NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.9887 8.2127 109.7411 45.3708 0.0000 176.3182 2 I 3.3314 8.3548 121.6398 61.8433 37.6885 172.5984 3 V 3.5337 8.3739 120.8797 65.0571 31.5740 177.7351 4 E 3.9561 8.0131 117.9398 58.7484 28.0977 178.6644 5 Q 4.1396 8.2699 119.8009 58.6193 29.0185 176.5335 6 C 4.6872 8.5300 115.5077 56.2877 41.1839 174.4963 7 C 4.4076 8.1677 117.8507 59.8225 28.5371 174.0105 8 T 4.4188 7.7740 110.2178 62.1521 70.0975 174.7359 9 S 4.6587 7.4303 114.2904 55.9780 66.1856 173.1875 10 I 3.9742 8.2343 122.8090 61.5246 37.0681 176.7335 11 C 4.8052 8.6095 123.7951 56.3376 40.8146 174.4596 12 S 4.6022 8.6805 119.1946 57.6632 65.3327 175.4793 13 L 4.1414 8.3843 121.0178 57.5313 41.0863 178.9405 14 Y 4.0905 8.0840 118.8535 60.9466 39.2068 177.7517 15 Q 4.0353 8.2914 118.7877 58.6316 28.9110 178.4100 16 L 4.3744 8.0624 120.0597 57.3707 41.7079 178.8510 17 E 4.0041 8.1479 119.3861 58.9722 29.2684 177.9895 18 N 4.3841 7.4155 113.8287 54.7822 38.6220 174.9638 19 Y 4.4864 7.6700 116.8900 57.9200 38.9460 175.7718 20 C 4.3861 7.7458 118.6722 59.3008 28.9298 173.4068 21 N 4.5230 8.6614 120.0820 53.1277 37.2280 174.8934 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 3.99 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 0.00 0.00 0.00 0.00 0.00 0.00 2 I 8.35 3.33 1.10 0.00 0.00 0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.82 0.72 0.00 0.00 3 V 8.37 3.53 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 0.74 0.00 0.00 0.91 0.00 0.00 4 E 8.01 3.96 0.00 1.97 2.06 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 2.31 2.37 0.00 5 Q 8.27 4.14 0.00 2.20 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.68 0.00 0.00 0.00 0.00 0.00 2.46 2.45 0.00 6 C 8.53 4.69 0.00 2.95 3.05 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 0.00 0.00 0.00 0.00 7 C 8.17 4.41 0.00 3.08 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 7.77 4.42 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 1.25 0.00 0.00 9 S 7.43 4.66 0.00 4.03 3.94 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 10 I 8.23 3.97 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 1.42 0.54 0.93 0.00 0.00 11 C 8.61 4.81 0.00 2.99 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 12 S 8.68 4.60 0.00 4.16 4.09 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 13 L 8.38 4.14 0.00 1.77 1.80 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 8.08 4.09 0.00 2.96 3.08 0.00 0.00 0.00 0.00 0.00 0.00 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 8.29 4.04 0.00 2.48 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.59 0.00 0.00 0.00 0.00 0.00 2.62 2.60 0.00 16 L 8.06 4.37 0.00 1.75 1.77 0.94 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 17 E 8.15 4.00 0.00 2.19 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 2.25 2.33 0.00 18 N 7.42 4.38 0.00 2.61 2.26 0.00 0.00 6.92 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 Y 7.67 4.49 0.00 3.12 2.96 0.00 0.00 0.00 0.00 0.00 0.00 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 7.75 4.39 0.00 2.97 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 8.66 4.52 0.00 2.83 2.80 0.00 0.00 5.99 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