NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1A D 4.5739 8.2076 120.1921 53.1655 43.2031 174.8419 1 C 3.5346 7.9641 112.5816 60.1261 29.5352 172.7090 2 G 3.8623 9.7146 111.2169 45.7921 0.0000 174.0355 3 L 4.6530 7.3525 118.5064 52.5116 43.2836 176.5467 4 R 4.2507 8.9055 124.1596 55.1170 30.7343 176.0249 5 P 4.2132 0.0000 0.0000 65.3396 31.4051 177.1292 6 L 4.2592 7.7572 114.5073 54.5412 42.3699 176.1091 7 F 4.5355 7.7831 115.1916 57.5217 42.2167 176.7987 8 E 4.0028 9.0565 121.7226 60.1744 30.0189 179.7666 9 K 4.2522 8.0712 114.3910 57.9809 32.2200 177.5309 10 K 4.4698 7.5165 116.2999 55.0320 33.2832 175.5461 11 S 3.7527 7.8876 111.9999 59.4213 61.2496 171.7701 12 L 4.8269 8.2864 117.3555 52.6448 43.7830 176.3257 13 E 4.7270 8.6008 122.1752 54.9669 30.9732 175.9202 14 D 4.6283 8.8915 122.7721 52.3548 40.2594 176.8007 14A K 4.2151 8.3924 118.1452 58.6911 33.0618 177.4933 14B T 4.6268 8.2393 108.7266 60.4463 70.2575 175.5078 14C E 3.8931 8.2244 123.0651 59.7498 29.6200 178.5824 14D R 3.8092 8.0051 119.1905 59.3402 29.7203 177.8204 14E E 3.8771 7.6982 117.9631 59.0328 29.9889 178.6457 14F L 3.7910 7.4974 118.4638 57.7633 41.9127 179.3441 14G L 3.6343 7.4806 118.7759 57.6038 41.2903 179.3572 14H E 4.0604 7.9285 117.6458 58.4856 29.4785 178.5975 14I S 4.4163 7.4456 112.4830 59.3739 63.8971 173.7306 14J Y 4.7680 7.6124 120.5728 59.3680 38.2031 175.5625 14K I 3.6648 7.8941 118.2040 61.5052 39.1808 173.5222 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 1A D 8.21 4.57 0.00 2.70 2.73 0.00 0.00 0.00 0.00 0.00 0.00 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 C 7.96 3.53 0.00 3.20 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 2 G 9.71 3.86 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 0.00 0.00 0.00 3 L 7.35 4.65 0.00 1.68 1.63 0.94 0.89 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 4 R 8.91 4.25 0.00 2.25 2.09 0.00 3.23 0.00 0.00 3.16 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.76 0.00 5 P 0.00 4.21 0.00 2.03 2.13 0.00 3.71 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.14 0.00 6 L 7.76 4.26 0.00 1.43 0.99 0.84 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 7 F 7.78 4.54 0.00 3.10 3.01 0.00 0.00 0.00 0.00 0.00 0.00 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 E 9.06 4.00 0.00 2.22 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 2.45 2.48 0.00 9 K 8.07 4.25 0.00 2.10 1.86 0.00 1.71 0.00 0.00 1.72 0.00 0.00 3.02 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.52 1.42 7.81 10 K 7.52 4.47 0.00 1.61 1.71 0.00 1.82 0.00 0.00 1.49 0.00 0.00 2.81 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.28 1.33 7.81 11 S 7.89 3.75 0.00 3.99 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 12 L 8.29 4.83 0.00 1.59 1.61 0.80 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 13 E 8.60 4.73 0.00 2.00 1.88 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 2.28 2.31 0.00 14 D 8.89 4.63 0.00 2.33 1.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14A K 8.39 4.22 0.00 1.88 1.99 0.00 1.52 0.00 0.00 1.76 0.00 0.00 3.02 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.41 1.40 7.81 14B T 8.24 4.63 4.19 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 0.00 0.00 0.00 1.18 0.00 0.00 14C E 8.22 3.89 0.00 2.14 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.31 0.00 14D R 8.01 3.81 0.00 1.86 1.94 0.00 3.16 0.00 0.00 3.24 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.67 0.00 14E E 7.70 3.88 0.00 1.98 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 0.00 2.26 2.30 0.00 14F L 7.50 3.79 0.00 1.75 1.34 0.84 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 14G L 7.48 3.63 0.00 1.56 1.64 1.01 0.98 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 14H E 7.93 4.06 0.00 1.92 1.96 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 2.30 2.39 0.00 14I S 7.45 4.42 0.00 4.06 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14J Y 7.61 4.77 0.00 2.97 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 14K I 7.89 3.66 1.90 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.47 0.93 0.00 0.00