NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.9971 8.2127 109.7429 45.4975 0.0000 173.4913 2 I 3.1908 8.1092 117.5872 63.1423 37.6748 173.6888 3 V 3.5134 8.3722 120.0157 65.9824 31.6475 177.3364 4 E 3.9623 7.9706 116.7599 59.4283 28.1391 178.6589 5 Q 4.1422 8.3056 119.6327 58.5818 29.0224 176.5011 6 C 4.6658 8.2774 115.5397 56.1315 41.6871 174.2337 7 C 4.2051 8.1209 117.4957 60.3789 28.7020 174.7543 8 T 4.2547 7.8885 109.1066 62.7761 69.0999 174.5903 9 S 4.6975 7.4239 114.0997 55.7943 66.3080 172.9822 10 I 4.1417 8.1722 121.9486 61.1834 37.0098 177.0026 11 C 4.7431 8.6290 123.9458 56.4058 38.7579 174.4641 12 S 4.5176 9.0565 119.3859 57.9428 64.9798 175.5969 13 L 4.0524 8.4174 121.8071 57.9710 41.0736 179.1625 14 Y 4.2349 7.9793 118.3650 60.8772 39.0494 177.5711 15 Q 4.0632 8.2399 118.9889 59.0250 28.8281 178.8886 16 L 4.2656 8.0692 119.9547 57.7609 41.7780 179.1817 17 E 4.0384 7.9299 117.7029 58.4832 29.0528 178.4880 18 N 4.0020 7.3928 116.6773 56.1639 38.9052 175.2700 19 Y 4.4645 7.4497 115.2786 57.3024 38.6668 175.6733 20 C 4.4095 6.9972 117.7707 59.3778 28.9988 173.5064 21 N 4.5263 8.5509 117.9936 53.7797 38.1501 175.3181 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 8.21 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 I 8.11 3.19 0.59 0.00 0.00 0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 1.06 0.63 0.00 0.00 3 V 8.37 3.51 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.00 0.00 0.87 0.00 0.00 4 E 7.97 3.96 0.00 2.09 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.42 0.00 5 Q 8.31 4.14 0.00 2.31 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.63 0.00 0.00 0.00 0.00 0.00 2.41 2.45 0.00 6 C 8.28 4.67 0.00 2.98 3.06 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 0.00 0.00 0.00 0.00 7 C 8.12 4.21 0.00 3.11 2.96 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 8 T 7.89 4.25 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 1.27 0.00 0.00 9 S 7.42 4.70 0.00 4.01 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 10 I 8.17 4.14 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 1.42 0.54 0.92 0.00 0.00 11 C 8.63 4.74 0.00 2.99 3.07 0.00 0.00 0.00 0.00 0.00 0.00 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 9.06 4.52 0.00 4.11 4.06 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 0.00 0.00 0.00 0.00 13 L 8.42 4.05 0.00 1.77 1.81 0.95 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 14 Y 7.98 4.23 0.00 2.95 3.04 0.00 0.00 0.00 0.00 0.00 0.00 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 8.24 4.06 0.00 2.39 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.57 0.00 0.00 0.00 0.00 0.00 2.46 2.53 0.00 16 L 8.07 4.27 0.00 1.92 1.78 0.95 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 17 E 7.93 4.04 0.00 1.95 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 2.30 2.48 0.00 18 N 7.39 4.00 0.00 2.28 2.05 0.00 0.00 7.14 8.88 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 19 Y 7.45 4.46 0.00 3.12 2.98 0.00 0.00 0.00 0.00 0.00 0.00 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 7.00 4.41 0.00 3.04 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 21 N 8.55 4.53 0.00 2.71 2.73 0.00 0.00 6.80 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