NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4702 8.3049 118.7930 54.3455 33.0592 174.0948 2 E 4.6555 8.1368 118.1860 53.2623 32.8957 173.1830 3 P 4.0813 0.0000 0.0000 62.6880 32.9021 174.9547 4 N 4.7890 8.4170 120.2126 51.0820 39.5155 172.0768 5 P 4.0420 0.0000 0.0000 64.6000 31.8411 175.1419 6 N 4.0269 7.9852 125.0793 54.9093 38.8231 175.1290 7 R 4.5694 7.8132 121.6730 56.3135 31.5902 173.2343 8 Q 4.5383 8.4213 124.2373 53.6226 31.2170 173.4718 9 P 4.7008 0.0000 0.0000 61.6068 32.8898 175.5605 10 V 4.3885 7.8582 118.9352 61.5547 33.5419 174.3935 11 E 4.6140 8.0804 122.6833 55.0430 32.4551 174.7475 12 L 4.1030 7.9768 123.9174 53.2599 43.8256 174.9562 13 N 4.6963 8.4322 124.9302 51.7776 39.9348 175.8130 14 R 3.6542 8.4345 119.3795 59.9313 30.0789 179.0288 15 T 4.0269 8.0040 114.4788 67.0033 68.4177 176.4825 16 S 4.0891 8.0253 116.1713 61.4704 62.9427 175.9531 17 L 3.8387 7.9750 123.2164 58.7077 41.6862 178.5975 18 Y 4.4333 8.1904 116.4102 61.4140 37.8779 178.9949 19 L 4.2695 8.8340 119.8903 57.1838 41.6137 179.8884 20 G 3.5044 8.4084 106.6388 47.8748 0.0000 175.6509 21 L 4.0754 8.0312 122.4121 57.3480 41.6367 179.7055 22 L 3.9782 8.0541 120.0661 57.9791 41.9968 178.7889 23 L 3.9659 7.8477 120.2944 58.3302 42.0051 178.7422 24 I 3.7070 8.3710 120.0025 64.4725 37.1016 178.1772 25 L 3.9839 8.1283 119.5327 58.0900 41.5460 180.1142 26 V 3.6239 7.9191 117.9300 66.0201 31.4728 178.0713 27 L 4.1479 8.3151 118.7554 57.8439 41.4320 179.4290 28 A 4.0434 8.2631 120.9674 54.8469 18.1311 179.3844 29 L 4.0236 7.7863 118.2067 57.7681 42.1632 178.7096 30 L 4.0661 7.8012 120.0414 58.2410 42.5327 178.6724 31 F 4.0698 8.6545 117.7873 59.5943 38.8444 177.7859 32 S 4.0082 7.9162 114.5087 61.8700 62.4421 176.9491 33 S 4.2270 8.0201 117.8447 61.0094 62.3681 175.2499 34 Y 4.4274 7.6433 117.1529 58.9246 38.0190 177.0148 35 F 4.9327 7.8760 118.2508 60.1420 39.7139 177.5135 36 F 4.3612 8.3252 116.4390 58.3446 38.8041 175.0424 37 N 4.5344 8.0627 120.7419 54.0640 40.3906 173.3394 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 4.47 0.00 2.05 1.92 0.00 0.00 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.42 2.14 0.00 2 E 8.14 4.66 0.00 1.98 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 2.34 0.00 3 P 0.00 4.08 0.00 2.03 2.01 0.00 3.65 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.12 0.00 4 N 8.42 4.79 0.00 2.66 2.70 0.00 0.00 7.07 7.69 0.00 0.00 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 P 0.00 4.04 0.00 2.08 1.93 0.00 3.76 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.11 0.00 6 N 7.99 4.03 0.00 2.70 2.83 0.00 0.00 6.68 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 7 R 7.81 4.57 0.00 1.95 1.83 0.00 3.25 0.00 0.00 3.22 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 1.50 0.00 8 Q 8.42 4.54 0.00 2.04 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.85 6.68 0.00 0.00 0.00 0.00 0.00 2.27 2.41 0.00 9 P 0.00 4.70 0.00 2.03 1.96 0.00 3.64 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 2.05 0.00 10 V 7.86 4.39 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 0.78 0.00 0.00 0.92 0.00 0.00 11 E 8.08 4.61 0.00 1.90 1.73 0.00 0.00 0.00 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 2.28 0.00 12 L 7.98 4.10 0.00 1.57 1.47 0.90 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 13 N 8.43 4.70 0.00 2.95 2.93 0.00 0.00 6.17 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 14 R 8.43 3.65 0.00 1.85 2.02 0.00 3.07 0.00 0.00 3.22 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.69 0.00 15 T 8.00 4.03 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 16 S 8.03 4.09 0.00 4.09 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 17 L 7.98 3.84 0.00 1.55 1.49 0.84 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 18 Y 8.19 4.43 0.00 3.16 2.89 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 0.00 0.00 0.00 0.00 19 L 8.83 4.27 0.00 1.74 1.75 0.95 0.89 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 20 G 8.41 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 21 L 8.03 4.08 0.00 1.80 1.82 0.99 0.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 22 L 8.05 3.98 0.00 1.89 1.84 0.94 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 23 L 7.85 3.97 0.00 1.91 1.80 0.94 1.09 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 24 I 8.37 3.71 1.89 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.70 0.93 0.00 0.00 25 L 8.13 3.98 0.00 1.84 1.76 0.95 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 26 V 7.92 3.62 2.24 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 1.06 0.00 0.00 1.00 0.00 0.00 27 L 8.32 4.15 0.00 1.99 1.77 0.90 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 28 A 8.26 4.04 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.79 4.02 0.00 1.82 1.73 0.94 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 30 L 7.80 4.07 0.00 1.78 1.96 0.85 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 31 F 8.65 4.07 0.00 2.90 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 0.00 0.00 0.00 32 S 7.92 4.01 0.00 4.16 4.36 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 33 S 8.02 4.23 0.00 3.42 3.68 0.00 0.00 0.00 0.00 0.00 0.00 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 Y 7.64 4.43 0.00 3.05 3.08 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 F 7.88 4.93 0.00 2.98 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 36 F 8.33 4.36 0.00 3.11 3.04 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 37 N 8.06 4.53 0.00 2.91 2.83 0.00 0.00 7.06 8.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00