NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 27 L 4.2980 8.1693 122.4884 55.0741 42.4873 175.5090 28 R 4.4607 8.4649 122.0686 53.1696 32.6880 169.4164 29 V 3.8025 8.2769 118.8696 64.3979 32.6109 177.0686 30 G 4.1069 9.1009 115.8323 45.3976 0.0000 174.1768 31 S 4.3665 8.3015 117.0579 58.6005 64.2585 173.7295 32 R 4.8305 8.6204 122.8271 55.9529 31.6561 175.9525 33 V 4.9612 9.3512 116.0563 59.7539 37.0386 173.7302 34 E 5.1642 8.7859 121.5962 54.4179 33.2359 174.6333 35 V 4.1641 9.1144 127.4690 62.3934 32.5217 175.3087 36 I 3.7696 8.3054 130.0373 63.3194 37.0661 175.6751 37 G 4.3200 9.1611 119.9379 45.9877 0.0000 175.1730 38 K 3.8669 7.7431 118.1828 57.0407 32.1573 178.5460 39 G 4.1271 8.2192 105.2522 43.4653 0.0000 172.6521 40 H 4.6267 7.8215 117.8777 55.5973 29.8382 174.9661 41 R 5.0535 8.5685 122.4271 55.5446 32.9762 176.0744 42 G 4.0570 8.1539 106.1168 46.6784 0.0000 171.7847 43 T 5.2348 8.1939 115.9707 61.3150 72.2506 174.2312 44 V 4.0764 8.9266 126.7415 63.1806 32.1429 175.9191 45 A 4.7840 8.7825 128.4174 51.8370 20.8084 175.2767 46 Y 4.7092 7.3936 115.3990 56.3974 42.5924 173.6483 47 V 4.7244 8.0485 125.7286 61.9883 34.2743 174.9041 48 G 3.7094 8.0971 116.6600 45.5251 0.0000 171.0569 49 A 4.5584 8.1554 123.5795 52.1927 19.1982 176.7641 50 T 4.7217 7.8250 109.1200 60.0423 71.8759 173.6498 51 L 4.3176 8.5536 120.7710 55.7198 42.1386 178.4564 52 F 4.3744 6.6015 113.2572 58.6916 38.3207 175.4640 53 A 4.5079 6.7262 120.8517 51.2056 21.4336 175.7632 54 T 4.0586 8.4428 111.7128 62.0530 69.7817 174.6637 55 G 3.8322 8.4671 108.1857 44.4558 0.0000 172.8133 56 K 4.1887 8.0763 120.2093 56.0535 32.7819 176.0197 57 W 4.9549 9.3954 126.7459 54.8338 33.4428 174.4748 58 V 4.9381 9.3597 123.3297 61.2688 33.5733 174.5318 59 G 3.7453 9.4273 116.7814 45.1209 0.0000 172.3442 60 V 4.6516 8.6197 125.0637 60.9870 35.2459 174.4835 61 I 4.4356 8.4868 128.6676 59.6760 38.1617 175.1045 62 L 4.5447 9.1069 128.2428 54.4157 41.7421 177.6678 63 D 4.4860 9.2828 123.3787 56.7469 41.0135 176.7945 64 E 4.7071 7.7947 115.4977 54.2159 32.7297 176.4425 65 A 4.1843 8.0471 124.1148 51.5661 16.5460 177.6603 66 K 4.4349 7.7247 116.2877 55.3037 33.6605 177.2614 67 G 4.2560 8.0220 108.5509 45.1988 0.0000 173.8188 68 K 4.8158 8.8294 118.5667 56.1887 34.2642 175.6604 69 N 4.9917 7.7048 116.7621 51.6606 40.3666 174.5579 70 D 4.8657 8.7990 118.8364 53.6013 40.6282 177.8248 71 G 2.8653 8.9070 109.0734 46.4908 0.0000 173.8160 72 T 5.0091 7.6766 116.3932 61.5551 70.9953 173.4229 73 V 4.5360 8.6880 125.2030 62.2921 34.2615 175.3528 74 Q 3.1655 9.8951 126.2116 57.0886 26.1423 174.7370 75 G 3.9072 8.6065 103.9871 45.1823 0.0000 173.6379 76 R 4.2704 7.6821 120.3678 53.8501 32.1333 174.2795 77 K 4.4306 8.1967 125.8559 55.0807 32.6240 175.2081 78 Y 4.3984 8.8544 125.1076 59.2465 39.3311 175.3129 79 F 5.0392 7.2877 112.3129 56.1381 40.8105 172.1466 80 T 4.9836 8.4307 116.5778 62.1168 71.0207 173.4604 81 C 4.7373 8.2330 119.6258 57.2589 33.3632 173.2818 82 D 4.5544 8.5141 118.7631 53.7960 41.6461 176.0995 83 E 4.0567 8.7848 122.5834 58.2962 30.0588 177.3692 84 G 4.0010 8.9957 113.8576 45.7365 0.0000 174.3494 85 H 4.5425 8.3239 116.0189 56.6209 29.6945 175.1630 86 G 4.4871 8.0777 107.4600 45.6519 0.0000 172.8462 87 I 4.8965 8.4843 121.1310 59.6791 42.1010 173.0004 88 F 5.5529 8.8107 126.4251 56.0571 40.9870 175.2387 89 V 5.0946 9.2176 115.5269 59.7559 36.7017 175.2676 90 R 4.1410 8.6122 120.9813 55.5864 30.4169 178.1532 91 Q 4.0942 8.4656 118.6137 58.7187 28.6909 178.4650 92 S 4.2219 7.8885 112.2186 60.3031 63.4885 174.7999 93 Q 4.2867 8.2555 120.1382 56.5963 29.0544 174.8846 94 I 5.3181 7.2400 110.1046 58.9521 41.0099 174.7322 95 Q 4.5514 8.5537 119.6887 54.4885 32.1447 174.1885 96 V 4.4347 8.1589 120.4057 61.8874 33.1630 175.8390 97 F 4.3412 8.6038 124.2280 57.8385 38.8480 175.6780 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 27 L 8.17 4.30 0.00 1.58 1.67 0.91 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 28 R 8.46 4.46 0.00 1.96 1.95 0.00 2.83 0.00 0.00 3.13 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.62 0.00 29 V 8.28 3.80 2.07 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 0.80 0.00 0.00 0.95 0.00 0.00 30 G 9.10 4.11 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 0.00 0.00 0.00 31 S 8.30 4.37 0.00 3.85 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 32 R 8.62 4.83 0.00 1.89 2.01 0.00 3.25 0.00 0.00 3.33 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.58 0.00 33 V 9.35 4.96 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 0.74 0.00 0.00 0.96 0.00 0.00 34 E 8.79 5.16 0.00 1.97 1.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 2.34 0.00 35 V 9.11 4.16 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 0.88 0.00 0.00 1.01 0.00 0.00 36 I 8.31 3.77 1.84 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.68 0.88 0.00 0.00 37 G 9.16 4.32 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 0.00 38 K 7.74 3.87 0.00 1.58 1.45 0.00 1.78 0.00 0.00 1.70 0.00 0.00 2.83 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.39 1.39 7.81 39 G 8.22 4.13 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 40 H 7.82 4.63 0.00 3.15 3.24 0.00 5.63 0.00 0.00 0.00 0.00 6.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 R 8.57 5.05 0.00 1.97 1.93 0.00 3.12 0.00 0.00 3.15 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 1.73 0.00 42 G 8.15 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 0.00 0.00 0.00 43 T 8.19 5.23 4.22 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 1.24 0.00 0.00 44 V 8.93 4.08 2.22 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 0.79 0.00 0.00 0.92 0.00 0.00 45 A 8.78 4.78 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 Y 7.39 4.71 0.00 3.25 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 47 V 8.05 4.72 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 0.81 0.00 0.00 0.91 0.00 0.00 48 G 8.10 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 0.00 0.00 0.00 49 A 8.16 4.56 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 50 T 7.82 4.72 2.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.34 0.00 0.00 51 L 8.55 4.32 0.00 1.69 1.77 0.91 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 52 F 6.60 4.37 0.00 3.07 3.16 0.00 0.00 0.00 0.00 0.00 0.00 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 A 6.73 4.51 1.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 T 8.44 4.06 4.26 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 1.24 0.00 0.00 55 G 8.47 3.83 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 0.00 0.00 0.00 56 K 8.08 4.19 0.00 1.72 1.60 0.00 1.68 0.00 0.00 1.65 0.00 0.00 2.72 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.39 1.46 7.81 57 W 9.40 4.95 0.00 3.49 3.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 V 9.36 4.94 2.21 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 0.99 0.00 0.00 0.99 0.00 0.00 59 G 9.43 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 V 8.62 4.65 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.00 0.00 0.90 0.00 0.00 61 I 8.49 4.44 1.85 0.00 0.00 0.94 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 0.36 0.97 0.00 0.00 62 L 9.11 4.54 0.00 1.70 1.65 0.95 1.25 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 63 D 9.28 4.49 0.00 2.64 2.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 E 7.79 4.71 0.00 1.89 1.80 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 2.22 2.27 0.00 65 A 8.05 4.18 1.10 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 0.00 0.00 66 K 7.72 4.43 0.00 1.50 1.56 0.00 1.67 0.00 0.00 1.63 0.00 0.00 2.96 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.19 0.98 7.81 67 G 8.02 4.26 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 0.00 68 K 8.83 4.82 0.00 1.55 1.76 0.00 1.68 0.00 0.00 1.71 0.00 0.00 3.00 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.34 1.34 7.81 69 N 7.70 4.99 0.00 2.84 2.86 0.00 0.00 5.74 8.07 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 70 D 8.80 4.87 0.00 2.82 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 71 G 8.91 2.87 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 0.00 0.00 0.00 72 T 7.68 5.01 4.29 0.00 0.00 0.00 0.00 0.00 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 0.00 0.00 73 V 8.69 4.54 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 0.59 0.00 0.00 0.93 0.00 0.00 74 Q 9.90 3.17 0.00 2.27 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.48 0.00 0.00 0.00 0.00 0.00 2.25 2.27 0.00 75 G 8.61 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 0.00 0.00 0.00 76 R 7.68 4.27 0.00 1.70 1.56 0.00 2.70 0.00 0.00 2.75 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.80 0.50 0.00 77 K 8.20 4.43 0.00 1.65 1.59 0.00 1.61 0.00 0.00 1.28 0.00 0.00 2.92 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.35 1.46 7.81 78 Y 8.85 4.40 0.00 3.27 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 79 F 7.29 5.04 0.00 3.28 3.26 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 80 T 8.43 4.98 4.32 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 1.23 0.00 0.00 81 C 8.23 4.74 0.00 3.01 3.06 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 82 D 8.51 4.55 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 83 E 8.78 4.06 0.00 1.89 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 2.29 2.39 0.00 84 G 9.00 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 H 8.32 4.54 0.00 3.43 3.39 0.00 5.61 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 86 G 8.08 4.49 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 87 I 8.48 4.90 1.90 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.94 0.94 0.00 0.00 88 F 8.81 5.55 0.00 2.73 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 89 V 9.22 5.09 2.22 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 0.89 0.00 0.00 1.05 0.00 0.00 90 R 8.61 4.14 0.00 1.74 1.65 0.00 2.71 0.00 0.00 2.25 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 1.29 0.00 91 Q 8.47 4.09 0.00 2.20 2.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.77 6.93 0.00 0.00 0.00 0.00 0.00 2.33 2.30 0.00 92 S 7.89 4.22 0.00 3.97 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 93 Q 8.26 4.29 0.00 2.24 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.07 6.69 0.00 0.00 0.00 0.00 0.00 2.46 2.49 0.00 94 I 7.24 5.32 1.85 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 1.29 0.65 0.93 0.00 0.00 95 Q 8.55 4.55 0.00 1.96 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 6.90 0.00 0.00 0.00 0.00 0.00 2.02 1.91 0.00 96 V 8.16 4.43 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 0.91 0.00 0.00 0.91 0.00 0.00 97 F 8.60 4.34 0.00 3.09 2.91 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