NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.9389 8.3549 109.7373 45.0957 0.0000 173.4386 2 I 3.8399 7.7237 121.5399 60.5701 37.6138 175.3855 3 G 4.3544 8.4371 111.8133 43.6870 0.0000 171.7758 4 D 4.8100 7.7384 118.7096 49.9162 43.6914 174.2439 5 P 4.2750 0.0000 0.0000 65.9424 31.2912 179.0995 6 V 3.5611 7.7864 117.5984 66.1476 31.6652 177.8667 7 T 3.8322 8.3268 115.5538 66.7037 68.1471 175.4284 8 C 4.1539 8.0973 120.2401 60.0790 44.6562 175.9063 9 L 4.0796 8.0941 120.2551 57.5364 40.9454 179.3830 10 K 4.0032 8.1871 119.5173 59.1461 32.2090 178.1774 11 S 4.4352 7.8496 112.0109 58.7841 63.4182 175.0281 12 G 3.8334 8.1285 111.1272 45.1301 0.0000 173.3369 13 A 4.5327 7.3522 121.3264 51.3331 20.2857 176.8294 14 I 4.5542 8.7298 119.5199 59.8619 40.2189 174.6768 15 C 5.1767 8.7911 123.9471 56.4021 41.1564 172.6684 16 H 5.1079 9.1013 121.3246 53.3166 30.9166 173.9002 17 P 4.2674 0.0000 0.0000 64.9437 31.9744 176.9323 18 V 4.0335 7.7468 115.3902 63.6040 33.8202 174.9598 19 F 5.0968 7.7273 115.4422 55.4626 42.3309 175.4860 20 C 4.4075 8.7623 121.3124 55.8427 35.3181 172.1705 21 P 4.3676 0.0000 0.0000 62.4049 31.5413 176.3290 22 R 4.2042 8.0793 119.1733 57.8365 30.4736 177.6767 23 R 4.1823 8.7912 118.6398 56.3378 28.5769 175.7567 24 Y 4.6092 7.6920 115.2628 55.7546 38.9702 175.2958 25 K 4.3003 8.5628 126.2598 55.7601 33.8146 175.4903 26 Q 4.7047 8.7765 129.2820 56.0669 29.5087 175.2280 27 I 4.5157 10.1385 118.1133 59.6514 39.6032 176.1119 28 G 4.1775 6.8993 109.3865 46.4696 0.0000 170.6414 29 T 5.0605 7.7572 109.9476 59.2759 71.5814 172.8486 30 C 4.8403 8.7127 117.1929 57.0817 42.6233 175.4365 31 G 4.0823 9.1557 109.0847 44.6367 0.0000 176.8679 32 L 4.1452 9.0864 118.7856 53.6486 43.0967 174.8257 33 P 4.3938 0.0000 0.0000 64.4513 31.6800 176.6438 34 G 3.9685 8.9147 110.9177 45.3319 0.0000 173.9103 35 T 4.5359 7.5798 109.7277 61.5789 70.5236 173.9887 36 K 4.7854 8.9896 121.7135 54.9030 36.6883 174.5207 37 C 4.8829 9.1801 125.5675 55.7571 44.7540 171.4574 38 C 5.5608 9.2666 124.9215 54.9221 41.5171 173.3610 39 K 4.5289 9.4570 127.0558 55.6915 33.1246 175.9473 40 K 3.7219 8.5956 129.1152 55.2808 32.9467 174.8415 41 P 4.2399 0.0000 0.0000 63.0466 31.2173 176.0237 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 G 8.35 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2 I 7.72 3.84 1.88 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 1.24 0.82 0.98 0.00 0.00 3 G 8.44 4.35 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 4 D 7.74 4.81 0.00 2.82 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 5 P 0.00 4.27 0.00 2.28 2.43 0.00 3.69 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.01 0.00 6 V 7.79 3.56 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 1.14 0.00 0.00 0.93 0.00 0.00 7 T 8.33 3.83 4.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 8 C 8.10 4.15 0.00 3.13 3.30 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 9 L 8.09 4.08 0.00 1.74 1.71 0.92 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 10 K 8.19 4.00 0.00 1.84 2.06 0.00 1.80 0.00 0.00 1.76 0.00 0.00 3.07 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.46 1.45 7.81 11 S 7.85 4.44 0.00 4.11 4.08 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 12 G 8.13 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 13 A 7.35 4.53 1.33 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 0.00 0.00 0.00 14 I 8.73 4.55 2.03 0.00 0.00 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.88 0.89 0.00 0.00 15 C 8.79 5.18 0.00 2.83 3.01 0.00 0.00 0.00 0.00 0.00 0.00 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 H 9.10 5.11 0.00 3.03 3.27 0.00 5.61 0.00 0.00 0.00 0.00 6.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 P 0.00 4.27 0.00 2.14 2.15 0.00 3.74 0.00 0.00 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.93 0.00 18 V 7.75 4.03 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.14 0.00 0.00 0.84 0.00 0.00 19 F 7.73 5.10 0.00 2.99 2.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 C 8.76 4.41 0.00 3.02 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 21 P 0.00 4.37 0.00 1.55 1.66 0.00 3.20 0.00 0.00 3.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 1.68 0.00 22 R 8.08 4.20 0.00 1.82 1.88 0.00 3.21 0.00 0.00 3.21 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.62 0.00 23 R 8.79 4.18 0.00 2.14 2.21 0.00 3.22 0.00 0.00 3.25 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.68 0.00 24 Y 7.69 4.61 0.00 2.95 2.95 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.56 4.30 0.00 1.84 1.68 0.00 1.72 0.00 0.00 1.75 0.00 0.00 2.77 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.51 1.45 7.81 26 Q 8.78 4.70 0.00 2.16 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 6.78 0.00 0.00 0.00 0.00 0.00 2.37 2.63 0.00 27 I 10.14 4.52 1.89 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 1.30 0.82 0.93 0.00 0.00 28 G 6.90 4.18 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 0.00 0.00 0.00 29 T 7.76 5.06 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 1.24 0.00 0.00 30 C 8.71 4.84 0.00 2.95 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 31 G 9.16 4.08 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 0.00 0.00 0.00 32 L 9.09 4.15 0.00 1.70 1.59 0.91 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 33 P 0.00 4.39 0.00 2.01 1.98 0.00 3.63 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.08 0.00 34 G 8.91 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 35 T 7.58 4.54 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 36 K 8.99 4.79 0.00 1.66 1.71 0.00 1.86 0.00 0.00 1.57 0.00 0.00 2.87 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.48 1.50 7.81 37 C 9.18 4.88 0.00 3.19 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 C 9.27 5.56 0.00 3.10 3.13 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 39 K 9.46 4.53 0.00 1.82 1.78 0.00 1.63 0.00 0.00 1.56 0.00 0.00 2.77 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.38 1.37 7.81 40 K 8.60 3.72 0.00 1.82 1.63 0.00 1.87 0.00 0.00 1.68 0.00 0.00 2.94 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.24 1.46 7.81 41 P 0.00 4.24 0.00 1.87 1.80 0.00 2.93 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.80 0.00