NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 4.0579 8.1600 109.1413 45.1776 0.0000 174.6506 2 I 3.2100 8.0456 120.8103 62.8193 37.8369 173.2375 3 V 3.5504 8.3930 120.1196 65.9183 31.3687 177.3404 4 E 3.9882 8.0318 118.0018 59.3256 29.2185 178.7386 5 Q 4.1574 7.9723 118.5132 57.9098 29.2737 175.5924 6 C 5.1510 7.9945 113.2913 55.7675 41.5817 173.9622 7 C 4.4813 7.9437 116.0478 59.8841 28.5348 174.1450 8 T 4.4341 7.9888 115.4477 64.0718 70.3077 174.2892 9 S 4.8492 7.6296 114.3082 56.0639 65.4647 173.0734 10 I 4.1048 8.1168 123.1050 61.2883 37.5980 176.2533 11 C 4.8785 8.5982 123.0890 55.6891 41.1868 174.5139 12 S 4.4837 8.8230 120.0044 58.1657 64.4644 175.5049 13 L 4.0833 8.4919 122.1283 58.0374 41.0785 179.1902 14 Y 3.9960 8.0208 118.6118 60.5700 38.9782 177.2924 15 Q 4.1254 8.2313 118.7911 58.8606 28.8386 178.5246 16 L 4.2171 8.1250 120.1030 57.8118 41.6427 179.1440 17 E 3.9342 7.9221 119.0749 59.0876 29.2332 178.3880 18 N 4.0982 7.4334 116.0041 55.8818 38.5198 175.6694 19 Y 4.4521 7.4482 115.5130 57.1917 38.5839 175.4908 20 C 4.4647 7.3986 118.3314 59.0327 29.1971 173.5354 21 N 4.5230 8.5888 118.4060 53.7725 38.1132 175.2172 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 8.16 4.06 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 0.00 0.00 0.00 2 I 8.05 3.21 0.88 0.00 0.00 0.32 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 0.38 0.67 0.00 0.00 3 V 8.39 3.55 2.04 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 0.99 0.00 0.00 0.87 0.00 0.00 4 E 8.03 3.99 0.00 2.25 1.98 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 2.40 2.42 0.00 5 Q 7.97 4.16 0.00 2.33 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.78 0.00 0.00 0.00 0.00 0.00 2.47 2.49 0.00 6 C 7.99 5.15 0.00 3.00 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 7 C 7.94 4.48 0.00 3.13 2.93 0.00 0.00 0.00 0.00 0.00 0.00 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 7.99 4.43 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 7.63 4.85 0.00 3.98 3.95 0.00 0.00 0.00 0.00 0.00 0.00 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 8.12 4.10 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 1.42 0.54 0.93 0.00 0.00 11 C 8.60 4.88 0.00 2.98 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 12 S 8.82 4.48 0.00 4.14 4.06 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 13 L 8.49 4.08 0.00 1.77 1.81 0.95 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 14 Y 8.02 4.00 0.00 3.00 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 15 Q 8.23 4.13 0.00 2.45 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.57 0.00 0.00 0.00 0.00 0.00 2.48 2.57 0.00 16 L 8.12 4.22 0.00 1.90 1.78 0.94 0.64 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 17 E 7.92 3.93 0.00 2.06 1.81 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 2.19 2.30 0.00 18 N 7.43 4.10 0.00 2.32 2.36 0.00 0.00 6.97 7.34 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 19 Y 7.45 4.45 0.00 3.09 2.99 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 20 C 7.40 4.46 0.00 2.95 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 21 N 8.59 4.52 0.00 2.71 2.73 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