NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 22 Q 4.4182 8.2033 119.6406 56.2565 31.2206 172.9370 23 T 4.9073 8.4653 116.0407 60.9445 71.5101 172.7561 24 C 4.6542 8.4012 126.2005 59.4978 32.1600 173.3269 25 Y 4.3430 8.5598 121.3952 59.4115 37.9922 176.4353 26 N 4.4446 7.4420 114.6906 54.8283 41.7863 175.0606 27 C 4.0571 7.8914 115.2720 60.7000 28.3893 175.2944 28 G 3.9695 7.9518 105.3522 45.6301 0.0000 173.5470 29 K 4.3258 7.1355 119.4923 54.5414 33.2236 176.1324 30 P 4.9466 0.0000 0.0000 63.5774 32.6899 176.2290 31 G 3.9898 8.7354 106.1650 47.4201 0.0000 172.9971 32 H 4.9358 8.1582 115.0598 53.8605 31.6907 173.3632 33 L 4.5813 7.8803 120.0800 53.7174 45.5577 176.6847 34 S 4.3055 8.6789 115.1535 60.3926 62.5956 175.2997 35 S 4.6571 7.7242 112.9257 57.9964 64.6501 175.0676 36 Q 4.0523 7.9829 122.2843 58.5466 28.9028 174.8010 37 C 5.0065 7.5744 112.1562 57.7112 32.5670 173.7465 38 R 3.8848 8.6231 118.8290 59.5111 29.8613 176.9688 39 A 4.4318 6.9119 117.6774 50.0737 22.0107 173.5555 40 P 4.7313 0.0000 0.0000 61.7926 32.2724 177.2917 41 K 3.9314 8.6595 120.1431 58.9812 32.0855 177.6420 42 V 3.3881 7.7408 117.4821 65.8921 31.7721 174.6409 43 C 4.6632 7.9458 119.2830 58.5427 33.2846 172.6968 44 F 4.5339 8.4271 107.5986 56.9128 39.9937 174.3999 45 K 4.3107 6.8080 119.8920 57.5591 38.9234 176.4206 46 C 3.9930 7.4548 113.6407 58.9680 29.9584 174.0524 47 K 3.9392 8.0365 116.2134 57.2125 31.0713 174.7393 48 Q 4.2118 7.2065 117.2217 55.7805 29.0984 175.7417 49 P 4.5086 0.0000 0.0000 65.6800 30.2134 178.0719 50 G 3.7719 7.9394 101.6766 45.6884 0.0000 174.2872 51 H 4.3600 8.3246 117.1236 58.0480 29.1055 177.6615 52 F 4.0269 7.5020 115.2382 59.8225 37.6531 177.1295 53 S 4.3232 6.4744 115.5577 59.8645 62.5347 174.7953 54 K 4.6507 7.9307 117.5378 56.2177 33.5440 175.8322 55 Q 4.6129 8.0482 118.6017 58.0447 34.1656 175.0841 56 C 4.7423 8.0498 111.3679 60.0419 29.1031 175.0029 57 R 4.6272 8.3602 117.8579 56.8730 31.3108 174.7462 58 S 4.4728 8.4547 118.0401 58.8988 62.8111 174.3412 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 22 Q 8.20 4.42 0.00 2.10 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.75 0.00 0.00 0.00 0.00 0.00 2.34 2.33 0.00 23 T 8.47 4.91 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 1.23 0.00 0.00 24 C 8.40 4.65 0.00 2.35 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 25 Y 8.56 4.34 0.00 3.38 3.32 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 26 N 7.44 4.44 0.00 1.44 1.83 0.00 0.00 6.71 7.49 0.00 0.00 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 C 7.89 4.06 0.00 2.86 2.92 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 28 G 7.95 3.97 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 0.00 0.00 0.00 29 K 7.14 4.33 0.00 1.72 1.79 0.00 1.65 0.00 0.00 1.70 0.00 0.00 3.07 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.46 1.43 7.81 30 P 0.00 4.95 0.00 2.19 2.11 0.00 3.92 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 2.00 1.97 0.00 31 G 8.74 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 32 H 8.16 4.94 0.00 3.27 3.24 0.00 5.87 0.00 0.00 0.00 0.00 6.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 L 7.88 4.58 0.00 1.65 1.51 0.92 0.85 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 34 S 8.68 4.31 0.00 3.83 3.88 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 35 S 7.72 4.66 0.00 3.91 3.91 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 0.00 0.00 0.00 0.00 36 Q 7.98 4.05 0.00 1.97 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.58 6.67 0.00 0.00 0.00 0.00 0.00 1.82 2.12 0.00 37 C 7.57 5.01 0.00 3.18 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 38 R 8.62 3.88 0.00 1.38 1.81 0.00 3.40 0.00 0.00 3.30 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.66 0.00 39 A 6.91 4.43 0.99 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 40 P 0.00 4.73 0.00 2.22 2.23 0.00 3.67 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 1.93 0.00 41 K 8.66 3.93 0.00 1.98 1.89 0.00 1.77 0.00 0.00 1.81 0.00 0.00 3.01 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.45 1.44 7.81 42 V 7.74 3.39 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 -0.12 0.00 0.00 0.72 0.00 0.00 43 C 7.95 4.66 0.00 2.98 2.67 0.00 0.00 0.00 0.00 0.00 0.00 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 F 8.43 4.53 0.00 3.18 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 45 K 6.81 4.31 0.00 1.01 0.74 0.00 1.74 0.00 0.00 1.64 0.00 0.00 2.78 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.06 1.21 7.81 46 C 7.45 3.99 0.00 2.91 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 47 K 8.04 3.94 0.00 1.93 1.84 0.00 1.51 0.00 0.00 1.70 0.00 0.00 2.90 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.37 1.36 7.81 48 Q 7.21 4.21 0.00 2.02 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.92 6.71 0.00 0.00 0.00 0.00 0.00 2.35 2.40 0.00 49 P 0.00 4.51 0.00 2.07 2.19 0.00 3.70 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 2.05 2.13 0.00 50 G 7.94 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 0.00 0.00 0.00 51 H 8.32 4.36 0.00 3.31 3.58 0.00 5.47 0.00 0.00 0.00 0.00 6.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 F 7.50 4.03 0.00 3.23 3.24 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 0.00 53 S 6.47 4.32 0.00 3.73 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 K 7.93 4.65 0.00 1.79 1.76 0.00 1.56 0.00 0.00 1.60 0.00 0.00 2.88 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.30 1.35 7.81 55 Q 8.05 4.61 0.00 2.03 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.67 6.98 0.00 0.00 0.00 0.00 0.00 2.36 2.45 0.00 56 C 8.05 4.74 0.00 3.15 3.18 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 0.00 0.00 0.00 0.00 57 R 8.36 4.63 0.00 1.87 2.09 0.00 3.37 0.00 0.00 3.27 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.73 0.00 58 S 8.45 4.47 0.00 3.91 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00