NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 W 4.7561 8.2744 120.5521 56.6083 31.1372 173.9381 2 R 4.1738 8.4408 122.0144 54.8578 30.4794 173.6808 3 Y 5.1396 9.1477 123.4708 56.3900 42.2359 173.8239 4 Y 4.7998 8.2509 117.9702 55.8098 41.7776 176.6519 5 E 4.0541 9.1188 121.3023 59.7287 29.7154 179.0944 6 S 4.2841 8.2020 112.0258 60.9596 63.0727 173.7888 7 S 4.7168 7.8648 112.9561 56.9994 65.4075 173.0793 8 L 4.6273 8.5390 121.3431 54.4866 41.7038 176.4003 9 L 4.7174 7.8704 119.6571 52.2660 43.1088 175.0227 10 P 3.9516 0.0000 0.0000 62.8168 31.7376 175.7778 11 Y 4.5591 8.3791 116.0776 57.1235 40.0448 174.5137 12 P 4.5447 0.0000 0.0000 63.0510 31.4447 175.8800 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 W 8.27 4.76 0.00 3.04 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.44 4.17 0.00 1.91 1.86 0.00 3.16 0.00 0.00 3.22 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.27 0.00 3 Y 9.15 5.14 0.00 2.90 2.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 4 Y 8.25 4.80 0.00 2.95 2.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5 E 9.12 4.05 0.00 2.02 2.07 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 2.35 2.36 0.00 6 S 8.20 4.28 0.00 4.03 4.04 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 0.00 0.00 0.00 0.00 7 S 7.86 4.72 0.00 3.87 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 8 L 8.54 4.63 0.00 1.72 1.70 0.92 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 9 L 7.87 4.72 0.00 1.62 1.49 0.87 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 10 P 0.00 3.95 0.00 1.59 1.42 0.00 3.39 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.64 0.00 11 Y 8.38 4.56 0.00 3.21 3.13 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.54 0.00 2.42 2.05 0.00 3.96 0.00 0.00 4.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.36 2.24 0.00