NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 L 4.2428 8.1731 120.9889 54.9960 42.5603 176.5594 2 G 3.9097 7.8217 106.8517 43.5109 0.0000 170.4506 3 R 4.6481 8.1931 117.7090 54.8352 35.7532 174.4678 4 V 4.2024 7.9859 117.5356 61.9655 30.5394 172.6337 5 D 4.5983 7.7050 125.2132 53.6826 41.1003 173.8504 6 I 4.4565 7.8916 121.4623 59.7560 38.9569 175.3796 7 H 4.3125 8.8187 124.7824 59.5082 30.0224 176.2247 8 V 4.1420 7.5916 111.7187 61.2739 31.1825 175.5621 9 W 4.8154 8.2127 130.4067 56.9979 33.3663 174.4774 10 D 4.2373 9.6205 124.0933 55.9232 39.1947 173.8136 11 G 4.4681 8.0651 107.8834 45.1661 0.0000 175.3531 12 V 4.4870 7.2088 111.4743 58.6286 35.4852 174.7796 13 Y 4.1561 8.7163 124.3979 57.3178 38.5976 175.7335 14 I 3.6989 7.8009 128.4728 61.2671 37.8142 176.2214 15 R 4.1460 8.3787 123.8243 56.9592 32.2913 177.6208 16 G 3.8778 9.1985 113.9397 46.6504 0.0000 173.4916 17 R 4.0362 9.1055 121.1660 56.2940 30.1109 174.7256 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 L 8.17 4.24 0.00 1.74 1.87 0.92 0.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 2 G 7.82 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3 R 8.19 4.65 0.00 1.73 1.80 0.00 3.16 0.00 0.00 3.14 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.58 0.00 4 V 7.99 4.20 2.10 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 0.85 0.00 0.00 0.94 0.00 0.00 5 D 7.70 4.60 0.00 2.96 2.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6 I 7.89 4.46 1.80 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.40 0.99 0.00 0.00 7 H 8.82 4.31 0.00 3.07 3.35 0.00 5.93 0.00 0.00 0.00 0.00 6.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8 V 7.59 4.14 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.78 0.00 0.00 0.97 0.00 0.00 9 W 8.21 4.82 0.00 3.45 2.81 0.00 0.00 0.00 0.00 0.00 0.00 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 D 9.62 4.24 0.00 3.11 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 11 G 8.07 4.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 V 7.21 4.49 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 0.78 0.00 0.00 0.97 0.00 0.00 13 Y 8.72 4.16 0.00 2.99 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 14 I 7.80 3.70 1.56 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.55 0.80 0.00 0.00 15 R 8.38 4.15 0.00 1.79 1.82 0.00 3.42 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 1.63 1.67 0.00 16 G 9.20 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 9.11 4.04 0.00 1.71 1.74 0.00 3.26 0.00 0.00 3.22 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.57 0.00