NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 T 4.3158 8.1631 117.3743 63.0453 69.2193 173.4760 2 G 3.4995 8.3876 115.4539 44.9683 0.0000 172.7316 3 A 4.1218 8.7018 125.5582 53.6963 21.0959 176.4558 4 G 4.4005 7.0578 111.1484 44.6833 0.0000 175.9084 5 T 3.8699 9.1341 121.9360 65.9150 68.4664 173.9544 6 P 4.2434 0.0000 0.0000 65.8022 31.2353 177.6773 7 S 4.4163 7.9113 112.4379 59.2319 63.3195 174.8981 8 Q 4.2211 8.2103 120.5072 57.6045 28.9355 178.4103 9 G 3.6641 7.4907 105.9599 48.1810 0.0000 174.4944 10 K 4.2886 7.8959 116.5893 56.7639 32.3825 178.0491 11 K 4.3923 7.5825 120.3305 55.2276 30.1789 176.1699 12 N 5.0823 8.0582 121.7486 52.5338 38.2727 175.0052 13 T 4.5171 7.9979 114.6396 63.1349 70.4313 174.2397 14 T 4.4171 8.3481 122.6814 62.5740 69.2810 172.7401 15 T 4.3117 7.5368 114.9636 63.0450 71.1850 172.9450 16 H 4.8749 8.0529 119.2983 55.1800 29.9945 174.6610 17 T 4.8306 9.4457 113.2500 59.0646 73.0179 172.9766 18 K 4.2067 8.8132 122.8276 57.5837 32.7256 175.1914 19 C 4.3426 9.3001 128.5106 58.3354 32.3909 174.1705 20 R 3.7181 8.5193 126.6769 59.4236 29.9515 177.4874 21 R 3.6979 7.1988 116.4638 58.2210 30.1643 176.3947 22 C 4.4584 7.9598 109.2928 57.3727 31.1023 174.7134 23 G 3.9283 8.2213 108.5954 45.1301 0.0000 173.4471 24 E 4.2577 7.6745 119.0527 55.1370 31.1395 176.4749 25 K 4.5440 8.1438 124.6849 55.8335 29.8029 176.5417 26 S 4.7715 7.8030 113.6311 57.9715 66.8272 174.2755 27 Y 4.6453 9.0779 123.8274 57.1528 39.3710 174.3114 28 H 4.3965 8.8930 128.9541 56.1317 30.0336 175.6403 29 T 3.5171 8.8527 122.1292 63.9384 66.9828 175.1653 30 K 4.2676 8.1140 119.2612 58.6761 33.0025 177.8016 31 K 4.0357 7.9358 116.1123 56.2743 32.8718 176.5480 32 K 3.2201 8.7157 118.8156 56.8600 29.9148 175.4670 33 V 4.5619 6.7642 116.3923 61.2598 35.0885 172.9059 34 C 5.0625 9.4771 128.2852 58.5185 32.0239 174.4733 35 S 4.3769 8.9452 122.4349 60.4979 63.2729 175.4050 36 S 4.4523 8.3249 115.3089 60.2369 62.7081 174.2370 37 C 4.5282 8.1918 112.2842 57.4158 30.5739 175.0459 38 G 3.9994 8.3853 109.4589 45.1065 0.0000 173.3014 39 F 4.4830 8.1264 122.3524 60.2115 39.5706 175.6342 40 G 4.0444 8.7666 115.4855 46.0169 0.0000 173.5596 41 K 4.3816 8.4050 119.2201 57.1976 33.6566 176.2915 42 S 4.7153 7.6676 109.9705 56.0702 66.0250 173.7068 43 A 4.1655 8.7099 125.5126 55.1838 18.4682 178.7860 44 K 4.2314 7.7116 113.4197 56.1724 32.8526 176.7062 45 R 4.3370 8.2351 120.9085 55.6360 30.8025 176.5736 46 R 3.8077 8.5253 125.3522 57.1197 30.4826 175.1898 47 D 4.4832 7.4625 122.7113 53.8284 44.3601 174.0934 48 Y 4.5108 8.3694 121.1711 56.0426 41.7333 176.4651 49 E 3.9953 8.6398 122.3000 58.8424 29.8107 178.5983 50 W 4.6017 7.6184 113.4672 57.4016 28.4713 176.7577 51 Q 4.3782 7.5785 117.8849 57.3066 28.3387 175.4636 52 S 4.7558 7.5635 111.1843 55.9936 66.5878 173.9391 53 K 4.0892 8.4901 119.6825 56.3161 32.5058 178.0060 54 A 3.9989 8.9386 125.6760 55.5967 18.2153 179.2339 55 G 4.0637 7.9177 101.9792 45.3354 0.0000 173.2425 56 E 4.2130 8.0607 126.6889 56.3285 29.9000 174.5393 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 T 8.16 4.32 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 2 G 8.39 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 3 A 8.70 4.12 1.29 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 0.00 0.00 0.00 4 G 7.06 4.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 T 9.13 3.87 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 6 P 0.00 4.24 0.00 2.21 2.31 0.00 3.60 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 2.00 0.00 7 S 7.91 4.42 0.00 4.20 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 8 Q 8.21 4.22 0.00 2.18 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 6.79 0.00 0.00 0.00 0.00 0.00 2.53 2.45 0.00 9 G 7.49 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 10 K 7.90 4.29 0.00 1.76 1.85 0.00 1.74 0.00 0.00 1.70 0.00 0.00 2.97 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.42 1.45 7.81 11 K 7.58 4.39 0.00 1.88 1.78 0.00 1.65 0.00 0.00 1.76 0.00 0.00 3.05 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.46 1.46 7.81 12 N 8.06 5.08 0.00 2.77 2.83 0.00 0.00 6.25 7.71 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 13 T 8.00 4.52 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 1.20 0.00 0.00 14 T 8.35 4.42 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 15 T 7.54 4.31 3.65 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 1.13 0.00 0.00 16 H 8.05 4.87 0.00 3.08 3.51 0.00 5.64 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 T 9.45 4.83 4.33 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 1.32 0.00 0.00 18 K 8.81 4.21 0.00 1.80 1.82 0.00 1.78 0.00 0.00 1.64 0.00 0.00 2.81 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.43 1.52 7.81 19 C 9.30 4.34 0.00 3.14 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 20 R 8.52 3.72 0.00 1.60 1.54 0.00 3.24 0.00 0.00 3.13 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.54 0.00 21 R 7.20 3.70 0.00 0.67 1.25 0.00 3.19 0.00 0.00 3.23 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 1.30 0.00 22 C 7.96 4.46 0.00 3.06 2.97 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 23 G 8.22 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 24 E 7.67 4.26 0.00 1.95 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 0.00 2.39 2.27 0.00 25 K 8.14 4.54 0.00 1.80 1.78 0.00 1.74 0.00 0.00 1.73 0.00 0.00 2.95 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.46 1.52 7.81 26 S 7.80 4.77 0.00 3.86 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 27 Y 9.08 4.65 0.00 3.11 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 28 H 8.89 4.40 0.00 3.19 3.06 0.00 5.84 0.00 0.00 0.00 0.00 6.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 T 8.85 3.52 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 1.18 0.00 0.00 30 K 8.11 4.27 0.00 1.85 1.84 0.00 1.81 0.00 0.00 1.70 0.00 0.00 3.10 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.37 1.42 7.81 31 K 7.94 4.04 0.00 1.55 1.72 0.00 1.64 0.00 0.00 1.55 0.00 0.00 2.44 0.00 0.00 2.74 0.00 0.00 0.00 0.00 1.20 0.88 7.81 32 K 8.72 3.22 0.00 1.75 1.88 0.00 1.75 0.00 0.00 1.46 0.00 0.00 2.89 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.29 1.49 7.81 33 V 6.76 4.56 2.01 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 1.02 0.00 0.00 0.95 0.00 0.00 34 C 9.48 5.06 0.00 3.39 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 35 S 8.95 4.38 0.00 4.10 4.10 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 36 S 8.32 4.45 0.00 3.91 3.98 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 37 C 8.19 4.53 0.00 3.14 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 38 G 8.39 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 39 F 8.13 4.48 0.00 3.03 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 40 G 8.77 4.04 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 K 8.41 4.38 0.00 1.67 2.01 0.00 1.81 0.00 0.00 1.82 0.00 0.00 2.94 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.38 1.36 7.81 42 S 7.67 4.72 0.00 3.96 3.78 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.71 4.17 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 44 K 7.71 4.23 0.00 1.74 1.72 0.00 1.73 0.00 0.00 1.67 0.00 0.00 2.95 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.43 1.45 7.81 45 R 8.24 4.34 0.00 1.65 1.82 0.00 3.36 0.00 0.00 3.15 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.54 0.00 46 R 8.53 3.81 0.00 1.91 1.98 0.00 3.46 0.00 0.00 3.39 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.68 0.00 47 D 7.46 4.48 0.00 2.47 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 Y 8.37 4.51 0.00 1.43 1.43 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 0.00 49 E 8.64 4.00 0.00 2.05 2.03 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 2.38 2.25 0.00 50 W 7.62 4.60 0.00 3.46 3.21 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 0.00 0.00 0.00 0.00 51 Q 7.58 4.38 0.00 2.05 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.73 0.00 0.00 0.00 0.00 0.00 2.08 1.51 0.00 52 S 7.56 4.76 0.00 3.94 3.78 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.49 4.09 0.00 1.83 1.80 0.00 1.73 0.00 0.00 1.86 0.00 0.00 2.94 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.56 1.41 7.81 54 A 8.94 4.00 1.32 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 55 G 7.92 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 56 E 8.06 4.21 0.00 1.93 1.77 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 2.24 2.25 0.00