NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 F 4.9118 8.1827 119.3847 57.3356 40.7286 175.0071 2 V 3.5168 8.5205 119.5373 64.6398 31.3014 176.0373 3 N 4.2674 8.6071 116.7391 56.5815 37.0728 176.2442 4 Q 4.0127 8.1340 121.2107 58.7604 29.4045 177.1441 5 H 4.1006 8.1572 119.1640 59.4487 29.8141 177.3131 6 L 3.9965 8.3804 121.1093 57.6400 41.3490 178.6487 7 C 4.0888 8.2501 118.9644 62.8759 31.3790 176.1620 8 G 3.5567 8.3575 107.0681 47.7284 0.0000 175.4160 9 S 3.9090 7.7654 114.9886 61.5915 62.3640 175.9457 10 H 4.3065 7.9084 118.7599 58.1045 28.5606 177.7274 11 L 3.8752 8.0501 121.2475 57.7777 41.4165 179.4119 12 V 3.1647 7.5633 118.1802 65.9264 31.4214 177.4859 13 E 3.8607 7.6727 117.4525 59.3781 29.4317 178.7433 14 A 3.9639 7.9864 120.6268 55.1681 18.3691 179.6415 15 L 3.6665 8.1119 117.9182 57.6605 41.1927 178.9922 16 Y 4.1143 7.8497 119.7950 60.8199 38.5264 178.3693 17 L 3.8886 7.6149 118.1558 57.8362 41.7942 179.5575 18 V 3.8032 7.6617 111.3031 64.2011 31.6910 178.1071 19 C 4.2832 8.1384 116.1120 61.2095 28.5221 175.7240 20 G 3.7888 8.1388 108.9096 46.0511 0.0000 176.2137 21 E 3.9989 8.8032 120.5967 59.2736 29.8204 178.3607 22 R 3.9035 8.0186 117.1434 57.8781 30.2831 176.9969 23 G 3.9574 9.1058 102.6944 44.8480 0.0000 171.6303 24 F 5.0010 7.7405 111.7908 55.7213 40.4483 172.9701 25 F 4.8439 8.5275 116.2254 55.0370 39.5172 174.4045 26 Y 4.4998 8.6585 124.9100 55.9588 40.2022 175.2757 27 T 4.2871 7.5638 117.9091 59.1195 69.7404 172.0111 28 P 4.2135 0.0000 0.0000 63.0897 31.4043 176.6215 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 F 8.18 4.91 0.00 3.28 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 2 V 8.52 3.52 2.15 0.00 0.00 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 0.00 0.00 0.99 0.00 0.00 3 N 8.61 4.27 0.00 2.99 3.14 0.00 0.00 5.87 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 4 Q 8.13 4.01 0.00 2.22 2.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.93 0.00 0.00 0.00 0.00 0.00 2.49 2.47 0.00 5 H 8.16 4.10 0.00 3.38 3.50 0.00 5.83 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6 L 8.38 4.00 0.00 1.74 1.75 0.95 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 7 C 8.25 4.09 0.00 3.09 3.16 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.36 3.56 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 9 S 7.77 3.91 0.00 3.79 3.89 0.00 0.00 0.00 0.00 0.00 0.00 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 H 7.91 4.31 0.00 3.26 3.28 0.00 5.68 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 L 8.05 3.88 0.00 1.76 1.64 1.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 12 V 7.56 3.16 1.95 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 1.06 0.00 0.00 0.33 0.00 0.00 13 E 7.67 3.86 0.00 2.02 2.07 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 2.30 2.32 0.00 14 A 7.99 3.96 1.31 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 0.00 0.00 0.00 0.00 0.00 0.00 15 L 8.11 3.67 0.00 0.86 0.65 0.62 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 16 Y 7.85 4.11 0.00 3.22 3.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 L 7.61 3.89 0.00 1.81 1.69 0.95 0.94 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 18 V 7.66 3.80 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 0.77 0.00 0.00 0.87 0.00 0.00 19 C 8.14 4.28 0.00 3.12 3.22 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.14 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 0.00 0.00 0.00 21 E 8.80 4.00 0.00 1.96 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 0.00 2.29 2.26 0.00 22 R 8.02 3.90 0.00 1.85 2.04 0.00 3.23 0.00 0.00 3.25 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.78 0.00 23 G 9.11 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 0.00 0.00 0.00 24 F 7.74 5.00 0.00 3.02 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 25 F 8.53 4.84 0.00 3.17 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 26 Y 8.66 4.50 0.00 3.34 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 27 T 7.56 4.29 4.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 28 P 0.00 4.21 0.00 2.20 2.08 0.00 3.69 0.00 0.00 3.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 2.06 0.00