NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 D 4.6232 8.3644 120.3175 52.9965 40.7796 173.4561 2 K 4.4188 8.3688 118.9106 54.8353 34.6109 173.1805 3 N 5.0393 8.9640 123.0535 54.7046 45.7800 174.3355 4 G 4.4426 7.5329 113.1899 46.3873 0.0000 174.0507 5 D 4.9204 7.2515 117.3072 53.5100 40.9092 177.0022 6 G 3.6059 6.9082 105.1435 49.6380 0.0000 173.3368 7 E 4.0113 8.1714 130.8807 55.6960 28.7938 177.8684 8 V 3.2382 9.1231 126.9380 64.8592 30.9334 175.6417 9 S 3.8745 8.7140 118.8521 60.7957 63.3222 172.5363 10 F 3.0754 8.8163 116.3242 61.6057 36.8603 175.0846 11 E 3.7349 8.0455 114.4105 57.3687 27.0607 175.3451 12 E 4.1965 7.9050 121.9035 56.4606 29.6315 175.5743 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 D 8.36 4.62 0.00 2.79 2.80 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.37 4.42 0.00 1.96 1.68 0.00 1.78 0.00 0.00 1.88 0.00 0.00 2.96 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.31 1.64 7.81 3 N 8.96 5.04 0.00 2.68 2.76 0.00 0.00 7.04 7.66 0.00 0.00 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 G 7.53 4.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 D 7.25 4.92 0.00 2.79 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 6 G 6.91 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.17 4.01 0.00 2.00 1.97 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 2.37 2.43 0.00 8 V 9.12 3.24 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.78 0.00 0.00 0.92 0.00 0.00 9 S 8.71 3.87 0.00 4.12 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 10 F 8.82 3.08 0.00 3.32 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 11 E 8.05 3.73 0.00 2.08 1.96 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 2.29 2.20 0.00 12 E 7.91 4.20 0.00 2.45 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.29 0.00