NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 4.0060 8.2127 109.7444 45.4040 0.0000 173.5344 2 I 3.4053 8.1672 117.5113 63.1609 37.5044 173.4788 3 V 3.5315 8.4063 120.1186 66.0081 31.8796 177.2277 4 E 4.4950 8.0338 119.1562 59.0755 29.1437 179.0487 5 Q 4.2180 7.8889 117.9667 56.9423 29.0638 176.1399 6 C 4.9974 8.3389 114.8200 56.7284 42.8343 174.1793 7 C 4.4639 8.0843 117.8059 61.2290 32.4365 174.9379 8 T 4.0626 8.2204 110.0131 63.3770 68.8934 173.7862 9 S 4.9602 7.5023 115.3065 55.8046 66.2923 172.8376 10 I 3.8022 8.1109 121.3996 61.0804 37.1290 177.1262 11 C 4.7914 8.5774 125.5348 56.4721 45.0626 172.5566 12 S 4.8416 8.0689 115.3081 55.6666 66.7475 174.6562 13 L 3.9466 8.5443 124.4737 58.3438 41.7000 178.3673 14 Y 3.8901 8.1314 118.2457 61.1106 38.9337 178.0304 15 Q 4.2879 8.3812 118.6293 58.8139 28.8840 178.3263 16 L 4.1900 8.2900 120.3005 58.1849 41.8376 179.5773 17 E 4.0119 8.4404 118.0355 59.0439 29.1095 178.6955 18 N 4.3383 7.7344 114.8462 54.9195 38.5817 175.0258 19 Y 4.5335 7.5119 116.5728 57.7044 38.9363 175.8968 20 C 4.4080 7.6234 118.1467 59.3379 28.9276 173.4957 21 N 4.5248 8.5995 118.7297 53.7457 38.1370 175.1927 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 8.17 3.41 0.85 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 1.31 1.12 0.63 0.00 0.00 3 V 8.41 3.53 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 0.88 0.00 0.00 4 E 8.03 4.49 0.00 2.28 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 0.00 2.41 2.33 0.00 5 Q 7.89 4.22 0.00 2.12 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.76 0.00 0.00 0.00 0.00 0.00 2.66 2.62 0.00 6 C 8.34 5.00 0.00 3.09 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 8.08 4.46 0.00 2.89 3.15 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 0.00 0.00 0.00 0.00 8 T 8.22 4.06 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 7.50 4.96 0.00 4.11 3.98 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 10 I 8.11 3.80 1.88 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.54 0.92 0.00 0.00 11 C 8.58 4.79 0.00 3.11 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 12 S 8.07 4.84 0.00 4.10 3.93 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 13 L 8.54 3.95 0.00 1.81 1.76 0.94 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 14 Y 8.13 3.89 0.00 3.07 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 15 Q 8.38 4.29 0.00 2.31 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.54 0.00 0.00 0.00 0.00 0.00 2.57 2.60 0.00 16 L 8.29 4.19 0.00 1.87 1.79 0.95 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 17 E 8.44 4.01 0.00 1.86 1.90 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 2.31 2.49 0.00 18 N 7.73 4.34 0.00 2.50 2.40 0.00 0.00 6.88 8.33 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 19 Y 7.51 4.53 0.00 3.11 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 20 C 7.62 4.41 0.00 3.05 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 8.60 4.52 0.00 2.71 2.73 0.00 0.00 6.81 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