NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 T 4.4939 8.1593 117.3243 62.7828 69.9484 173.3834 2 P 4.3324 0.0000 0.0000 61.7862 32.8554 174.1269 3 D 4.6513 8.9103 121.5727 55.6970 41.2985 177.7560 4 C 4.9069 8.4948 121.2527 57.7855 45.7743 174.8042 5 V 4.3579 7.0925 114.3873 61.0531 33.9030 172.0738 6 T 4.9114 9.4367 121.2294 60.5814 71.5759 173.9881 7 G 3.9399 7.8763 111.4874 46.2431 0.0000 171.6141 8 K 5.1627 8.1837 119.2910 55.2736 33.3074 177.1473 9 V 4.1131 8.1234 121.3242 62.2450 32.5171 175.4851 10 E 4.3183 9.1912 127.5801 58.5900 30.2111 175.7337 11 Y 5.0821 6.8127 114.5006 56.1274 41.5601 173.3900 12 T 4.9903 8.0093 108.3142 60.2266 72.4029 173.2756 13 K 4.4889 8.3059 122.5721 55.5068 36.2619 173.8586 14 Y 4.8084 8.7706 129.1508 56.5687 39.3710 174.8764 15 N 4.7634 8.6825 125.0221 52.1050 39.8268 176.0662 16 D 4.3222 8.5880 119.1593 57.3083 41.2985 176.5821 17 D 4.5765 7.9124 115.9065 53.2581 39.6067 176.5653 18 D 4.1824 8.1199 118.9578 54.5543 39.3045 174.0869 19 T 4.6102 8.8241 111.3548 60.7231 71.1370 173.3345 20 F 5.4354 8.6803 125.3856 57.3082 41.5168 174.4435 21 T 4.9418 9.1328 123.2514 62.1730 70.8560 173.8446 22 V 4.4558 8.4734 124.6103 60.7740 35.2978 173.9441 23 K 4.7320 8.2708 127.7955 54.4882 34.1632 175.1800 24 V 4.5963 7.9902 126.1565 62.3138 35.6029 174.3035 25 G 4.1264 8.6292 114.1100 46.8243 0.0000 173.8445 26 D 4.8626 8.7075 124.0777 52.6690 39.7650 175.8465 27 K 4.6909 7.5071 118.2898 54.8739 35.5342 174.5889 28 E 4.9336 8.8800 123.2310 54.5457 32.4240 174.8407 29 L 5.4875 8.6968 125.2848 53.0714 46.8603 174.8693 30 F 5.7826 9.6359 114.9784 55.9333 42.1576 173.2070 31 T 4.2373 8.6689 112.0401 60.6881 70.2261 174.0832 32 N 4.7400 8.5973 123.3621 54.5294 39.4052 175.8497 33 R 3.9332 7.7634 118.1291 56.0847 29.9379 177.4480 34 W 4.3415 8.7053 123.3257 58.8786 29.4043 178.1356 35 N 4.3555 8.2126 116.2524 55.8274 37.6987 177.0756 36 L 4.1830 7.7222 120.4325 58.1041 41.7255 179.6314 37 Q 3.0013 7.2120 117.7155 58.1690 28.1161 179.0446 38 S 4.5544 7.7323 110.9728 58.7222 63.1898 175.6491 39 L 4.1772 9.0560 122.1625 57.1709 41.6652 178.8201 40 L 4.2066 8.0263 118.5387 58.0437 41.6971 178.9535 41 L 4.1165 8.1540 120.0445 58.4754 41.9159 179.0633 42 S 4.3263 7.8878 113.8368 60.7752 62.9336 176.2348 43 A 4.1190 8.6355 124.0790 55.1654 18.1283 179.5184 44 Q 3.9257 8.4685 118.1497 59.5567 29.0388 178.5481 45 I 3.9174 7.5040 119.2823 63.4328 37.0493 176.9300 46 T 4.4550 7.4402 107.4580 60.7103 68.8008 174.2521 47 G 3.9590 8.0772 107.9603 47.1808 0.0000 174.3959 48 M 4.3925 7.7415 118.6543 55.3491 33.6913 175.4523 49 T 4.9664 8.4135 117.5894 62.2702 71.2064 174.1315 50 V 4.7492 8.5734 117.9157 60.0537 36.4067 174.3757 51 T 4.8299 8.1541 120.0882 61.9591 71.6112 173.9381 52 I 4.4032 8.4507 125.6378 59.4135 39.6560 174.5442 53 K 4.7818 8.1018 125.9544 56.0817 32.8280 176.7129 54 T 4.5587 8.3104 117.6253 61.3794 70.1428 173.3987 55 N 4.4305 9.0189 123.8730 55.1466 39.7644 176.0509 56 A 4.4543 7.9346 124.2604 50.9223 17.7263 176.6197 57 C 4.9374 7.5318 123.6217 54.0565 43.3722 171.2972 58 H 4.8337 7.2772 118.8021 53.5185 31.4984 173.3181 59 N 4.8435 8.5842 117.8459 54.7980 38.4643 175.9294 60 G 4.1158 9.5823 113.1924 44.5998 0.0000 173.8318 61 G 4.3460 7.4942 107.3995 46.2551 0.0000 173.0714 62 G 4.1738 8.5387 108.9596 44.4566 0.0000 172.4927 63 F 5.1837 8.3290 115.4773 55.5054 40.9302 174.5507 64 S 4.3768 8.8903 112.0966 57.3552 65.2236 173.7769 65 E 4.8291 8.2799 121.3857 54.2665 32.2449 174.7096 66 V 4.7170 8.4237 124.8234 61.3241 35.6079 174.3221 67 I 4.5554 7.7220 123.9980 59.6651 41.2138 174.2682 68 F 4.5609 9.0700 126.0333 56.0213 40.1417 176.1579 69 R 4.3073 8.3432 122.1686 56.2805 29.6721 176.6440 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 4.49 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 1.19 0.00 0.00 2 P 0.00 4.33 0.00 2.17 2.16 0.00 3.70 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 2.20 2.05 0.00 3 D 8.91 4.65 0.00 2.53 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 4 C 8.49 4.91 0.00 2.89 3.29 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 5 V 7.09 4.36 1.99 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 0.58 0.00 0.00 0.89 0.00 0.00 6 T 9.44 4.91 4.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 7 G 7.88 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 8 K 8.18 5.16 0.00 1.65 1.77 0.00 1.80 0.00 0.00 2.61 0.00 0.00 2.83 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.44 1.27 7.81 9 V 8.12 4.11 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 0.86 0.00 0.00 0.93 0.00 0.00 10 E 9.19 4.32 0.00 1.80 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 0.00 2.30 2.17 0.00 11 Y 6.81 5.08 0.00 2.99 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 12 T 8.01 4.99 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 1.21 0.00 0.00 13 K 8.31 4.49 0.00 1.85 1.71 0.00 1.64 0.00 0.00 1.61 0.00 0.00 2.89 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.45 1.43 7.81 14 Y 8.77 4.81 0.00 3.24 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 15 N 8.68 4.76 0.00 2.71 2.68 0.00 0.00 6.25 7.38 0.00 0.00 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 D 8.59 4.32 0.00 2.63 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 0.00 17 D 7.91 4.58 0.00 2.80 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 18 D 8.12 4.18 0.00 2.87 2.66 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 19 T 8.82 4.61 4.70 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 1.51 0.00 0.00 20 F 8.68 5.44 0.00 2.92 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 T 9.13 4.94 4.38 0.00 0.00 0.00 0.00 0.00 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 0.00 0.00 22 V 8.47 4.46 2.15 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 0.81 0.00 0.00 1.02 0.00 0.00 23 K 8.27 4.73 0.00 0.79 0.74 0.00 1.53 0.00 0.00 1.65 0.00 0.00 2.76 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.03 1.25 7.81 24 V 7.99 4.60 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 0.77 0.00 0.00 0.85 0.00 0.00 25 G 8.63 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 26 D 8.71 4.86 0.00 2.73 2.72 0.00 0.00 0.00 0.00 0.00 0.00 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 K 7.51 4.69 0.00 1.64 1.68 0.00 1.61 0.00 0.00 1.56 0.00 0.00 2.79 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.31 1.44 7.81 28 E 8.88 4.93 0.00 2.29 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 2.18 2.28 0.00 29 L 8.70 5.49 0.00 1.60 1.74 0.68 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 30 F 9.64 5.78 0.00 3.04 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 31 T 8.67 4.24 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 1.12 0.00 0.00 32 N 8.60 4.74 0.00 2.74 2.92 0.00 0.00 6.99 7.66 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 33 R 7.76 3.93 0.00 1.78 1.87 0.00 3.25 0.00 0.00 3.27 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.48 0.00 34 W 8.71 4.34 0.00 3.31 3.12 0.00 0.00 0.00 0.00 0.00 0.00 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 N 8.21 4.36 0.00 2.84 2.88 0.00 0.00 7.16 6.74 0.00 0.00 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 L 7.72 4.18 0.00 1.63 1.90 0.94 1.05 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 37 Q 7.21 3.00 0.00 1.90 1.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.61 0.00 0.00 0.00 0.00 0.00 1.84 2.38 0.00 38 S 7.73 4.55 0.00 3.87 3.80 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 0.00 0.00 0.00 39 L 9.06 4.18 0.00 1.84 1.43 0.91 0.38 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 40 L 8.03 4.21 0.00 2.11 2.08 1.36 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 41 L 8.15 4.12 0.00 2.14 1.82 1.08 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 42 S 7.89 4.33 0.00 4.06 3.90 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 0.00 0.00 0.00 43 A 8.64 4.12 1.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 8.47 3.93 0.00 2.19 2.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.73 0.00 0.00 0.00 0.00 0.00 2.41 2.45 0.00 45 I 7.50 3.92 1.91 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.78 0.94 0.00 0.00 46 T 7.44 4.46 4.27 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 0.00 0.00 1.23 0.00 0.00 47 G 8.08 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 48 M 7.74 4.39 0.00 2.06 2.10 0.00 0.00 0.00 0.00 0.00 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.68 2.59 0.00 49 T 8.41 4.97 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 1.19 0.00 0.00 50 V 8.57 4.75 1.73 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 0.66 0.00 0.00 0.81 0.00 0.00 51 T 8.15 4.83 4.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 52 I 8.45 4.40 1.57 0.00 0.00 0.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.87 0.72 0.16 0.00 0.00 53 K 8.10 4.78 0.00 1.67 1.86 0.00 1.71 0.00 0.00 1.80 0.00 0.00 2.79 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.55 1.32 7.81 54 T 8.31 4.56 4.27 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 0.00 0.00 1.18 0.00 0.00 55 N 9.02 4.43 0.00 2.75 2.86 0.00 0.00 6.84 7.35 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 56 A 7.93 4.45 1.21 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 0.00 0.00 57 C 7.53 4.94 0.00 2.90 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 58 H 7.28 4.83 0.00 3.36 3.38 0.00 5.71 0.00 0.00 0.00 0.00 6.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 N 8.58 4.84 0.00 2.78 2.86 0.00 0.00 7.16 7.65 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 60 G 9.58 4.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 61 G 7.49 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 62 G 8.54 4.17 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 0.00 0.00 0.00 63 F 8.33 5.18 0.00 2.86 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 64 S 8.89 4.38 0.00 3.79 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 65 E 8.28 4.83 0.00 2.03 1.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 2.28 0.00 66 V 8.42 4.72 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 0.23 0.00 0.00 1.16 0.00 0.00 67 I 7.72 4.56 1.76 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 1.27 0.90 0.00 0.00 68 F 9.07 4.56 0.00 2.99 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 69 R 8.34 4.31 0.00 1.74 1.84 0.00 3.18 0.00 0.00 3.25 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.68 0.00