NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.8768 8.3544 109.7391 45.0949 0.0000 173.4098 2 S 4.5867 7.9060 114.7091 54.2202 63.5056 171.9587 3 D 5.0794 9.1162 129.9946 52.8862 40.6547 176.9094 4 R 3.9520 8.3065 118.9984 60.1247 30.2840 176.4140 5 F 4.4254 7.7058 116.2194 56.4796 42.7673 174.2536 6 V 4.0414 8.8964 123.4802 62.1565 31.3402 175.1141 7 K 3.6041 8.5075 128.9853 58.9050 27.8175 176.3919 8 G 3.4192 7.8994 103.0055 46.8916 0.0000 171.4012 9 T 4.0796 7.4769 115.4961 61.5549 72.7072 172.6997 10 C 3.3847 7.5573 122.2864 57.2475 30.0979 171.9494 11 P 4.1748 0.0000 0.0000 64.5269 31.3705 178.0365 12 K 4.1019 8.1149 120.0186 58.7685 32.4342 176.8964 13 C 4.4070 8.2107 109.4131 58.6187 29.8113 175.8203 14 K 4.3782 7.6828 120.4706 57.6854 28.5299 172.8396 15 S 4.3680 8.4171 116.9278 57.0912 62.0386 174.6192 16 P 3.9436 0.0000 0.0000 64.6259 31.6016 176.8439 17 D 4.5335 7.4795 117.9221 50.3452 39.3218 174.7879 18 Q 4.2516 7.7052 128.3832 55.4082 27.5792 174.7672 19 Y 4.4805 8.0085 118.0652 59.3056 39.3878 178.3994 20 G 4.3562 8.1226 106.0830 45.6140 0.0000 172.2381 21 D 4.9187 7.4460 117.4409 58.4140 41.9558 178.8899 22 N 3.6929 8.5360 115.2071 56.3758 34.5603 174.3993 23 C 3.8756 6.9771 114.4945 60.0549 29.3178 173.4317 24 E 4.9589 8.2773 129.4420 56.4189 30.1272 176.9689 25 V 4.2256 8.0112 117.1580 65.3691 33.8016 175.1480 26 C 4.5286 8.1755 111.2295 60.5056 31.6399 173.4017 27 G 3.9038 9.0468 107.8017 48.2644 0.0000 173.4440 28 A 4.2110 7.7679 122.8160 51.5909 17.9457 177.6122 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 8.35 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 2 S 7.91 4.59 0.00 3.93 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 3 D 9.12 5.08 0.00 2.74 2.67 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.31 3.95 0.00 1.94 2.15 0.00 3.35 0.00 0.00 3.19 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.71 0.00 5 F 7.71 4.43 0.00 3.03 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 V 8.90 4.04 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 0.00 0.00 0.97 0.00 0.00 7 K 8.51 3.60 0.00 2.03 1.89 0.00 1.86 0.00 0.00 1.83 0.00 0.00 2.91 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.42 1.44 7.81 8 G 7.90 3.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.48 4.08 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.00 0.00 10 C 7.56 3.38 0.00 2.58 2.63 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.17 0.00 2.22 2.43 0.00 4.04 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.07 0.00 12 K 8.11 4.10 0.00 1.76 1.88 0.00 1.77 0.00 0.00 1.77 0.00 0.00 3.03 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.39 1.42 7.81 13 C 8.21 4.41 0.00 3.08 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 14 K 7.68 4.38 0.00 1.74 1.87 0.00 1.71 0.00 0.00 1.57 0.00 0.00 2.94 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.37 1.32 7.81 15 S 8.42 4.37 0.00 3.84 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 16 P 0.00 3.94 0.00 2.10 2.07 0.00 3.64 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.10 0.00 17 D 7.48 4.53 0.00 3.13 2.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 18 Q 7.71 4.25 0.00 1.42 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.72 6.74 0.00 0.00 0.00 0.00 0.00 2.12 2.22 0.00 19 Y 8.01 4.48 0.00 2.99 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 G 8.12 4.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 D 7.45 4.92 0.00 2.87 2.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 N 8.54 3.69 0.00 2.79 2.94 0.00 0.00 7.25 7.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 C 6.98 3.88 0.00 3.19 3.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 E 8.28 4.96 0.00 2.11 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 2.27 0.00 25 V 8.01 4.23 2.08 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 0.83 0.00 0.00 0.91 0.00 0.00 26 C 8.18 4.53 0.00 3.10 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 27 G 9.05 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 A 7.77 4.21 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