NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 A 4.2589 8.2644 123.5843 52.2579 19.4393 176.1706 3 R 4.1169 7.0052 122.9620 56.3603 31.2373 174.5844 4 K 3.7939 8.3417 120.1172 59.9523 32.7246 178.4012 5 A 4.1038 7.9498 120.0795 55.1875 17.8979 179.4389 6 L 4.0663 7.8274 117.2969 57.6161 41.6557 179.4280 7 I 3.8659 8.1628 112.8276 63.4921 37.4009 177.3829 8 E 4.1752 7.8294 119.7675 58.3708 29.5352 177.7492 9 K 3.9175 8.1595 117.8897 57.8601 32.3103 176.8398 10 A 4.1672 7.2771 119.0020 53.2919 19.8989 177.4320 11 K 4.2004 7.3565 118.1044 59.2143 34.9844 177.1657 12 R 3.9622 7.7866 121.3709 56.9241 29.7432 177.5896 13 T 4.4369 8.0051 123.8329 61.2335 67.4412 173.9309 14 P 4.0840 0.0000 0.0000 64.3342 32.0673 177.1109 15 K 3.9250 6.3935 116.8267 54.4757 35.4050 176.5301 16 F 3.7967 5.8566 116.3515 56.4310 36.7999 176.9386 17 K 3.9068 9.0255 125.2039 60.1844 32.2685 179.0771 18 V 3.6584 8.0949 111.3520 64.4824 31.7791 177.8462 19 R 3.9921 8.4129 117.5909 59.1142 29.9606 176.1813 20 A 3.8098 7.3866 122.2173 52.5164 17.9429 176.1527 21 Y 4.8787 7.4815 119.5566 55.3300 40.7498 175.6582 22 T 4.1015 8.5292 111.4387 61.7277 69.5175 173.1866 23 R 4.6861 7.8081 119.2069 55.8962 32.3541 173.3101 24 C 4.5562 9.2908 126.0864 59.7907 32.1650 173.8505 25 V 4.0218 8.3912 118.5762 63.5019 32.0056 178.4104 26 R 4.1311 8.1838 118.2287 58.4667 30.2453 176.2830 27 C 4.9312 7.6912 109.7469 55.8908 33.0039 174.7081 28 G 3.9335 8.4543 110.1003 45.3661 0.0000 173.4996 29 R 4.3671 7.6377 119.4579 55.2549 31.9335 176.0842 30 A 4.3845 8.6288 126.8381 53.2494 20.8386 177.2525 31 R 4.3463 7.8355 113.0215 55.9756 32.0725 176.2042 32 S 3.4455 8.3407 112.8906 59.3537 61.1240 171.6800 33 V 4.7839 7.0979 118.5852 60.7590 32.6937 174.5281 34 Y 4.1371 8.8083 126.5725 57.9364 37.7925 178.3936 35 R 4.6005 8.5012 126.6376 55.7957 28.9064 177.2098 36 F 4.5733 8.2566 118.1271 59.0696 42.6498 174.3260 37 F 4.7878 8.7336 116.9808 56.1002 40.4587 176.6702 38 G 4.0212 8.3232 108.0025 46.0374 0.0000 173.4878 39 L 5.1206 7.7149 120.6679 53.4370 44.2212 174.7742 40 C 5.6587 8.4444 112.0952 55.2428 32.7848 174.5478 41 R 4.1442 8.9648 116.9778 60.3542 28.6477 177.1750 42 I 3.9915 7.9276 120.2354 62.2106 37.2127 177.0502 43 C 4.0988 7.9770 118.5656 62.6096 28.4469 176.2713 44 L 3.7088 8.5026 121.7930 58.0744 41.5320 178.6443 45 R 4.0514 7.7170 115.4075 57.9683 29.8087 177.5274 46 E 4.1222 7.7190 118.0109 59.6326 29.9498 178.2132 47 L 4.0047 8.0393 118.4396 57.7238 41.5703 179.4073 48 A 3.9200 7.7330 119.7161 55.8328 18.3857 179.0968 49 H 4.1828 7.7311 112.8022 57.9866 28.8873 177.5606 50 K 4.0559 8.3746 119.7067 56.7602 31.6893 176.7196 51 G 4.2348 8.3987 120.6552 46.2714 0.0000 175.1433 52 Q 4.0693 8.4213 116.1484 56.6867 28.2995 176.0242 53 L 4.6862 7.9759 119.3992 51.9468 43.0961 174.1826 54 P 4.2772 0.0000 0.0000 64.2405 31.2361 175.2948 55 G 3.9193 7.7010 115.1163 45.5518 0.0000 173.7762 56 V 3.3097 7.0525 121.9638 61.0657 30.3926 175.4939 57 R 4.6172 8.0827 126.7340 53.7642 33.1441 175.0796 58 K 3.9771 8.5532 123.3577 55.9872 30.4282 175.9684 59 A 4.0172 7.8830 127.2971 51.9425 19.0868 177.3158 60 S 4.6944 8.1396 110.6600 57.7297 64.7424 177.1121 61 W 4.8333 8.3265 124.5806 56.7969 27.9456 174.7404 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 2 A 8.26 4.26 1.30 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 0.00 0.00 3 R 7.01 4.12 0.00 1.97 1.81 0.00 3.23 0.00 0.00 3.32 7.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.77 0.00 4 K 8.34 3.79 0.00 1.91 1.83 0.00 1.67 0.00 0.00 1.83 0.00 0.00 3.05 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.53 1.61 7.81 5 A 7.95 4.10 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 7.83 4.07 0.00 2.01 1.83 0.99 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 7 I 8.16 3.87 1.89 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.52 0.94 0.00 0.00 8 E 7.83 4.18 0.00 2.27 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 2.34 0.00 9 K 8.16 3.92 0.00 2.00 1.87 0.00 1.88 0.00 0.00 1.74 0.00 0.00 3.13 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.49 1.46 7.81 10 A 7.28 4.17 0.96 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 0.00 0.00 11 K 7.36 4.20 0.00 1.78 1.68 0.00 1.86 0.00 0.00 1.73 0.00 0.00 3.03 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.30 1.37 7.81 12 R 7.79 3.96 0.00 1.86 1.95 0.00 3.03 0.00 0.00 3.18 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.68 0.00 13 T 8.01 4.44 4.20 0.00 0.00 0.00 0.00 0.00 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 14 P 0.00 4.08 0.00 2.09 2.13 0.00 3.71 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 1.94 0.00 15 K 6.39 3.93 0.00 1.57 0.78 0.00 0.95 0.00 0.00 1.16 0.00 0.00 2.83 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.11 1.31 7.81 16 F 5.86 3.80 0.00 3.19 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 17 K 9.03 3.91 0.00 1.95 2.14 0.00 1.57 0.00 0.00 1.85 0.00 0.00 3.12 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.58 1.56 7.81 18 V 8.09 3.66 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 0.77 0.00 0.00 1.11 0.00 0.00 19 R 8.41 3.99 0.00 1.99 2.13 0.00 3.33 0.00 0.00 3.35 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.75 0.00 20 A 7.39 3.81 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Y 7.48 4.88 0.00 3.07 3.02 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 0.00 0.00 0.00 22 T 8.53 4.10 4.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 23 R 7.81 4.69 0.00 1.85 1.82 0.00 3.29 0.00 0.00 3.44 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.53 0.00 24 C 9.29 4.56 0.00 3.00 3.25 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 0.00 25 V 8.39 4.02 2.11 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 0.76 0.00 0.00 1.01 0.00 0.00 26 R 8.18 4.13 0.00 1.83 2.00 0.00 3.16 0.00 0.00 3.29 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.64 0.00 27 C 7.69 4.93 0.00 3.04 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 28 G 8.45 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 29 R 7.64 4.37 0.00 1.94 1.85 0.00 3.22 0.00 0.00 3.37 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.86 0.00 30 A 8.63 4.38 1.26 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 0.00 0.00 0.00 0.00 0.00 0.00 31 R 7.84 4.35 0.00 1.82 1.86 0.00 3.35 0.00 0.00 3.27 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.59 0.00 32 S 8.34 3.45 0.00 4.15 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 33 V 7.10 4.78 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 1.34 0.00 0.00 1.06 0.00 0.00 34 Y 8.81 4.14 0.00 3.41 3.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 R 8.50 4.60 0.00 1.97 2.07 0.00 3.02 0.00 0.00 3.19 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.70 0.00 36 F 8.26 4.57 0.00 2.92 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 37 F 8.73 4.79 0.00 3.28 3.08 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 0.00 0.00 0.00 0.00 38 G 8.32 4.02 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 0.00 0.00 0.00 0.00 0.00 0.00 39 L 7.71 5.12 0.00 1.88 1.68 0.91 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 40 C 8.44 5.66 0.00 3.29 3.07 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 0.00 0.00 0.00 41 R 8.96 4.14 0.00 2.11 2.36 0.00 3.09 0.00 0.00 3.27 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.81 0.00 42 I 7.93 3.99 1.88 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 1.65 0.90 0.94 0.00 0.00 43 C 7.98 4.10 0.00 2.98 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 44 L 8.50 3.71 0.00 1.44 1.76 0.43 0.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 0.00 0.00 0.00 0.00 45 R 7.72 4.05 0.00 1.88 1.93 0.00 3.31 0.00 0.00 3.19 7.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.66 0.00 46 E 7.72 4.12 0.00 2.23 1.89 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 2.32 2.53 0.00 47 L 8.04 4.00 0.00 1.64 1.70 0.92 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 48 A 7.73 3.92 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 H 7.73 4.18 0.00 3.23 3.39 0.00 5.85 0.00 0.00 0.00 0.00 7.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 K 8.37 4.06 0.00 1.90 1.61 0.00 1.76 0.00 0.00 1.71 0.00 0.00 3.04 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.48 1.65 7.81 51 G 8.40 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 0.00 0.00 0.00 0.00 52 Q 8.42 4.07 0.00 2.06 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.09 6.83 0.00 0.00 0.00 0.00 0.00 2.38 2.39 0.00 53 L 7.98 4.69 0.00 1.65 1.60 0.69 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 54 P 0.00 4.28 0.00 2.14 2.07 0.00 3.88 0.00 0.00 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.16 0.00 55 G 7.70 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 56 V 7.05 3.31 2.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.67 0.00 0.00 0.96 0.00 0.00 57 R 8.08 4.62 0.00 1.92 1.74 0.00 3.31 0.00 0.00 3.17 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.58 0.00 58 K 8.55 3.98 0.00 1.72 1.73 0.00 1.84 0.00 0.00 1.66 0.00 0.00 2.79 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.34 1.33 7.81 59 A 7.88 4.02 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 60 S 8.14 4.69 0.00 3.79 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 61 W 8.33 4.83 0.00 3.29 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