NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 4 Y 5.0908 8.1293 121.6984 57.2385 41.6201 174.7444 5 R 4.6098 7.5592 123.0626 54.9860 28.8835 177.1678 6 C 5.8833 9.0848 113.8918 60.4454 30.6518 172.3056 7 G 3.9874 7.5463 112.1735 45.1540 0.0000 171.0796 8 K 5.1586 8.3026 117.6387 55.3055 36.2363 174.6894 9 C 5.2771 8.1194 119.6560 54.9546 45.9224 172.0754 10 W 4.7369 8.4799 128.9133 57.0429 30.8017 174.2348 11 K 3.2040 6.9230 126.5334 57.3777 28.7807 177.4008 12 T 4.0433 6.8357 111.6178 60.4852 67.2895 171.9303 13 F 5.0198 7.7257 126.0389 59.1845 38.0194 173.0701 14 T 4.6413 8.3106 118.8221 61.2371 71.6148 172.9445 15 D 5.3421 9.1839 127.4682 53.8632 41.5891 175.8719 16 E 4.8306 8.6887 120.5089 54.1492 33.6838 175.3200 17 Q 4.4227 8.6284 122.2960 55.7020 29.8602 176.6486 18 L 4.1039 8.3324 121.9109 56.8003 42.1366 177.3314 19 K 4.2349 7.4516 116.4449 56.7239 30.5513 176.4080 20 V 4.5206 7.5565 116.1163 59.4557 34.7846 175.6449 21 L 4.2542 8.0814 120.0572 54.1813 44.5407 172.6100 22 P 4.6740 0.0000 0.0000 62.9347 32.9788 175.4564 23 G 4.3716 7.7838 108.6851 44.5643 0.0000 173.8968 24 V 4.2519 8.0969 114.7534 60.0835 30.3181 174.7984 25 R 4.9266 7.3909 122.7033 54.9119 34.8691 175.8127 26 C 4.5439 8.7596 122.1844 55.9387 44.3498 171.5755 27 P 4.2993 0.0000 0.0000 63.0090 31.2888 176.0130 28 Y 3.6880 8.5755 126.5022 58.5256 36.7380 168.2540 29 C 4.5158 7.6567 116.4850 60.5157 34.9239 176.0932 30 G 3.9289 8.2243 105.2644 46.8328 0.0000 172.4962 31 Y 4.7837 7.7561 117.9534 55.3904 42.1421 175.2141 32 K 4.2027 7.0760 122.5446 56.5402 34.3728 176.5477 33 I 3.6558 6.3697 119.3383 60.7896 36.7516 174.8752 34 I 4.7036 7.6584 125.3794 57.4843 40.1038 174.3757 35 F 4.9875 8.8569 133.9628 57.4417 40.4456 175.6163 36 M 4.7545 8.6953 124.1595 55.8328 34.7402 174.7408 37 V 4.1345 8.3651 124.9891 59.8495 33.4397 175.6694 38 R 3.8547 8.2877 120.7067 56.2265 30.4467 176.1087 39 K 4.0515 8.5358 125.6380 55.9485 32.4404 175.9958 40 P 4.6466 0.0000 0.0000 63.5496 30.7629 176.1256 41 T 4.4415 7.8442 115.5575 62.7269 69.7497 174.4719 42 I 3.9424 8.1667 124.7701 60.5736 38.6356 175.1764 43 K 4.5669 8.5049 126.8680 54.8004 34.0520 176.8313 44 I 4.1359 8.0465 125.5811 59.7931 35.8183 174.7990 45 V 3.7752 7.7569 123.4828 62.2945 32.3631 175.9018 46 K 4.3439 8.3714 125.4536 55.7360 33.0871 176.7847 47 A 4.3172 8.3243 123.5554 53.5065 19.5800 177.7226 48 I 3.8655 7.9090 120.6351 62.0163 37.1468 175.6859 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 4 Y 8.13 5.09 0.00 2.83 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 5 R 7.56 4.61 0.00 2.04 1.09 0.00 3.14 0.00 0.00 3.25 7.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.75 0.00 6 C 9.08 5.88 0.00 3.11 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 7 G 7.55 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 0.00 0.00 0.00 8 K 8.30 5.16 0.00 2.02 2.04 0.00 1.42 0.00 0.00 1.47 0.00 0.00 3.21 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.60 1.40 7.81 9 C 8.12 5.28 0.00 3.17 3.23 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 0.00 10 W 8.48 4.74 0.00 2.87 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 0.00 0.00 0.00 11 K 6.92 3.20 0.00 1.47 1.43 0.00 1.38 0.00 0.00 1.09 0.00 0.00 2.32 0.00 0.00 2.58 0.00 0.00 0.00 0.00 0.30 0.67 7.81 12 T 6.84 4.04 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 13 F 7.73 5.02 0.00 2.93 2.97 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 0.00 0.00 0.00 14 T 8.31 4.64 4.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 15 D 9.18 5.34 0.00 2.58 2.65 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.69 4.83 0.00 2.03 2.05 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 2.31 2.32 0.00 17 Q 8.63 4.42 0.00 2.18 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.88 6.97 0.00 0.00 0.00 0.00 0.00 2.45 2.54 0.00 18 L 8.33 4.10 0.00 1.67 1.72 0.94 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 19 K 7.45 4.23 0.00 1.91 1.80 0.00 1.73 0.00 0.00 1.72 0.00 0.00 2.99 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.50 1.57 7.81 20 V 7.56 4.52 2.10 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 0.74 0.00 0.00 0.98 0.00 0.00 21 L 8.08 4.25 0.00 1.56 1.51 0.93 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 22 P 0.00 4.67 0.00 2.21 2.15 0.00 3.78 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 1.95 0.00 23 G 7.78 4.37 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 0.00 24 V 8.10 4.25 2.06 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 0.75 0.00 0.00 0.89 0.00 0.00 25 R 7.39 4.93 0.00 1.66 1.83 0.00 3.20 0.00 0.00 3.12 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.58 0.00 26 C 8.76 4.54 0.00 3.14 3.12 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.30 0.00 2.06 2.06 0.00 3.98 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 2.08 2.13 0.00 28 Y 8.58 3.69 0.00 3.04 3.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 C 7.66 4.52 0.00 3.12 2.99 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 30 G 8.22 3.93 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31 Y 7.76 4.78 0.00 3.00 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 32 K 7.08 4.20 0.00 1.38 1.59 0.00 1.66 0.00 0.00 1.59 0.00 0.00 2.78 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.22 1.24 7.81 33 I 6.37 3.66 2.06 0.00 0.00 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.16 0.52 0.00 0.00 34 I 7.66 4.70 1.90 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 1.89 0.92 0.00 0.00 35 F 8.86 4.99 0.00 3.02 2.71 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 36 M 8.70 4.75 0.00 2.01 1.92 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.47 2.49 0.00 37 V 8.37 4.13 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.77 0.00 0.00 0.90 0.00 0.00 38 R 8.29 3.85 0.00 1.76 1.87 0.00 3.23 0.00 0.00 3.15 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.62 0.00 39 K 8.54 4.05 0.00 1.79 1.68 0.00 1.75 0.00 0.00 1.89 0.00 0.00 2.93 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.58 1.40 7.81 40 P 0.00 4.65 0.00 2.26 2.17 0.00 3.99 0.00 0.00 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.12 0.00 41 T 7.84 4.44 4.27 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 1.24 0.00 0.00 42 I 8.17 3.94 1.88 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 1.42 0.75 0.92 0.00 0.00 43 K 8.50 4.57 0.00 1.75 1.69 0.00 1.81 0.00 0.00 1.71 0.00 0.00 2.97 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.50 1.36 7.81 44 I 8.05 4.14 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 0.38 0.91 0.00 0.00 45 V 7.76 3.78 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 0.79 0.00 0.00 0.93 0.00 0.00 46 K 8.37 4.34 0.00 1.78 1.71 0.00 1.79 0.00 0.00 1.71 0.00 0.00 2.98 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.41 1.43 7.81 47 A 8.32 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 48 I 7.91 3.87 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 1.27 0.57 0.91 0.00 0.00