NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 Q 4.2637 8.3444 118.8243 56.2769 29.8096 173.7485 2 Q 4.1762 8.4679 118.0787 54.4728 30.4275 174.1713 3 Q 4.4480 8.4365 124.2782 53.9052 30.8657 174.7227 4 Q 4.0642 8.6337 127.1466 56.2911 29.7372 175.0479 5 Q 4.6495 8.4725 123.5779 54.4056 30.6047 174.9051 6 Q 4.7289 8.3362 119.7185 54.2580 32.9408 174.4544 7 Q 4.5986 8.1894 117.0056 54.0238 32.5909 175.4313 8 Q 4.1930 8.5430 120.8984 55.9743 29.3928 176.7485 9 Q 4.1055 8.7069 121.5425 57.7856 29.2837 176.0435 10 Q 4.5311 8.4064 117.5494 54.6651 31.1016 175.2332 11 G 3.7329 8.8827 111.0120 45.5568 0.0000 173.7520 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 Q 8.34 4.26 0.00 2.18 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.82 0.00 0.00 0.00 0.00 0.00 2.22 2.36 0.00 2 Q 8.47 4.18 0.00 2.11 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.22 6.78 0.00 0.00 0.00 0.00 0.00 2.28 2.41 0.00 3 Q 8.44 4.45 0.00 2.03 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.69 0.00 0.00 0.00 0.00 0.00 2.25 2.31 0.00 4 Q 8.63 4.06 0.00 2.05 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.64 6.49 0.00 0.00 0.00 0.00 0.00 2.34 2.38 0.00 5 Q 8.47 4.65 0.00 2.06 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.59 0.00 0.00 0.00 0.00 0.00 2.28 2.30 0.00 6 Q 8.34 4.73 0.00 1.97 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.72 0.00 0.00 0.00 0.00 0.00 2.25 2.34 0.00 7 Q 8.19 4.60 0.00 1.97 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.93 0.00 0.00 0.00 0.00 0.00 2.25 2.35 0.00 8 Q 8.54 4.19 0.00 2.04 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 7.12 0.00 0.00 0.00 0.00 0.00 2.36 2.32 0.00 9 Q 8.71 4.11 0.00 2.04 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.77 0.00 0.00 0.00 0.00 0.00 2.36 2.29 0.00 10 Q 8.41 4.53 0.00 1.99 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.76 0.00 0.00 0.00 0.00 0.00 2.25 2.32 0.00 11 G 8.88 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00