NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 F 4.8380 8.3244 122.8224 57.5161 40.9300 175.7705 2 V 4.0513 8.0958 119.8493 60.4972 32.9288 172.9810 3 N 4.7775 8.2794 126.6299 51.6746 38.1325 173.3361 4 Q 4.6654 7.2596 118.6958 54.7676 32.6179 173.3336 5 H 4.2264 8.9392 121.0046 55.9758 29.2529 175.3153 6 L 4.6016 8.3871 122.6922 53.4192 43.5086 175.6100 7 C 4.8977 8.4593 120.9553 57.9797 32.2758 178.5636 8 G 3.8206 8.2587 111.8696 47.2226 0.0000 177.3510 9 S 4.1272 8.6046 122.1338 59.5266 63.6675 175.4431 10 H 4.3875 7.9642 118.9517 58.0647 28.4163 177.2274 11 L 3.9468 7.3243 122.8019 58.1053 42.0026 179.2178 12 V 3.2970 7.3381 111.4632 63.6850 31.5067 178.1252 13 E 4.0344 7.7593 117.6734 58.7290 29.2730 178.9342 14 A 3.9445 7.7037 120.6925 55.0924 18.4612 179.4805 15 L 3.6794 7.6552 117.5015 58.0577 41.3749 179.0946 16 Y 4.1460 7.3780 119.1288 60.6288 38.4642 178.0934 17 L 3.8623 7.7216 119.7794 58.1254 42.4057 178.5621 18 V 3.7325 7.7869 117.0830 66.4501 31.5451 177.5285 19 C 4.2728 8.2812 115.5152 60.6438 28.3231 175.6032 20 G 3.8012 8.2967 108.9767 46.2769 0.0000 176.8783 21 E 3.8216 8.9045 122.9227 59.0950 29.5177 178.2338 22 R 3.8768 8.0254 117.2011 59.6287 30.1680 176.9581 23 G 3.9153 8.7329 100.7576 44.8729 0.0000 171.4761 24 F 4.9083 7.5345 112.4941 55.5824 40.5873 173.1953 25 F 4.9641 8.1498 115.3000 55.0532 39.7172 173.5664 26 Y 4.7770 9.0029 126.1999 56.0265 40.1443 174.9044 27 T 4.2815 7.8834 123.2971 61.3549 70.2914 171.6140 28 P 4.5022 0.0000 0.0000 62.4983 31.7375 177.7153 29 K 4.0971 7.5513 118.7693 59.5564 32.0994 177.1898 30 T 4.0831 7.5023 111.4694 62.2184 68.0803 172.9765 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 F 8.32 4.84 0.00 2.92 2.95 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 0.00 2 V 8.10 4.05 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.66 0.00 0.00 -0.04 0.00 0.00 3 N 8.28 4.78 0.00 2.74 2.76 0.00 0.00 7.02 7.08 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 4 Q 7.26 4.67 0.00 1.99 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.87 6.70 0.00 0.00 0.00 0.00 0.00 2.26 2.36 0.00 5 H 8.94 4.23 0.00 3.12 3.25 0.00 5.89 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6 L 8.39 4.60 0.00 1.59 1.58 0.92 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 7 C 8.46 4.90 0.00 3.00 2.86 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 8 G 8.26 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 S 8.60 4.13 0.00 3.88 4.01 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 10 H 7.96 4.39 0.00 3.33 3.32 0.00 5.61 0.00 0.00 0.00 0.00 6.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 L 7.32 3.95 0.00 1.84 1.72 0.96 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 12 V 7.34 3.30 1.93 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 -0.06 0.00 0.00 0.77 0.00 0.00 13 E 7.76 4.03 0.00 2.05 1.97 0.00 0.00 0.00 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 2.41 0.00 14 A 7.70 3.94 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 7.66 3.68 0.00 0.94 0.54 0.78 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 16 Y 7.38 4.15 0.00 3.19 3.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 L 7.72 3.86 0.00 1.89 1.71 0.96 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 18 V 7.79 3.73 2.13 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 0.82 0.00 0.00 1.08 0.00 0.00 19 C 8.28 4.27 0.00 3.10 3.15 0.00 0.00 0.00 0.00 0.00 0.00 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 8.30 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 0.00 0.00 0.00 21 E 8.90 3.82 0.00 1.96 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 2.30 2.31 0.00 22 R 8.03 3.88 0.00 2.02 2.04 0.00 3.20 0.00 0.00 3.25 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.65 0.00 23 G 8.73 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 F 7.53 4.91 0.00 3.01 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 25 F 8.15 4.96 0.00 3.17 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 26 Y 9.00 4.78 0.00 3.16 3.11 0.00 0.00 0.00 0.00 0.00 0.00 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 T 7.88 4.28 4.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 28 P 0.00 4.50 0.00 2.14 1.91 0.00 3.63 0.00 0.00 3.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 2.03 0.00 29 K 7.55 4.10 0.00 1.78 1.89 0.00 1.75 0.00 0.00 1.74 0.00 0.00 3.04 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.44 1.50 7.81 30 T 7.50 4.08 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 1.21 0.00 0.00