NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 L 4.7628 8.0848 122.5660 55.1553 43.4135 175.7234 2 E 4.7847 8.8872 124.1624 54.5985 33.0409 173.8623 3 C 5.2713 9.5487 118.9289 55.2082 45.5147 173.2325 4 H 5.5557 9.6383 118.2402 55.7750 28.7283 175.4343 5 N 5.8320 8.8844 115.7724 51.1091 38.8297 174.5387 6 Q 4.2302 8.1175 117.5254 56.1044 29.9559 175.4237 7 Q 4.5983 8.3869 117.9394 56.1803 31.1966 177.4308 8 S 3.3283 7.9353 117.9107 60.5078 62.5203 173.6027 9 S 4.6119 8.6345 124.2395 59.2768 62.4366 173.8655 10 Q 4.2315 7.8090 120.0760 54.6684 29.0488 174.4138 11 P 4.3231 0.0000 0.0000 62.1151 31.8728 175.0548 12 P 4.5334 0.0000 0.0000 62.9126 32.1444 175.7541 13 T 4.9657 8.2232 111.2859 60.5339 72.7510 172.3804 14 T 5.2934 8.1950 111.6781 60.6209 72.6111 172.5672 15 K 4.6075 8.8536 119.7623 55.6118 35.6852 175.3705 16 T 4.8196 8.5064 121.1846 62.0148 69.6174 176.2895 17 C 4.7388 8.6443 129.6594 56.8238 34.6092 174.2414 18 S 4.2712 8.6708 122.2784 58.7478 62.7989 171.8940 19 P 4.4145 0.0000 0.0000 64.3729 31.5982 174.6554 20 G 4.1760 9.0168 110.5287 45.7242 0.0000 173.8483 21 E 4.1403 8.0155 120.3168 56.1341 30.2035 176.8966 22 T 4.6354 8.5206 113.0852 61.0426 70.3354 172.7371 23 N 5.5476 8.1670 119.8472 51.9459 42.3738 173.6045 24 C 5.3007 9.0314 120.6719 58.2591 31.9863 171.8779 25 Y 5.3728 8.6809 116.7311 55.5319 41.6543 174.4293 26 K 5.0849 9.3274 121.4791 54.7289 35.6564 174.8939 27 K 5.1858 9.3970 128.3780 54.9386 35.7653 174.7868 28 V 5.0694 9.1912 127.7623 60.9764 34.6529 174.3072 29 W 5.4713 8.5530 123.3980 55.6582 32.2531 172.8655 30 R 5.0819 8.7818 119.8405 54.8711 32.2078 174.4141 31 D 4.8381 8.7667 124.1474 52.5113 42.1261 175.1048 32 H 4.2397 9.0399 113.1451 58.9873 28.4091 176.5432 33 R 3.9810 7.9528 118.3780 56.7647 30.9287 175.5090 34 G 3.8167 7.3374 103.7776 44.4003 0.0000 172.2300 35 T 4.6197 8.2978 118.8101 62.6197 69.9111 174.5524 36 I 4.1710 7.9976 127.2130 59.2160 40.1575 174.5540 37 I 4.8995 8.2099 126.6932 59.3785 40.1923 174.0607 38 E 5.0883 9.4352 128.0902 54.4679 32.6866 174.7677 39 R 4.6540 8.1303 123.7451 54.6524 34.6050 175.0577 40 G 4.0314 6.5789 107.0663 46.8370 0.0000 172.2558 41 C 4.8295 9.0448 118.0879 60.2343 29.4468 174.7529 42 G 4.0061 11.3000 110.5625 45.1130 0.0000 171.9021 43 C 4.5395 8.1486 119.4353 55.1688 45.1324 172.7928 44 P 4.5280 0.0000 0.0000 61.5671 32.2197 175.9034 45 T 4.0210 7.9318 108.5687 61.0750 69.2734 174.3879 46 V 3.7295 8.1481 123.1589 62.9272 32.2121 175.5641 47 K 4.6708 8.2501 125.1528 53.6278 35.6379 173.9839 48 P 4.3100 0.0000 0.0000 63.9712 31.7457 177.1928 49 G 4.0393 9.1592 110.2584 45.0819 0.0000 173.0469 50 I 4.8680 7.2438 120.0479 59.2698 40.3202 174.8560 51 K 4.4597 9.2520 128.8642 55.1244 33.4277 174.7860 52 L 5.3544 8.6167 129.1731 53.3697 44.8179 175.0153 53 N 5.2123 9.4260 122.4370 51.6726 42.5005 172.6317 54 C 5.6101 8.7854 119.7670 55.6803 42.3676 172.2694 55 C 4.8181 8.6785 116.4419 55.1851 43.1129 174.3334 56 T 5.4322 8.8970 107.1154 60.7175 70.3454 172.7166 57 T 4.7486 7.2854 114.2835 60.6859 69.7497 173.1378 58 D 4.6718 8.8681 119.2586 56.2628 41.1563 176.8583 59 K 3.9819 8.9293 124.2925 57.6352 30.1359 173.5270 60 C 4.6709 8.0760 109.4841 55.9070 41.7808 173.9668 61 N 4.7441 7.8169 116.8883 52.6042 36.7725 174.2381 62 N 4.3740 7.9867 120.4990 54.7055 39.0664 174.0780 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 L 8.08 4.76 0.00 1.66 1.64 0.98 0.66 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 2 E 8.89 4.78 0.00 2.03 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 2.27 2.55 0.00 3 C 9.55 5.27 0.00 2.76 3.01 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 0.00 4 H 9.64 5.56 0.00 3.19 3.18 0.00 5.75 0.00 0.00 0.00 0.00 6.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5 N 8.88 5.83 0.00 2.64 2.81 0.00 0.00 6.43 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6 Q 8.12 4.23 0.00 2.17 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.93 6.93 0.00 0.00 0.00 0.00 0.00 2.28 2.61 0.00 7 Q 8.39 4.60 0.00 2.10 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.95 5.91 0.00 0.00 0.00 0.00 0.00 2.42 2.37 0.00 8 S 7.94 3.33 0.00 3.88 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 9 S 8.63 4.61 0.00 3.81 3.83 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 0.00 0.00 0.00 10 Q 7.81 4.23 0.00 2.09 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.41 6.81 0.00 0.00 0.00 0.00 0.00 2.53 2.45 0.00 11 P 0.00 4.32 0.00 2.02 1.98 0.00 3.66 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.10 0.00 12 P 0.00 4.53 0.00 2.02 1.83 0.00 3.59 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.99 0.00 13 T 8.22 4.97 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 1.25 0.00 0.00 14 T 8.20 5.29 4.18 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 0.00 0.00 1.07 0.00 0.00 15 K 8.85 4.61 0.00 1.80 1.89 0.00 1.30 0.00 0.00 1.64 0.00 0.00 2.84 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.28 1.39 7.81 16 T 8.51 4.82 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 1.31 0.00 0.00 17 C 8.64 4.74 0.00 2.97 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 18 S 8.67 4.27 0.00 3.89 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 P 0.00 4.41 0.00 2.04 2.01 0.00 3.65 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 2.03 2.10 0.00 20 G 9.02 4.18 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 0.00 0.00 0.00 0.00 0.00 0.00 21 E 8.02 4.14 0.00 2.16 1.92 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 2.33 2.45 0.00 22 T 8.52 4.64 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 1.28 0.00 0.00 23 N 8.17 5.55 0.00 2.67 2.88 0.00 0.00 6.98 7.66 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 24 C 9.03 5.30 0.00 2.83 2.88 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 25 Y 8.68 5.37 0.00 3.03 3.24 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 26 K 9.33 5.08 0.00 1.78 1.69 0.00 1.57 0.00 0.00 1.57 0.00 0.00 2.82 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.37 1.38 7.81 27 K 9.40 5.19 0.00 2.11 2.12 0.00 1.56 0.00 0.00 1.65 0.00 0.00 2.32 0.00 0.00 2.58 0.00 0.00 0.00 0.00 1.80 1.54 7.81 28 V 9.19 5.07 2.14 0.00 0.00 0.00 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 29 W 8.55 5.47 0.00 3.53 3.25 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 30 R 8.78 5.08 0.00 1.83 1.85 0.00 3.18 0.00 0.00 3.29 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.53 0.00 31 D 8.77 4.84 0.00 3.04 3.03 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 0.00 0.00 0.00 32 H 9.04 4.24 0.00 3.29 3.53 0.00 5.72 0.00 0.00 0.00 0.00 7.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 R 7.95 3.98 0.00 1.81 1.94 0.00 3.11 0.00 0.00 3.22 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.23 0.00 34 G 7.34 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 T 8.30 4.62 4.13 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 1.08 0.00 0.00 36 I 8.00 4.17 0.56 0.00 0.00 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.64 0.86 0.37 0.00 0.00 37 I 8.21 4.90 1.88 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 1.03 0.70 0.90 0.00 0.00 38 E 9.44 5.09 0.00 2.27 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 0.00 2.67 2.48 0.00 39 R 8.13 4.65 0.00 1.75 1.71 0.00 3.31 0.00 0.00 3.45 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.55 0.00 40 G 6.58 4.03 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 0.00 0.00 0.00 0.00 0.00 0.00 41 C 9.04 4.83 0.00 3.05 3.06 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 0.00 0.00 0.00 42 G 11.30 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 0.00 0.00 0.00 0.00 43 C 8.15 4.54 0.00 3.05 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 44 P 0.00 4.53 0.00 2.06 1.81 0.00 3.67 0.00 0.00 3.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.49 0.00 45 T 7.93 4.02 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 1.18 0.00 0.00 46 V 8.15 3.73 2.07 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 0.82 0.00 0.00 0.93 0.00 0.00 47 K 8.25 4.67 0.00 1.70 1.56 0.00 1.69 0.00 0.00 1.76 0.00 0.00 2.83 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.52 1.26 7.81 48 P 0.00 4.31 0.00 2.03 1.98 0.00 3.66 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.07 0.00 49 G 9.16 4.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 I 7.24 4.87 1.98 0.00 0.00 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.66 1.01 0.00 0.00 51 K 9.25 4.46 0.00 1.86 1.75 0.00 1.60 0.00 0.00 1.61 0.00 0.00 2.83 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.42 1.41 7.81 52 L 8.62 5.35 0.00 1.68 1.52 1.07 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 53 N 9.43 5.21 0.00 2.73 2.68 0.00 0.00 6.61 7.30 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 54 C 8.79 5.61 0.00 2.85 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 55 C 8.68 4.82 0.00 3.00 3.20 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 56 T 8.90 5.43 4.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 57 T 7.29 4.75 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 58 D 8.87 4.67 0.00 2.71 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 59 K 8.93 3.98 0.00 1.78 1.79 0.00 1.63 0.00 0.00 1.71 0.00 0.00 3.04 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.12 1.25 7.81 60 C 8.08 4.67 0.00 3.11 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 N 7.82 4.74 0.00 2.79 2.88 0.00 0.00 6.14 8.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 N 7.99 4.37 0.00 2.67 2.68 0.00 0.00 7.12 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00