NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.8495 8.3544 109.7369 45.2700 0.0000 173.8977 2 S 4.2282 7.7690 112.9488 55.8080 63.8746 168.8064 3 S 3.6704 8.6490 122.5939 57.8905 60.4778 170.7898 4 S 4.1759 8.5410 121.2258 59.5359 62.5498 174.3786 5 C 4.9797 7.6242 119.2836 54.7832 41.6014 172.9806 6 P 3.8998 0.0000 0.0000 64.7644 31.4991 177.6172 7 Q 3.6595 7.7257 117.7726 57.8591 28.7492 176.3956 8 F 4.8410 7.2867 115.8205 55.2425 42.2953 172.8879 9 P 4.5619 0.0000 0.0000 63.4454 31.7874 176.8057 10 S 4.6000 7.8737 113.8214 58.1877 63.2301 174.1610 11 C 4.2368 8.1594 121.3751 56.3983 43.3117 173.2443 12 S 4.3044 8.6953 122.2613 57.7679 62.7603 173.0105 13 P 4.2388 0.0000 0.0000 65.9500 30.9746 178.6238 14 S 4.1093 7.9759 113.0817 61.2720 62.9800 174.3279 15 C 4.5679 8.3295 115.9541 56.4738 40.0008 172.8930 16 A 4.9954 7.4894 122.1451 49.9113 21.1000 174.2952 17 P 4.8380 0.0000 0.0000 62.5852 31.7187 177.7011 18 Q 3.8869 8.3073 119.5424 58.4722 28.3759 177.4324 19 C 4.4075 7.7664 114.0251 58.3937 34.4746 173.8052 20 S 4.9468 7.5854 113.4169 56.2803 65.8883 173.5455 21 Q 2.6293 8.7553 126.3344 58.8936 28.4016 178.4937 22 Q 4.6885 7.8105 119.1294 58.5780 28.8615 179.2279 23 C 4.3318 7.7675 117.0071 59.8758 44.0407 175.8121 24 C 4.1958 7.6552 116.7155 59.9056 39.7250 173.6355 25 Q 4.1469 8.0800 120.0068 55.9386 30.2457 175.3416 26 Q 4.5187 7.9009 112.8898 54.1754 33.7591 173.0051 27 P 4.3843 0.0000 0.0000 63.2792 31.2764 176.2939 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 G 8.35 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 0.00 0.00 0.00 2 S 7.77 4.23 0.00 3.92 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 3 S 8.65 3.67 0.00 4.15 3.89 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 4 S 8.54 4.18 0.00 3.89 3.89 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 5 C 7.62 4.98 0.00 3.28 3.10 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 3.90 0.00 2.11 2.14 0.00 3.75 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 1.95 0.00 7 Q 7.73 3.66 0.00 0.93 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.68 0.00 0.00 0.00 0.00 0.00 2.19 2.13 0.00 8 F 7.29 4.84 0.00 3.02 2.90 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 9 P 0.00 4.56 0.00 2.20 2.18 0.00 3.43 0.00 0.00 4.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.96 0.00 10 S 7.87 4.60 0.00 3.89 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 11 C 8.16 4.24 0.00 3.04 3.09 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 0.00 0.00 0.00 12 S 8.70 4.30 0.00 3.88 3.71 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 0.00 0.00 0.00 0.00 13 P 0.00 4.24 0.00 2.25 2.33 0.00 3.75 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 2.08 1.99 0.00 14 S 7.98 4.11 0.00 4.02 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 15 C 8.33 4.57 0.00 2.92 3.12 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 16 A 7.49 5.00 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 17 P 0.00 4.84 0.00 2.24 2.27 0.00 3.74 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 1.95 0.00 18 Q 8.31 3.89 0.00 2.19 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.12 6.90 0.00 0.00 0.00 0.00 0.00 2.60 2.53 0.00 19 C 7.77 4.41 0.00 3.24 3.34 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 0.00 20 S 7.59 4.95 0.00 3.98 3.96 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 8.76 2.63 0.00 2.33 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.89 0.00 0.00 0.00 0.00 0.00 2.27 2.58 0.00 22 Q 7.81 4.69 0.00 1.99 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.04 6.82 0.00 0.00 0.00 0.00 0.00 2.34 2.22 0.00 23 C 7.77 4.33 0.00 2.94 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 24 C 7.66 4.20 0.00 2.37 2.97 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 8.08 4.15 0.00 1.79 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.52 6.68 0.00 0.00 0.00 0.00 0.00 2.28 2.48 0.00 26 Q 7.90 4.52 0.00 2.10 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.87 6.73 0.00 0.00 0.00 0.00 0.00 2.23 2.23 0.00 27 P 0.00 4.38 0.00 2.16 2.02 0.00 3.77 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 1.94 0.00