NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.9681 8.2127 109.7410 45.3837 0.0000 173.4344 2 I 3.2188 8.1924 117.5578 63.2984 37.4875 173.4662 3 V 3.5168 8.3737 120.0422 65.9573 31.8640 177.2934 4 E 3.9692 8.0690 117.9123 59.4530 29.1303 179.2629 5 Q 4.0242 8.2212 117.5546 58.5776 28.9786 177.0370 6 C 4.8195 8.3672 115.0618 56.9639 42.0109 174.4575 7 C 4.3976 7.7905 118.7240 61.5904 32.2781 174.8882 8 T 3.9916 8.1321 115.1051 66.6048 68.4556 175.1081 9 S 4.6291 7.7440 115.7836 57.0879 64.4092 172.7493 10 I 4.7172 8.0981 111.2733 59.4804 40.1535 173.0765 11 C 5.1076 8.2846 115.0222 53.0565 43.1609 174.0760 12 S 4.6860 8.9985 116.2108 57.4533 65.1534 175.2816 13 L 4.0113 8.3406 122.1377 58.1276 41.4270 179.1048 14 Y 4.1295 7.8814 116.3904 61.0976 37.7840 178.3192 15 Q 4.0949 8.2778 119.1145 58.7794 28.8352 178.5767 16 L 4.2643 8.0533 120.0931 57.6082 41.7242 178.9098 17 E 4.1753 7.9574 118.0827 58.3327 29.1099 178.4796 18 N 4.3304 8.0727 116.4059 55.1347 38.4714 175.0496 19 Y 4.5821 7.3359 116.2571 57.6636 38.4693 175.7346 20 C 4.4456 7.6793 117.9293 59.4792 28.9461 173.5794 21 N 4.5414 8.5599 117.9889 53.7554 38.2400 175.3704 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 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.19 3.22 0.75 0.00 0.00 0.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.97 0.64 0.00 0.00 3 V 8.37 3.52 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 1.08 0.00 0.00 0.87 0.00 0.00 4 E 8.07 3.97 0.00 2.34 1.99 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 2.40 2.46 0.00 5 Q 8.22 4.02 0.00 2.08 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.78 0.00 0.00 0.00 0.00 0.00 2.66 2.67 0.00 6 C 8.37 4.82 0.00 2.97 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 7.79 4.40 0.00 2.89 3.09 0.00 0.00 0.00 0.00 0.00 0.00 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 8.13 3.99 4.40 0.00 0.00 0.00 0.00 0.00 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 7.74 4.63 0.00 3.84 4.07 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 10 I 8.10 4.72 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 1.48 0.87 0.92 0.00 0.00 11 C 8.28 5.11 0.00 3.23 3.25 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 0.00 12 S 9.00 4.69 0.00 4.20 4.12 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 13 L 8.34 4.01 0.00 1.43 1.62 0.85 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 14 Y 7.88 4.13 0.00 3.04 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 8.28 4.09 0.00 2.33 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.79 0.00 0.00 0.00 0.00 0.00 2.43 2.48 0.00 16 L 8.05 4.26 0.00 1.96 1.79 0.93 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 17 E 7.96 4.18 0.00 2.14 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 2.31 2.50 0.00 18 N 8.07 4.33 0.00 2.07 2.23 0.00 0.00 6.84 7.97 0.00 0.00 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 7.34 4.58 0.00 3.01 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 7.68 4.45 0.00 3.00 2.87 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 0.00 0.00 0.00 21 N 8.56 4.54 0.00 2.72 2.73 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