NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.9641 8.3393 109.7364 45.5179 0.0000 173.4986 2 S 4.0300 8.0774 116.5555 61.0598 63.6562 173.9376 3 M 4.2911 7.9211 120.4314 53.4669 34.0249 176.9748 4 N 4.5702 8.6122 121.7146 52.6503 39.6688 175.4706 5 A 3.9388 8.4888 130.2300 54.8745 18.7799 177.2020 6 P 4.1933 0.0000 0.0000 65.8212 31.4916 178.7520 7 A 4.0307 7.8607 118.0920 55.0298 18.1506 179.7736 8 R 3.8448 7.9469 116.3029 59.5714 29.9665 179.0901 9 A 4.0249 7.5614 118.3667 54.5431 18.5500 179.4202 10 A 4.0560 7.8415 118.5703 55.2535 18.9167 179.1475 11 A 4.2421 8.4035 117.4548 52.6246 18.6926 179.0757 12 K 3.8051 7.5631 119.1656 59.9705 32.2483 178.8520 13 T 3.8821 7.9113 115.1171 66.4191 68.3864 176.4545 14 A 3.9767 7.9348 122.1628 55.1238 18.5656 179.4184 15 A 3.9960 8.2733 119.4693 55.1209 18.1486 179.6564 16 D 4.2618 8.1838 117.0204 57.6175 41.1411 178.5493 17 A 4.1371 8.0115 121.2032 55.1724 18.3509 179.6595 18 L 4.0324 8.1325 117.0643 57.4145 41.6895 179.3564 19 A 4.1664 8.0610 120.5521 54.4693 17.8528 179.5269 20 A 3.9163 7.7303 119.6560 55.2419 18.4766 179.6479 21 A 3.8645 7.8823 118.7630 55.0295 18.7511 179.7759 22 K 3.9375 8.5114 117.4936 59.2017 32.0456 179.3115 23 K 3.8716 8.0559 120.0614 60.1124 32.0896 179.0546 24 T 4.0473 7.5358 115.2136 66.2635 67.1635 176.6668 25 A 3.9483 8.0159 122.7163 55.2220 18.3898 179.6145 26 A 4.2299 8.1744 119.3466 55.1142 18.4286 179.2597 27 D 4.2472 8.6390 116.8364 57.5410 41.0595 178.2982 28 A 4.0304 8.0602 120.0808 54.9640 18.4245 179.2491 29 A 4.1042 7.4576 119.2032 55.0461 18.8409 179.6571 30 A 3.9203 8.2958 119.4439 55.3902 18.3460 179.7216 31 A 4.2760 8.4867 117.2848 54.3957 18.5255 178.9879 32 A 4.1444 7.5981 118.1059 53.4399 18.7414 178.0527 33 A 4.3094 7.6580 118.5643 54.0228 20.4258 178.2757 34 A 4.3606 8.1124 120.2723 50.6820 17.1833 177.3854 35 A 4.2551 7.5851 124.8884 51.6838 19.4301 176.5062 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 8.34 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 0.00 0.00 0.00 2 S 8.08 4.03 0.00 4.07 4.01 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 3 M 7.92 4.29 0.00 2.02 2.03 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.56 2.51 0.00 4 N 8.61 4.57 0.00 2.75 2.70 0.00 0.00 7.11 8.71 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 5 A 8.49 3.94 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6 P 0.00 4.19 0.00 2.17 2.11 0.00 3.83 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.16 0.00 7 A 7.86 4.03 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8 R 7.95 3.84 0.00 2.20 2.00 0.00 3.25 0.00 0.00 3.17 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 9 A 7.56 4.02 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 7.84 4.06 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.40 4.24 1.31 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 0.00 0.00 12 K 7.56 3.81 0.00 2.10 1.83 0.00 1.66 0.00 0.00 1.65 0.00 0.00 2.92 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.44 1.69 7.81 13 T 7.91 3.88 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 14 A 7.93 3.98 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.27 4.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 D 8.18 4.26 0.00 2.80 2.74 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.01 4.14 1.36 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 0.00 0.00 18 L 8.13 4.03 0.00 1.94 1.73 0.95 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 19 A 8.06 4.17 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 7.73 3.92 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 7.88 3.86 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 K 8.51 3.94 0.00 1.89 1.87 0.00 1.68 0.00 0.00 1.57 0.00 0.00 2.88 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.46 1.52 7.81 23 K 8.06 3.87 0.00 1.92 2.05 0.00 1.65 0.00 0.00 1.65 0.00 0.00 2.95 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.44 1.64 7.81 24 T 7.54 4.05 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 25 A 8.02 3.95 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 A 8.17 4.23 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27 D 8.64 4.25 0.00 2.82 2.86 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 0.00 0.00 0.00 28 A 8.06 4.03 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 7.46 4.10 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 A 8.30 3.92 1.31 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 0.00 0.00 31 A 8.49 4.28 1.36 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 0.00 0.00 32 A 7.60 4.14 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 7.66 4.31 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 A 8.11 4.36 1.24 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 0.00 0.00 0.00 35 A 7.59 4.26 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00