NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 Q 4.3063 8.3449 121.7090 55.8756 29.1328 173.7399 2 N 4.8241 8.0295 118.5741 50.3321 42.7814 172.5850 3 G 4.1078 8.6316 109.4954 44.0155 0.0000 171.3396 4 Y 4.6041 8.2869 117.7838 55.7989 41.1361 174.6694 5 E 4.3540 8.7527 125.5195 54.6144 31.2829 174.7870 6 N 4.6882 8.5169 124.5581 52.1322 39.0022 173.6987 7 P 4.4890 0.0000 0.0000 65.9817 32.0909 179.0863 8 T 4.2143 8.3414 114.6189 66.8852 68.9587 175.4274 9 Y 4.0384 8.2274 121.1781 60.6932 38.8996 178.1808 10 K 3.8552 7.7020 118.9893 59.5597 32.1788 176.6296 11 F 4.8186 8.2842 115.0379 57.2607 38.9146 175.8058 12 F 4.2166 8.4548 126.3968 57.7576 39.7453 174.5975 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 4.31 0.00 2.01 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.71 0.00 0.00 0.00 0.00 0.00 2.20 2.37 0.00 2 N 8.03 4.82 0.00 2.73 2.33 0.00 0.00 6.91 6.81 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 3 G 8.63 4.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 4 Y 8.29 4.60 0.00 2.91 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 5 E 8.75 4.35 0.00 1.90 1.86 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 2.25 2.38 0.00 6 N 8.52 4.69 0.00 2.86 2.74 0.00 0.00 7.27 7.78 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 7 P 0.00 4.49 0.00 2.36 2.19 0.00 3.75 0.00 0.00 4.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 2.18 0.00 8 T 8.34 4.21 4.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 9 Y 8.23 4.04 0.00 3.08 3.30 0.00 0.00 0.00 0.00 0.00 0.00 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 K 7.70 3.86 0.00 1.69 1.63 0.00 0.91 0.00 0.00 1.38 0.00 0.00 3.04 0.00 0.00 2.89 0.00 0.00 0.00 0.00 0.90 1.25 7.81 11 F 8.28 4.82 0.00 3.29 2.94 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 12 F 8.45 4.22 0.00 2.79 2.78 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