NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.7519 8.3544 109.6912 44.9277 0.0000 174.1429 2 I 3.5137 6.7634 119.8699 60.3595 38.4954 172.1145 3 V 3.6125 8.4073 119.9123 63.6757 32.0072 175.9801 4 E 4.3009 7.9217 118.4933 56.9771 30.5756 176.3161 5 Q 4.3610 8.3103 119.7519 57.8839 30.2363 176.2973 6 C 4.5336 8.0724 110.7363 58.0574 39.9719 173.8182 7 C 4.2819 7.6737 120.1507 61.7149 31.7130 174.6853 8 T 4.1588 7.7219 115.2409 64.4440 68.7119 174.5824 9 S 4.7664 7.7346 115.6923 56.3899 65.4293 172.8046 10 I 4.5138 7.6872 119.2832 59.7832 38.9437 174.9632 11 C 5.4156 8.5826 121.3370 54.4080 40.8769 173.7273 12 S 4.5533 8.3910 119.6593 58.1833 66.1546 173.2271 13 L 3.5322 8.8853 123.7401 55.7875 40.6118 173.7967 14 Y 5.0188 8.3573 111.1724 57.4249 43.9419 176.1959 15 Q 4.5140 8.1992 118.1959 56.8859 30.0802 177.0991 16 L 4.3862 7.8267 119.3744 57.3478 40.9606 178.1092 17 E 4.0494 8.3153 120.6583 59.8003 29.0789 178.1133 18 N 4.1504 7.5636 114.1905 55.4214 38.5006 175.2560 19 Y 4.6230 7.8381 115.1101 57.6288 38.7278 175.1725 20 C 4.4810 7.6857 120.1242 58.2645 32.7784 172.9815 21 N 4.5092 8.5459 121.2592 53.8930 38.5826 174.7945 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 8.35 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 6.76 3.51 0.88 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.45 0.72 0.00 0.00 3 V 8.41 3.61 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 0.73 0.00 0.00 0.89 0.00 0.00 4 E 7.92 4.30 0.00 1.93 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 2.23 2.23 0.00 5 Q 8.31 4.36 0.00 2.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.95 6.96 0.00 0.00 0.00 0.00 0.00 2.27 2.46 0.00 6 C 8.07 4.53 0.00 3.10 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 7 C 7.67 4.28 0.00 3.02 2.90 0.00 0.00 0.00 0.00 0.00 0.00 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 7.72 4.16 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 1.21 0.00 0.00 9 S 7.73 4.77 0.00 3.98 3.91 0.00 0.00 0.00 0.00 0.00 0.00 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 7.69 4.51 1.89 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 1.31 0.69 0.93 0.00 0.00 11 C 8.58 5.42 0.00 2.93 2.99 0.00 0.00 0.00 0.00 0.00 0.00 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 8.39 4.55 0.00 3.85 3.70 0.00 0.00 0.00 0.00 0.00 0.00 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 8.89 3.53 0.00 1.52 1.14 0.83 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 0.00 0.00 0.00 0.00 14 Y 8.36 5.02 0.00 3.04 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 15 Q 8.20 4.51 0.00 2.14 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.95 0.00 0.00 0.00 0.00 0.00 2.42 2.47 0.00 16 L 7.83 4.39 0.00 1.93 1.98 0.91 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 17 E 8.32 4.05 0.00 2.05 2.02 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 2.36 2.42 0.00 18 N 7.56 4.15 0.00 2.23 2.11 0.00 0.00 6.86 7.34 0.00 0.00 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 7.84 4.62 0.00 2.95 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 20 C 7.69 4.48 0.00 2.98 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 21 N 8.55 4.51 0.00 2.72 2.68 0.00 0.00 6.87 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