NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 4.0129 8.2127 109.7452 45.6167 0.0000 175.6564 2 I 3.4591 8.1716 122.6017 63.1505 37.6201 172.1312 3 V 3.5011 8.4827 120.4150 65.4670 32.1384 176.3829 4 E 4.1137 8.8941 119.2834 57.8134 28.7236 178.1795 5 Q 4.4041 8.4230 128.1963 58.3716 29.5423 178.9218 6 C 4.4528 7.3728 116.2033 59.5053 40.5808 174.7224 7 C 4.1442 9.3462 120.0368 62.5336 31.2688 174.7783 8 T 4.4240 8.1623 110.7243 62.2469 67.6699 174.5960 9 S 4.5399 7.1853 114.5552 59.4025 68.1701 174.5213 10 I 4.8165 8.4139 124.3202 60.7139 40.1179 173.6797 11 C 4.9152 8.2792 115.5910 53.5401 40.4566 173.0411 12 S 4.8930 8.2913 112.0168 56.5161 65.4740 174.9445 13 L 3.9994 8.5920 129.1621 58.3326 41.3851 178.6627 14 Y 4.0130 8.3267 116.4571 61.5786 37.6846 178.8680 15 Q 4.1914 8.2136 116.3098 58.4515 29.1776 178.1112 16 L 4.1925 7.6993 122.1826 58.0399 42.2460 178.3042 17 E 4.2453 8.9027 117.6303 58.1433 29.2698 178.2514 18 N 4.5378 7.6929 115.3978 55.1254 38.7840 175.6938 19 Y 4.3127 7.7605 116.7704 57.4896 39.2199 175.4677 20 C 4.3382 7.5836 119.2029 59.4022 26.6133 173.6570 21 N 4.0794 8.1399 119.9267 53.9280 39.1427 174.7462 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 4.01 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 0.00 0.00 0.00 2 I 8.17 3.46 1.68 0.00 0.00 -0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.93 0.72 0.00 0.00 3 V 8.48 3.50 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 0.00 0.00 0.87 0.00 0.00 4 E 8.89 4.11 0.00 2.24 1.78 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 2.33 2.40 0.00 5 Q 8.42 4.40 0.00 2.02 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.98 0.00 0.00 0.00 0.00 0.00 2.39 2.36 0.00 6 C 7.37 4.45 0.00 2.91 3.08 0.00 0.00 0.00 0.00 0.00 0.00 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 9.35 4.14 0.00 2.89 3.03 0.00 0.00 0.00 0.00 0.00 0.00 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 8.16 4.42 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 1.23 0.00 0.00 9 S 7.19 4.54 0.00 4.04 3.64 0.00 0.00 0.00 0.00 0.00 0.00 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 8.41 4.82 1.87 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.88 0.91 0.00 0.00 11 C 8.28 4.92 0.00 3.02 3.05 0.00 0.00 0.00 0.00 0.00 0.00 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 8.29 4.89 0.00 3.89 3.78 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 13 L 8.59 4.00 0.00 1.86 1.77 0.94 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 14 Y 8.33 4.01 0.00 3.06 3.12 0.00 0.00 0.00 0.00 0.00 0.00 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 8.21 4.19 0.00 2.14 2.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 7.13 0.00 0.00 0.00 0.00 0.00 2.47 2.45 0.00 16 L 7.70 4.19 0.00 1.87 1.73 0.78 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 17 E 8.90 4.25 0.00 2.02 1.88 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 0.00 2.32 2.46 0.00 18 N 7.69 4.54 0.00 2.77 2.76 0.00 0.00 6.92 7.31 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 19 Y 7.76 4.31 0.00 3.14 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 20 C 7.58 4.34 0.00 3.24 2.92 0.00 0.00 0.00 0.00 0.00 0.00 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 8.14 4.08 0.00 2.63 2.63 0.00 0.00 7.04 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00