NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 A 4.3153 8.2649 123.5821 50.9465 19.9461 176.7021 3 P 4.2118 0.0000 0.0000 62.0188 31.9578 175.0464 4 S 4.2559 9.2887 118.2894 58.9601 64.2948 173.5780 5 I 4.3035 8.1538 123.6843 59.5207 38.6374 174.8416 6 D 4.7686 8.4179 124.7907 52.5052 41.6821 176.4664 7 R 4.1504 8.3841 126.5725 57.8808 30.5701 179.1729 8 S 4.2106 8.0707 112.4286 60.6284 62.9574 175.0674 9 T 4.3734 7.3150 109.3081 61.0493 68.9546 174.9212 10 K 4.0433 7.7658 123.5132 56.0423 32.3376 175.3480 11 P 4.5893 0.0000 0.0000 61.1124 32.4493 174.2010 12 P 4.3299 0.0000 0.0000 62.5624 31.8454 176.5677 13 L 4.1477 8.3547 121.9350 55.4218 42.0405 176.5287 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 2 A 8.26 4.32 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.21 0.00 2.13 2.01 0.00 3.69 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.16 0.00 4 S 9.29 4.26 0.00 3.85 3.80 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 5 I 8.15 4.30 1.87 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 0.73 0.91 0.00 0.00 6 D 8.42 4.77 0.00 2.64 2.53 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.38 4.15 0.00 1.91 1.95 0.00 3.18 0.00 0.00 3.39 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.61 0.00 8 S 8.07 4.21 0.00 4.01 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 9 T 7.32 4.37 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 1.24 0.00 0.00 10 K 7.77 4.04 0.00 1.79 1.80 0.00 1.70 0.00 0.00 1.75 0.00 0.00 3.07 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.47 1.38 7.81 11 P 0.00 4.59 0.00 2.18 2.05 0.00 3.77 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.98 0.00 12 P 0.00 4.33 0.00 2.06 2.03 0.00 3.67 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.07 0.00 13 L 8.35 4.15 0.00 1.58 1.54 0.92 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00