NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 4.0170 8.2127 109.7459 45.4564 0.0000 173.6089 2 I 3.1000 8.0778 117.5714 62.9413 37.7553 173.4950 3 V 3.4854 7.7368 118.9077 65.9286 31.7130 176.8599 4 E 3.9116 8.0922 117.1809 59.5568 29.5326 178.1350 5 Q 4.2154 8.1422 118.1654 58.0772 29.2625 175.5763 6 C 5.0839 8.0789 113.8094 56.8255 41.4752 173.9461 7 C 4.4560 8.0184 116.3080 59.9627 28.3645 173.5809 8 T 4.4041 7.8810 113.9392 64.8323 70.2714 174.2533 9 S 4.7129 7.6741 115.9761 56.7203 64.4296 174.3264 10 I 3.8732 8.1474 125.4945 61.4516 37.4625 176.4074 11 C 4.7972 8.6420 123.2460 56.1360 41.2206 174.4500 12 S 4.4920 8.8998 119.9325 57.8799 64.6835 175.4225 13 L 3.9973 8.4668 121.7631 58.1182 41.0705 179.0647 14 Y 4.0529 8.0623 117.9630 60.9520 38.9202 177.8724 15 Q 4.2055 8.3215 118.8272 59.0330 28.7596 178.7251 16 L 4.2536 8.3739 120.3343 57.8184 41.6710 179.0769 17 E 3.9012 8.5728 119.5065 59.2143 29.2290 178.4343 18 N 4.2290 7.5887 115.5039 55.2058 38.5245 175.0515 19 Y 4.5660 7.6391 116.5007 57.7255 38.6411 175.7890 20 C 4.4352 7.7166 118.2314 59.1509 28.9720 173.5180 21 N 4.5146 8.6079 118.2385 53.8140 38.0807 175.2073 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 4.02 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 0.00 0.00 0.00 2 I 8.08 3.10 0.59 0.00 0.00 0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.61 0.64 0.00 0.00 3 V 7.74 3.49 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 0.95 0.00 0.00 0.87 0.00 0.00 4 E 8.09 3.91 0.00 2.00 2.16 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 2.31 2.39 0.00 5 Q 8.14 4.22 0.00 2.20 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.55 0.00 0.00 0.00 0.00 0.00 2.45 2.46 0.00 6 C 8.08 5.08 0.00 3.03 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 7 C 8.02 4.46 0.00 3.10 2.93 0.00 0.00 0.00 0.00 0.00 0.00 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 7.88 4.40 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 7.67 4.71 0.00 3.87 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 8.15 3.87 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 0.47 0.93 0.00 0.00 11 C 8.64 4.80 0.00 3.00 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 12 S 8.90 4.49 0.00 4.13 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 8.47 4.00 0.00 1.78 1.81 0.95 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 14 Y 8.06 4.05 0.00 2.93 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 15 Q 8.32 4.21 0.00 2.45 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.57 0.00 0.00 0.00 0.00 0.00 2.51 2.60 0.00 16 L 8.37 4.25 0.00 1.90 1.80 0.95 1.12 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 8.57 3.90 0.00 2.13 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.32 0.00 18 N 7.59 4.23 0.00 2.32 2.41 0.00 0.00 6.92 7.32 0.00 0.00 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 7.64 4.57 0.00 3.06 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 20 C 7.72 4.44 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 8.61 4.51 0.00 2.71 2.74 0.00 0.00 6.80 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