213 8.0998 119.1133 57.7552 41.0143 179.5424 52 R 3.8684 8.1170 118.6415 59.5835 30.0362 178.4323 53 Q 3.9867 8.0409 119.0810 58.9784 29.0180 177.7470 54 Q 3.9475 8.5214 121.1427 59.2052 29.0662 178.4468 55 V 3.6130 8.1275 119.5536 66.0345 31.5535 178.1441 56 K 4.0266 7.7917 117.3745 59.5141 31.7989 179.2500 57 E 4.0386 8.3055 118.9402 59.5138 29.4167 179.4839 58 I 3.8638 7.9145 119.9170 64.4374 37.0569 178.6988 59 T 3.9175 8.2227 116.9925 66.3820 68.1982 176.4925 60 F 3.8926 8.2212 122.5847 61.3005 39.4325 176.8589 61 L 4.0222 8.4980 120.3305 57.9558 41.7603 178.9349 62 K 3.8902 8.0779 119.4866 59.7198 32.0339 178.5174 63 N 4.2187 7.9660 115.3652 56.5892 38.7185 177.2201 64 T 3.8434 7.8778 117.2617 66.6853 68.5885 176.9284 65 V 3.6474 7.8652 120.0440 66.0918 31.2685 177.9582 66 M 4.1751 8.0060 117.8814 57.3684 31.6987 177.4165 67 E 4.7873 7.3718 116.3505 55.1974 30.3010 175.7733 68 C 4.3261 7.8393 121.5595 58.4179 30.6488 173.4863 69 D 4.1390 8.8448 128.0306 57.5527 40.4772 178.4803 70 A 4.2224 7.9357 118.9176 53.6125 19.1785 177.2780 71 C 4.7182 8.9238 116.6416 60.3799 29.6472 174.1920 72 G 3.7159 8.5825 111.2176 47.5404 0.0000 172.1091 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 27 M 8.30 4.37 0.00 2.14 2.14 0.00 0.00 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.46 2.48 0.00 28 D 8.48 4.40 0.00 2.72 2.62 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 29 L 8.88 4.24 0.00 1.77 1.68 0.97 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 30 A 8.23 3.97 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 31 P 0.00 4.22 0.00 2.17 2.11 0.00 3.68 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.18 0.00 32 Q 8.04 4.03 0.00 2.23 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.91 0.00 0.00 0.00 0.00 0.00 2.45 2.45 0.00 33 M 8.03 4.06 0.00 2.09 2.25 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.84 2.54 0.00 34 L 7.96 3.98 0.00 1.77 1.85 0.92 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 35 R 7.95 3.94 0.00 2.08 1.96 0.00 3.51 0.00 0.00 3.17 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.82 0.00 36 E 8.17 4.01 0.00 2.18 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 2.55 2.49 0.00 37 L 8.02 3.99 0.00 1.85 1.71 0.92 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 38 Q 8.11 4.06 0.00 2.25 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.81 0.00 0.00 0.00 0.00 0.00 2.38 2.63 0.00 39 E 8.24 4.06 0.00 2.13 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 2.49 2.49 0.00 40 T 8.13 3.87 4.43 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 1.21 0.00 0.00 41 N 8.23 4.32 0.00 2.88 2.86 0.00 0.00 6.95 7.18 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 42 A 8.12 3.97 1.35 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 0.00 0.00 43 A 8.03 3.98 1.41 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 0.00 0.00 44 L 8.10 4.07 0.00 1.91 1.72 0.92 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 45 Q 8.18 4.08 0.00 2.30 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.82 0.00 0.00 0.00 0.00 0.00 2.38 2.44 0.00 46 D 7.91 4.36 0.00 2.87 2.70 0.00 0.00 0.00 0.00 0.00 0.00 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 V 7.74 3.61 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 1.11 0.00 0.00 0.99 0.00 0.00 48 R 7.99 3.90 0.00 2.07 1.96 0.00 3.18 0.00 0.00 3.24 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.74 0.00 49 E 8.00 3.99 0.00 2.21 1.94 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 2.30 2.39 0.00 50 L 7.72 3.99 0.00 2.12 1.69 0.92 0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 51 L 8.10 4.02 0.00 1.80 1.72 0.92 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 52 R 8.12 3.87 0.00 2.13 1.92 0.00 3.09 0.00 0.00 3.10 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.64 0.00 53 Q 8.04 3.99 0.00 2.29 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.58 0.00 0.00 0.00 0.00 0.00 2.34 2.35 0.00 54 Q 8.52 3.95 0.00 2.23 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.57 0.00 0.00 0.00 0.00 0.00 2.37 2.38 0.00 55 V 8.13 3.61 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 0.99 0.00 0.00 0.96 0.00 0.00 56 K 7.79 4.03 0.00 2.10 1.87 0.00 1.63 0.00 0.00 1.67 0.00 0.00 3.05 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.47 1.55 7.81 57 E 8.31 4.04 0.00 2.13 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 2.57 2.48 0.00 58 I 7.91 3.86 1.90 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.94 0.93 0.00 0.00 59 T 8.22 3.92 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 1.22 0.00 0.00 60 F 8.22 3.89 0.00 3.25 3.23 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 61 L 8.50 4.02 0.00 1.93 1.86 0.97 0.51 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 62 K 8.08 3.89 0.00 1.87 1.94 0.00 1.68 0.00 0.00 1.64 0.00 0.00 2.92 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.40 1.46 7.81 63 N 7.97 4.22 0.00 2.47 2.68 0.00 0.00 7.16 7.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 T 7.88 3.84 4.37 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 1.22 0.00 0.00 65 V 7.87 3.65 2.16 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 1.02 0.00 0.00 0.99 0.00 0.00 66 M 8.01 4.18 0.00 1.99 2.25 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.79 2.55 0.00 67 E 7.37 4.79 0.00 1.89 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 2.37 2.35 0.00 68 C 7.84 4.33 0.00 2.96 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 69 D 8.84 4.14 0.00 2.70 2.75 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 70 A 7.94 4.22 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 71 C 8.92 4.72 0.00 3.01 2.84 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 72 G 8.58 3.72 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 0.00 0.00 0.00