NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 4.0095 8.2127 109.7429 45.5495 0.0000 174.5099 2 I 3.1929 8.0369 117.9463 62.9424 37.7817 173.8262 3 V 3.4951 8.3089 120.0963 65.9850 31.7230 177.2912 4 E 3.9501 7.9967 116.5029 59.4327 29.4471 178.7341 5 Q 4.1388 8.1168 118.4970 58.7018 29.3481 176.5603 6 C 4.9837 8.3689 114.0558 56.8851 41.5129 174.0731 7 C 4.3481 8.1026 117.1913 60.0403 28.8638 174.6663 8 T 4.2934 7.9384 116.0732 64.6991 68.9873 174.7787 9 S 4.7593 7.5130 112.4187 55.8670 66.2425 173.3354 10 I 3.8993 8.1814 122.2633 61.3244 37.1819 176.8513 11 C 4.7478 8.6394 123.8112 56.3050 42.2446 174.4153 12 S 4.5175 9.1738 119.7655 57.8471 64.8813 175.5597 13 L 4.0108 8.4184 121.7511 58.1455 41.0884 179.1862 14 Y 4.3520 7.8984 119.4813 60.2557 39.0548 177.4990 15 Q 4.0568 8.2283 119.0085 58.9658 28.7671 178.7543 16 L 4.2388 8.2231 120.0635 57.8948 41.1210 179.3627 17 E 3.9543 8.0329 118.1623 58.7812 29.0670 178.5789 18 N 4.0637 7.4513 116.1674 55.8647 38.8946 175.2231 19 Y 4.5472 7.4157 115.6682 57.2149 38.7598 175.6204 20 C 4.4206 7.0824 118.0693 59.3854 29.0073 173.5042 21 N 4.5315 8.5375 117.7627 53.7871 38.1724 175.3718 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 8.04 3.19 0.56 0.00 0.00 0.38 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 1.03 0.60 0.00 0.00 3 V 8.31 3.50 2.03 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 0.98 0.00 0.00 0.86 0.00 0.00 4 E 8.00 3.95 0.00 1.96 2.01 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 2.32 2.42 0.00 5 Q 8.12 4.14 0.00 2.17 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.71 0.00 0.00 0.00 0.00 0.00 2.44 2.45 0.00 6 C 8.37 4.98 0.00 3.00 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 7 C 8.10 4.35 0.00 3.12 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 8 T 7.94 4.29 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 9 S 7.51 4.76 0.00 3.92 3.79 0.00 0.00 0.00 0.00 0.00 0.00 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 8.18 3.90 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 0.93 0.00 0.00 11 C 8.64 4.75 0.00 3.00 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 9.17 4.52 0.00 4.10 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 4.01 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 1.69 0.00 0.00 0.00 0.00 0.00 0.00 14 Y 7.90 4.35 0.00 2.94 3.02 0.00 0.00 0.00 0.00 0.00 0.00 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 8.23 4.06 0.00 2.47 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.57 0.00 0.00 0.00 0.00 0.00 2.45 2.52 0.00 16 L 8.22 4.24 0.00 1.91 1.78 0.95 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 17 E 8.03 3.95 0.00 1.96 1.85 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 2.31 2.53 0.00 18 N 7.45 4.06 0.00 2.30 2.12 0.00 0.00 7.12 8.80 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 19 Y 7.42 4.55 0.00 3.11 2.95 0.00 0.00 0.00 0.00 0.00 0.00 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 7.08 4.42 0.00 3.03 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 21 N 8.54 4.53 0.00 2.71 2.73 0.00 0.00 6.79 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