NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.8817 8.3393 109.7364 45.6305 0.0000 173.3002 2 S 4.5640 8.3415 120.1467 55.8591 65.4074 171.5543 3 S 4.5369 8.1380 113.6585 57.1036 66.3175 176.1185 4 G 3.9619 8.4320 117.1434 45.1233 0.0000 174.0394 5 S 4.4742 7.5052 110.2358 58.7427 63.6953 175.0791 6 S 4.6519 7.5160 114.1536 57.5171 64.6441 172.5605 7 G 4.0305 8.1470 114.2409 45.5396 0.0000 171.7859 8 T 4.5837 8.1433 113.9079 58.9810 69.3182 172.2352 9 P 4.2971 0.0000 0.0000 62.6201 32.0319 176.2409 10 G 3.8719 8.4614 110.4081 44.0037 0.0000 173.5059 11 R 4.2850 8.9767 122.7584 54.4342 30.6241 173.4423 12 G 3.5043 9.4239 110.2712 41.9857 0.0000 174.0109 13 S 3.7617 7.6763 117.8932 57.6475 60.6268 172.9061 14 R 4.6177 7.4651 113.2230 54.6697 32.1238 175.3466 15 V 3.7964 8.2528 120.8093 62.1943 32.0913 175.7065 16 T 4.5056 8.2196 113.3108 61.7508 68.7866 173.8327 17 D 5.0108 8.0917 119.0967 55.2554 41.0272 175.5941 18 Q 4.7820 7.6841 115.3503 54.9581 31.4891 177.1897 19 G 3.6213 8.7844 109.2473 46.6868 0.0000 175.9168 20 I 4.5541 8.4830 115.9877 59.4792 42.1682 174.1678 21 C 4.2654 8.4248 124.5713 58.5977 31.5052 172.3693 22 P 4.5775 0.0000 0.0000 63.7523 31.0098 176.3109 23 K 4.3037 7.9784 117.1203 58.4263 33.5309 176.8673 24 H 4.6689 7.9461 111.6836 54.7523 30.5673 174.2175 25 Q 3.6427 8.5306 117.6984 57.3700 25.8559 173.3841 26 E 4.7902 7.5710 115.9581 53.8888 33.6651 176.5179 27 A 4.2715 8.8633 124.8299 52.0449 18.8822 177.1716 28 L 4.2984 8.3392 123.6645 54.8469 41.9083 177.0239 29 K 4.7746 8.5040 123.6773 56.0108 34.3637 175.3869 30 L 5.0812 7.9485 118.3141 54.2663 46.9878 174.5948 31 F 4.9847 9.5467 123.5438 56.3114 42.7271 173.3009 32 C 4.2089 7.9697 126.9966 59.5396 32.0293 173.2897 33 E 4.5293 8.6481 125.0782 57.0083 28.8899 177.6397 34 V 4.1289 7.7074 119.8683 63.2686 33.3281 175.8541 35 D 4.6269 7.7812 116.6198 53.1399 42.4839 175.4968 36 E 3.6231 8.0353 117.6796 56.7681 27.3154 174.2921 37 E 4.8645 6.6532 114.7404 54.2518 33.4318 175.2303 38 A 4.7848 9.0322 125.3780 52.5740 19.0013 176.2481 39 I 4.7808 9.2236 114.6107 59.6205 42.2857 173.3461 40 C 4.6620 8.3073 116.3259 56.2073 32.6423 175.2274 41 V 3.6034 8.5258 111.6622 64.7261 30.9085 178.9212 42 V 3.4629 7.6717 117.0590 66.1319 31.1752 177.4545 43 C 4.0714 7.9533 114.5011 62.9225 28.3045 175.5265 44 R 4.0467 7.9420 119.9356 59.8162 29.4435 178.4580 45 E 4.0408 7.8988 116.5003 57.9781 29.8018 177.7124 46 S 4.2284 7.8813 115.3477 57.6109 62.6819 174.9310 47 R 3.8150 8.7704 124.4291 59.5034 29.2856 178.4535 48 S 4.0457 8.2352 113.8226 61.7124 61.7087 175.3833 49 H 4.6535 8.2677 115.1916 55.3616 29.3099 176.3600 50 K 4.7155 7.4609 121.8485 59.2351 32.0377 178.6175 51 Q 4.1369 7.7771 115.5236 58.3699 29.0194 176.3376 52 H 4.4962 7.1604 115.5691 55.4331 29.5476 176.0879 53 S 4.4151 8.4825 119.5858 58.7275 62.1300 172.8479 54 V 4.4861 8.0911 124.0393 61.9669 32.8176 175.1512 55 V 4.7092 8.4090 119.4306 58.4971 35.7731 173.3017 56 P 4.9980 0.0000 0.0000 62.1345 31.6318 176.2037 57 L 4.2281 8.6443 123.8617 55.2318 41.2457 177.5974 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 8.34 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 0.00 0.00 0.00 2 S 8.34 4.56 0.00 4.05 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 3 S 8.14 4.54 0.00 3.80 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 4 G 8.43 3.96 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 0.00 5 S 7.51 4.47 0.00 3.99 3.95 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 6 S 7.52 4.65 0.00 3.80 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 7 G 8.15 4.03 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 0.00 0.00 0.00 8 T 8.14 4.58 4.24 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 1.21 0.00 0.00 9 P 0.00 4.30 0.00 2.21 2.03 0.00 3.79 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 1.98 1.96 0.00 10 G 8.46 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 0.00 0.00 0.00 11 R 8.98 4.29 0.00 1.90 1.95 0.00 3.08 0.00 0.00 3.23 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.67 0.00 12 G 9.42 3.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 S 7.68 3.76 0.00 4.02 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 14 R 7.47 4.62 0.00 1.86 1.84 0.00 3.08 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 1.50 1.60 0.00 15 V 8.25 3.80 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 0.71 0.00 0.00 0.94 0.00 0.00 16 T 8.22 4.51 4.24 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 1.21 0.00 0.00 17 D 8.09 5.01 0.00 2.67 2.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 18 Q 7.68 4.78 0.00 1.98 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.81 0.00 0.00 0.00 0.00 0.00 2.30 2.27 0.00 19 G 8.78 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 I 8.48 4.55 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 1.31 0.83 0.95 0.00 0.00 21 C 8.42 4.27 0.00 3.01 2.85 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.58 0.00 2.21 2.14 0.00 3.78 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 1.98 1.98 0.00 23 K 7.98 4.30 0.00 1.50 1.65 0.00 1.70 0.00 0.00 1.66 0.00 0.00 2.97 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.30 1.38 7.81 24 H 7.95 4.67 0.00 3.10 3.33 0.00 6.05 0.00 0.00 0.00 0.00 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 Q 8.53 3.64 0.00 2.17 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.58 0.00 0.00 0.00 0.00 0.00 2.30 2.46 0.00 26 E 7.57 4.79 0.00 1.86 1.81 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 2.29 2.22 0.00 27 A 8.86 4.27 1.25 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 0.00 0.00 28 L 8.34 4.30 0.00 1.43 1.70 0.98 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 29 K 8.50 4.77 0.00 1.79 1.96 0.00 1.50 0.00 0.00 1.82 0.00 0.00 2.82 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.38 1.44 7.81 30 L 7.95 5.08 0.00 1.60 1.56 0.95 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 31 F 9.55 4.98 0.00 3.03 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 32 C 7.97 4.21 0.00 2.86 2.47 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 0.00 0.00 0.00 33 E 8.65 4.53 0.00 2.12 2.02 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 2.54 2.47 0.00 34 V 7.71 4.13 1.91 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 0.64 0.00 0.00 0.91 0.00 0.00 35 D 7.78 4.63 0.00 2.61 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 36 E 8.04 3.62 0.00 2.16 2.27 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 2.37 2.25 0.00 37 E 6.65 4.86 0.00 1.95 1.94 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 2.09 2.15 0.00 38 A 9.03 4.78 1.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 I 9.22 4.78 1.77 0.00 0.00 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 1.27 0.89 0.69 0.00 0.00 40 C 8.31 4.66 0.00 3.00 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 41 V 8.53 3.60 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 0.75 0.00 0.00 0.94 0.00 0.00 42 V 7.67 3.46 1.81 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 0.65 0.00 0.00 0.88 0.00 0.00 43 C 7.95 4.07 0.00 3.24 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 44 R 7.94 4.05 0.00 1.84 2.09 0.00 3.25 0.00 0.00 3.16 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.83 0.00 45 E 7.90 4.04 0.00 2.12 1.98 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 2.33 2.50 0.00 46 S 7.88 4.23 0.00 4.03 3.84 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.77 3.82 0.00 1.99 2.20 0.00 3.03 0.00 0.00 3.32 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.67 0.00 48 S 8.24 4.05 0.00 3.86 3.84 0.00 0.00 0.00 0.00 0.00 0.00 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 8.27 4.65 0.00 3.25 3.22 0.00 5.61 0.00 0.00 0.00 0.00 6.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 K 7.46 4.72 0.00 1.79 1.77 0.00 1.57 0.00 0.00 1.70 0.00 0.00 3.05 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.43 1.39 7.81 51 Q 7.78 4.14 0.00 2.04 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.56 6.72 0.00 0.00 0.00 0.00 0.00 2.35 2.34 0.00 52 H 7.16 4.50 0.00 3.29 3.18 0.00 5.67 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53 S 8.48 4.42 0.00 3.80 3.86 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 54 V 8.09 4.49 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 0.74 0.00 0.00 1.05 0.00 0.00 55 V 8.41 4.71 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 0.83 0.00 0.00 1.10 0.00 0.00 56 P 0.00 5.00 0.00 2.09 2.12 0.00 3.44 0.00 0.00 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.85 0.00 57 L 8.64 4.23 0.00 1.49 1.68 1.18 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00