NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 I 4.1128 8.0093 120.7866 61.0314 39.1808 174.4562 2 T 4.4289 8.3125 116.8432 59.2982 70.8007 172.0997 3 A 4.7510 8.8880 126.8377 49.9013 23.2034 177.2152 4 K 4.2193 8.3831 119.3984 55.5536 32.8343 175.4710 5 P 4.3978 0.0000 0.0000 61.7503 31.9166 176.5094 6 A 4.0207 8.4597 123.1253 52.5998 18.4569 178.2916 7 K 4.1681 8.7791 123.3873 59.3269 32.5626 177.7704 8 T 4.6252 7.3362 107.3554 58.4441 68.5274 170.9440 9 P 4.1932 0.0000 0.0000 64.0653 32.2841 176.1647 10 T 5.1827 8.4533 118.4818 61.1146 69.4363 175.5366 11 S 4.3524 8.5012 122.0490 57.3290 65.1968 173.0269 12 P 4.1760 0.0000 0.0000 65.8037 31.1029 178.4202 13 K 3.7922 8.1452 117.6657 59.9740 31.9469 178.2648 14 E 3.9870 8.2492 118.4401 59.5910 29.3415 179.4789 15 Q 4.0080 8.6828 118.2504 58.5401 28.6125 178.7359 16 A 3.8721 8.0371 122.0035 55.2445 18.4433 179.2163 17 I 3.6964 7.7846 118.4233 64.8823 37.1711 178.6777 18 G 3.6323 8.1979 105.8568 47.7814 0.0000 174.9599 19 L 3.8348 7.9368 122.9473 58.0787 41.9659 179.1582 20 S 4.0313 8.1198 114.7515 61.5904 62.7850 176.7593 21 V 3.6308 8.1134 121.1626 66.4990 31.1077 178.1280 22 T 4.0313 8.1886 115.1866 66.8866 68.3646 176.6528 23 F 4.2384 8.8661 120.0305 60.7510 38.8864 177.8394 24 L 4.1524 8.6242 119.2469 57.6703 41.1325 179.7401 25 S 4.1699 8.3309 113.9598 61.4366 63.3130 176.3507 26 F 4.1849 8.4598 121.2005 60.2668 38.6818 177.6163 27 L 4.1513 8.3361 118.5507 57.3822 41.5184 179.2165 28 L 4.0309 8.2002 119.0732 57.4017 41.5765 177.7646 29 P 4.3066 0.0000 0.0000 65.6728 31.3847 178.2638 30 A 4.1839 7.5492 117.3035 55.6451 18.2254 179.9948 31 G 3.6573 8.2908 103.8495 47.2682 0.0000 175.8271 32 W 4.2140 8.7370 131.1312 60.5036 30.5495 178.2459 33 V 3.7927 8.1636 116.8059 66.1862 31.3905 177.6947 34 L 4.1772 8.4666 119.1733 57.8611 41.2296 178.7799 35 Y 3.9156 8.2663 119.0803 60.6399 39.0228 176.9801 36 H 4.1032 7.8310 114.7924 55.3027 28.8188 176.7735 37 L 3.8392 7.2061 123.4803 58.2481 41.1275 179.1100 38 D 4.2095 7.6291 116.9534 57.3138 41.0535 177.6176 39 N 4.2843 7.7794 115.4911 56.4611 38.4672 176.5968 40 Y 4.4787 7.2084 117.2966 61.3455 38.1813 177.4214 41 K 4.0359 7.8130 117.5727 58.1921 33.2019 177.9644 42 K 4.4271 7.5728 124.4441 54.6965 31.2244 176.6260 43 S 4.2137 7.9590 118.6326 58.3184 63.9052 174.0877 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 I 8.01 4.11 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 1.47 1.35 0.91 0.00 0.00 2 T 8.31 4.43 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 3 A 8.89 4.75 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.38 4.22 0.00 1.76 1.77 0.00 1.75 0.00 0.00 1.70 0.00 0.00 2.85 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.44 1.46 7.81 5 P 0.00 4.40 0.00 2.04 1.98 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 2.02 2.07 0.00 6 A 8.46 4.02 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.78 4.17 0.00 1.76 1.89 0.00 1.70 0.00 0.00 1.76 0.00 0.00 3.04 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.44 1.43 7.81 8 T 7.34 4.63 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 9 P 0.00 4.19 0.00 2.06 2.04 0.00 3.65 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.22 0.00 10 T 8.45 5.18 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 1.23 0.00 0.00 11 S 8.50 4.35 0.00 4.04 3.99 0.00 0.00 0.00 0.00 0.00 0.00 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 4.18 0.00 2.16 2.14 0.00 3.61 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.15 0.00 13 K 8.15 3.79 0.00 1.77 1.82 0.00 1.73 0.00 0.00 1.81 0.00 0.00 2.96 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.50 1.50 7.81 14 E 8.25 3.99 0.00 2.28 1.98 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 2.32 2.34 0.00 15 Q 8.68 4.01 0.00 2.15 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.82 0.00 0.00 0.00 0.00 0.00 2.36 2.56 0.00 16 A 8.04 3.87 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 I 7.78 3.70 2.01 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.77 0.91 0.00 0.00 18 G 8.20 3.63 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 0.00 0.00 0.00 19 L 7.94 3.83 0.00 1.77 1.62 0.58 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.69 0.00 0.00 0.00 0.00 0.00 0.00 20 S 8.12 4.03 0.00 3.88 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 21 V 8.11 3.63 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 1.00 0.00 0.00 22 T 8.19 4.03 4.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 23 F 8.87 4.24 0.00 2.90 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 24 L 8.62 4.15 0.00 1.88 1.78 0.96 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 25 S 8.33 4.17 0.00 4.01 4.06 0.00 0.00 0.00 0.00 0.00 0.00 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 F 8.46 4.18 0.00 3.15 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 L 8.34 4.15 0.00 1.78 1.77 0.98 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 28 L 8.20 4.03 0.00 1.78 1.75 0.94 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 29 P 0.00 4.31 0.00 2.19 2.11 0.00 3.87 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.13 0.00 30 A 7.55 4.18 1.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31 G 8.29 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 W 8.74 4.21 0.00 3.50 3.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 V 8.16 3.79 2.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.00 0.00 1.23 0.00 0.00 34 L 8.47 4.18 0.00 2.01 1.75 0.98 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 35 Y 8.27 3.92 0.00 2.94 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 36 H 7.83 4.10 0.00 2.47 2.12 0.00 5.91 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 L 7.21 3.84 0.00 1.79 1.66 0.92 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 38 D 7.63 4.21 0.00 2.59 2.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 39 N 7.78 4.28 0.00 2.43 2.76 0.00 0.00 6.93 7.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 40 Y 7.21 4.48 0.00 3.05 2.88 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 41 K 7.81 4.04 0.00 1.85 1.85 0.00 1.67 0.00 0.00 1.60 0.00 0.00 2.96 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.50 1.50 7.81 42 K 7.57 4.43 0.00 1.71 1.71 0.00 1.66 0.00 0.00 1.70 0.00 0.00 3.10 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.36 1.42 7.81 43 S 7.96 4.21 0.00 3.97 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00