NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 I 3.9950 7.9829 118.5494 59.9734 38.3026 178.1710 3 V 3.5367 7.7456 121.2282 65.7372 31.3825 177.8288 4 E 4.3520 8.4478 118.5388 61.5192 30.1303 179.5090 5 Q 4.4688 8.0105 119.2929 59.7083 28.0529 183.5125 6 C 4.4992 8.4205 119.8350 60.1993 40.9419 175.2851 7 C 4.1957 7.8165 118.4979 62.9160 31.4987 174.7431 8 T 4.0453 7.9059 114.9156 66.3872 69.0738 175.0633 9 S 4.8151 7.3457 120.3152 57.6943 61.0901 174.4621 10 I 4.6350 8.1763 111.5753 59.0283 40.0332 173.0251 11 C 5.6174 8.9086 116.7889 52.6183 44.2224 172.5363 12 S 4.8569 8.2806 113.5698 56.1225 64.9467 175.0935 13 L 4.1038 8.2050 119.9937 57.6992 41.8364 179.3680 14 Y 4.2339 7.9275 116.5889 61.3270 38.0146 177.9256 15 Q 4.1872 8.0661 118.8870 59.4017 28.9983 179.4825 16 L 4.3936 7.8155 118.0287 57.4832 41.5916 179.1376 17 E 4.1516 8.6913 118.9477 58.8580 29.1112 178.7005 18 N 4.3135 7.9698 115.9236 55.4002 38.5470 175.7291 19 Y 4.4719 7.3519 115.4593 57.0596 38.7660 175.7060 20 C 4.4269 7.2224 118.3114 59.6480 29.0139 173.5134 21 N 4.5462 8.5775 118.2964 53.6934 38.2838 175.3333 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 2 I 7.98 3.99 1.87 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 1.27 0.64 0.91 0.00 0.00 3 V 7.75 3.54 2.08 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 0.72 0.00 0.00 0.93 0.00 0.00 4 E 8.45 4.35 0.00 2.06 1.90 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 2.23 1.94 0.00 5 Q 8.01 4.47 0.00 2.05 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.23 6.89 0.00 0.00 0.00 0.00 0.00 2.32 2.01 0.00 6 C 8.42 4.50 0.00 2.89 3.16 0.00 0.00 0.00 0.00 0.00 0.00 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 7.82 4.20 0.00 2.90 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 8 T 7.91 4.05 4.46 0.00 0.00 0.00 0.00 0.00 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 7.35 4.82 0.00 3.78 3.65 0.00 0.00 0.00 0.00 0.00 0.00 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 8.18 4.64 1.88 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 1.48 0.76 0.92 0.00 0.00 11 C 8.91 5.62 0.00 3.37 3.13 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 0.00 12 S 8.28 4.86 0.00 4.15 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 0.00 13 L 8.20 4.10 0.00 1.36 1.59 0.82 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 14 Y 7.93 4.23 0.00 3.04 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 15 Q 8.07 4.19 0.00 2.32 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.80 0.00 0.00 0.00 0.00 0.00 2.46 2.52 0.00 16 L 7.82 4.39 0.00 2.00 1.80 0.92 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 17 E 8.69 4.15 0.00 2.19 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 2.35 2.38 0.00 18 N 7.97 4.31 0.00 2.32 2.40 0.00 0.00 6.92 7.06 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 19 Y 7.35 4.47 0.00 3.04 3.02 0.00 0.00 0.00 0.00 0.00 0.00 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 7.22 4.43 0.00 3.10 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 8.58 4.55 0.00 2.72 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