NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 F 4.8024 8.1827 122.8234 58.0763 41.6074 176.7201 2 K 3.6792 7.9501 121.1087 58.4616 32.1547 177.4714 3 R 3.9144 7.6765 118.6394 59.0885 30.6140 178.3069 4 I 3.8139 7.5394 112.4827 63.8667 37.7478 178.2606 5 V 3.5082 7.4661 119.9366 65.3426 31.0539 177.8147 6 Q 3.9184 7.6564 119.3281 59.2044 28.6569 178.4378 7 R 3.9526 7.3721 117.1456 59.0354 30.2644 178.8968 8 I 4.0057 7.4124 118.5869 64.3541 37.1176 178.4458 9 K 3.9109 7.8359 119.2103 60.2674 31.9008 178.4340 10 D 4.3056 7.6639 118.2233 56.5193 41.1458 177.8787 11 F 4.5636 8.2552 121.3024 61.5228 39.5929 176.9291 12 L 3.5194 7.5397 116.6247 56.3621 41.5929 176.9182 13 R 4.1202 8.0141 122.9574 56.2474 30.1775 174.9407 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 4.80 0.00 3.11 3.21 0.00 0.00 0.00 0.00 0.00 0.00 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 K 7.95 3.68 0.00 1.94 1.77 0.00 1.74 0.00 0.00 1.73 0.00 0.00 2.98 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.49 1.54 7.81 3 R 7.68 3.91 0.00 1.93 1.93 0.00 3.22 0.00 0.00 3.39 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.73 0.00 4 I 7.54 3.81 1.84 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.67 0.91 0.00 0.00 5 V 7.47 3.51 1.66 0.00 0.00 0.00 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 -0.46 0.00 0.00 6 Q 7.66 3.92 0.00 2.28 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.57 0.00 0.00 0.00 0.00 0.00 2.32 2.52 0.00 7 R 7.37 3.95 0.00 2.06 1.98 0.00 3.38 0.00 0.00 3.21 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.80 0.00 8 I 7.41 4.01 2.02 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.94 1.01 0.00 0.00 9 K 7.84 3.91 0.00 1.94 2.06 0.00 1.28 0.00 0.00 1.56 0.00 0.00 2.87 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.61 1.44 7.81 10 D 7.66 4.31 0.00 2.78 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 11 F 8.26 4.56 0.00 2.91 3.33 0.00 0.00 0.00 0.00 0.00 0.00 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 L 7.54 3.52 0.00 1.46 1.45 -0.26 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 13 R 8.01 4.12 0.00 1.66 1.79 0.00 3.27 0.00 0.00 3.24 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.49 0.00