NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.9418 8.2127 109.7385 45.3300 0.0000 173.7665 2 I 3.2150 8.4950 118.3312 63.9857 37.6431 173.7055 3 V 3.5098 8.4380 113.9591 64.6143 31.6895 177.4477 4 E 3.9255 8.1976 116.2843 59.9535 29.3985 179.0955 5 Q 4.1772 8.3011 117.9124 58.0654 29.1959 175.7301 6 C 5.1858 7.7437 114.4388 57.0896 42.9365 174.9566 7 C 4.2169 8.1982 118.7468 62.4005 31.2954 174.8401 8 T 4.1857 7.7194 113.1362 65.0010 68.8477 174.5041 9 S 4.6305 7.5280 115.1775 55.9749 65.5550 173.0455 10 I 4.2410 8.0910 118.8205 61.4435 37.9687 173.9153 11 C 5.0071 8.1084 113.5763 53.3929 43.2443 174.2697 12 S 4.6081 8.8047 117.2508 57.3883 65.6160 175.5424 13 L 4.0319 8.0121 122.3897 58.0117 41.1037 179.4537 14 Y 4.3102 7.3683 115.8153 61.2291 38.1879 177.9326 15 Q 4.3577 8.4750 119.1335 59.0349 28.8444 178.8306 16 L 4.3419 8.1944 119.9710 57.7956 41.6726 179.2808 17 E 4.1178 8.2322 118.4406 59.1948 29.0936 178.8873 18 N 4.3261 8.0027 115.6544 55.2969 38.4454 175.2452 19 Y 4.5915 7.3940 116.3698 57.7662 38.2340 175.5598 20 C 4.4731 7.6234 117.6497 59.3415 29.0429 173.6121 21 N 4.5459 8.5911 118.4201 53.7432 38.2245 175.2908 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 8.21 3.94 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 0.00 0.00 0.00 0.00 0.00 0.00 2 I 8.49 3.22 0.95 0.00 0.00 0.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.85 0.68 0.00 0.00 3 V 8.44 3.51 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.81 0.00 0.00 0.90 0.00 0.00 4 E 8.20 3.93 0.00 2.14 2.06 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 2.34 2.46 0.00 5 Q 8.30 4.18 0.00 2.18 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.74 0.00 0.00 0.00 0.00 0.00 2.46 2.48 0.00 6 C 7.74 5.19 0.00 2.95 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 7 C 8.20 4.22 0.00 2.92 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 8 T 7.72 4.19 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 9 S 7.53 4.63 0.00 3.79 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 10 I 8.09 4.24 1.86 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.71 0.90 0.00 0.00 11 C 8.11 5.01 0.00 3.20 3.31 0.00 0.00 0.00 0.00 0.00 0.00 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 8.80 4.61 0.00 3.79 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 13 L 8.01 4.03 0.00 1.52 1.73 0.89 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 14 Y 7.37 4.31 0.00 2.95 2.87 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 0.00 0.00 0.00 0.00 15 Q 8.47 4.36 0.00 2.32 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.79 0.00 0.00 0.00 0.00 0.00 2.45 2.50 0.00 16 L 8.19 4.34 0.00 1.97 1.82 0.93 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 17 E 8.23 4.12 0.00 2.29 2.03 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 2.40 2.60 0.00 18 N 8.00 4.33 0.00 2.13 2.30 0.00 0.00 6.92 7.08 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 19 Y 7.39 4.59 0.00 3.03 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 20 C 7.62 4.47 0.00 2.99 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 21 N 8.59 4.55 0.00 2.73 2.74 0.00 0.00 6.81 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