NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 N 4.7029 8.4249 119.2036 53.1082 40.3335 174.0495 2 S 4.1949 8.6202 119.5668 60.9270 63.7578 169.3736 3 V 5.1069 8.2730 110.8639 59.8508 36.0541 175.0576 4 R 4.6465 8.4426 117.1898 55.3187 33.1597 173.3330 5 D 4.8705 8.3421 120.2723 53.4329 42.3381 175.7397 6 A 2.5800 6.5406 123.2411 50.9777 24.0458 174.2011 7 Y 4.8996 7.7896 115.9696 57.3264 38.8510 175.8933 8 I 4.3013 8.3773 124.8129 61.0488 38.9898 174.3388 9 A 5.1791 8.6362 128.9668 50.5239 22.8972 175.1528 10 D 4.8359 8.2261 118.7305 52.1928 41.6927 177.2582 11 S 4.3927 8.6009 112.5071 60.2288 63.2743 173.9642 12 H 4.5277 8.8493 118.5390 55.0756 29.1214 173.8535 13 N 4.2273 7.8018 117.3677 55.1421 37.7182 172.7883 14 C 4.8653 7.9073 112.9072 54.6714 42.9885 174.5865 15 V 4.4051 7.9824 116.9694 61.5384 32.8542 175.0838 16 Y 4.5104 8.5565 119.4752 56.4734 39.1517 175.7842 17 E 4.7177 8.8768 124.3271 56.6267 30.5346 175.3942 18 C 4.8191 8.4812 114.2695 54.0778 44.7090 173.5723 19 A 4.6710 8.4404 121.7043 51.9929 21.1362 176.7358 20 R 5.0323 7.6320 113.6946 53.7609 34.2443 176.1182 21 N 4.6348 9.0968 118.7311 56.4683 38.6284 177.3417 22 E 3.9820 8.3431 120.3681 59.4082 29.7010 177.9958 23 Y 4.1544 7.7712 118.1848 61.1095 38.7968 177.7024 24 C 4.0552 8.1939 116.8702 59.7554 41.3970 175.3793 25 N 4.2777 8.3186 118.8215 56.5557 38.5527 176.4816 26 D 4.1873 8.1099 119.4080 57.2080 40.9627 177.8486 27 L 3.6515 7.5477 120.7587 58.2534 41.9819 178.3928 28 C 4.0274 8.2750 116.9239 60.2495 36.9800 176.2961 29 T 4.1280 8.2421 113.0470 63.9279 68.1550 176.3389 30 K 4.1631 7.9804 120.0462 58.4802 32.7129 177.2306 31 N 4.6513 7.1605 116.3826 53.0473 38.6242 175.7715 32 G 3.8800 7.9181 107.6923 44.8597 0.0000 174.2122 33 A 4.6582 7.7505 121.5827 51.0371 19.3672 178.6198 34 K 4.0553 8.8461 121.4761 59.5389 32.9940 176.5495 35 S 4.6496 7.6797 112.3311 58.4086 66.0041 174.0392 36 G 4.4448 9.1927 106.0485 46.2293 0.0000 172.0021 37 Y 5.0302 8.0716 117.5862 55.8428 42.0165 172.6691 38 C 4.5645 9.2922 121.2587 55.8031 45.6811 172.3687 39 Q 4.6674 8.6001 127.9373 54.5441 29.6574 175.9919 40 W 4.4254 9.2275 126.4651 57.9404 29.9442 176.9782 41 V 4.5947 7.4649 110.4863 59.3485 35.2694 174.5273 42 G 4.0094 8.3110 109.8864 45.5184 0.0000 173.0267 43 K 3.7079 9.0692 119.5710 59.1699 31.8897 177.1409 44 Y 4.6721 7.9425 113.3984 57.3494 38.9782 177.4563 45 G 3.9068 8.0220 108.2324 44.7343 0.0000 172.9474 46 N 4.7511 9.0074 119.6326 53.3143 39.6143 176.1162 47 G 4.5175 8.4318 115.2390 46.2715 0.0000 171.0998 48 C 4.9579 8.5397 119.2233 56.3941 42.5976 172.5545 49 W 4.7905 8.8008 133.7780 55.6157 32.8784 173.6472 50 C 5.2364 8.3394 124.4408 55.1713 43.3176 172.6808 51 I 4.6170 8.5088 123.3218 59.8895 38.7821 175.9126 52 E 3.6734 9.0914 128.0212 57.2513 27.5244 174.2422 53 L 4.4305 7.8981 121.3382 53.6645 44.0760 175.2805 54 P 4.7880 0.0000 0.0000 62.7241 32.4630 176.4067 55 D 4.7097 8.8553 121.7608 54.2290 39.3683 176.5583 56 N 4.6357 8.1910 115.3924 53.0624 38.2048 174.6738 57 V 4.3272 7.1863 119.1656 60.3465 33.5784 173.4990 58 P 4.6474 0.0000 0.0000 62.6350 32.4808 175.1544 59 I 5.0314 7.9527 114.6413 58.6316 41.0785 174.6535 60 K 4.1038 8.9188 125.8631 56.3977 32.4573 176.2898 61 G 4.2647 8.7599 115.5967 42.4394 0.0000 170.1486 62 P 4.2476 0.0000 0.0000 63.4385 31.5646 175.5857 63 G 3.9931 8.5031 107.2724 43.3141 0.0000 173.1963 64 K 4.2486 8.1415 119.0878 55.7181 33.9275 176.7459 65 C 4.7427 8.6727 119.6322 55.0353 44.0774 173.0760 66 H 4.5337 8.4699 122.3348 55.6986 28.1178 173.4234 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 N 8.42 4.70 0.00 2.70 2.78 0.00 0.00 7.03 6.75 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 2 S 8.62 4.19 0.00 3.89 3.89 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 0.00 0.00 0.00 3 V 8.27 5.11 1.93 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 0.67 0.00 0.00 0.91 0.00 0.00 4 R 8.44 4.65 0.00 1.79 1.93 0.00 2.88 0.00 0.00 3.29 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.69 0.00 5 D 8.34 4.87 0.00 2.71 2.79 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 0.00 0.00 0.00 6 A 6.54 2.58 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 Y 7.79 4.90 0.00 2.88 2.88 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 8 I 8.38 4.30 1.71 0.00 0.00 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.83 0.74 0.00 0.00 9 A 8.64 5.18 1.19 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 0.00 0.00 0.00 10 D 8.23 4.84 0.00 2.88 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 11 S 8.60 4.39 0.00 3.93 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 12 H 8.85 4.53 0.00 3.20 3.25 0.00 5.95 0.00 0.00 0.00 0.00 6.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 N 7.80 4.23 0.00 2.81 2.82 0.00 0.00 7.01 7.50 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 14 C 7.91 4.87 0.00 3.01 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 15 V 7.98 4.41 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.31 0.00 0.00 0.89 0.00 0.00 16 Y 8.56 4.51 0.00 2.99 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 17 E 8.88 4.72 0.00 1.87 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 2.35 2.32 0.00 18 C 8.48 4.82 0.00 3.01 3.17 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 19 A 8.44 4.67 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 20 R 7.63 5.03 0.00 1.97 1.91 0.00 3.22 0.00 0.00 3.40 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.70 0.00 21 N 9.10 4.63 0.00 2.89 3.02 0.00 0.00 6.67 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 22 E 8.34 3.98 0.00 2.15 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 0.00 2.43 2.49 0.00 23 Y 7.77 4.15 0.00 3.15 3.19 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 0.00 24 C 8.19 4.06 0.00 3.14 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 25 N 8.32 4.28 0.00 2.96 2.82 0.00 0.00 6.83 8.09 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 26 D 8.11 4.19 0.00 2.80 2.68 0.00 0.00 0.00 0.00 0.00 0.00 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 L 7.55 3.65 0.00 1.17 1.35 0.42 0.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 28 C 8.28 4.03 0.00 2.90 2.98 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 29 T 8.24 4.13 4.20 0.00 0.00 0.00 0.00 0.00 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 30 K 7.98 4.16 0.00 1.89 1.96 0.00 1.45 0.00 0.00 1.63 0.00 0.00 2.94 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.52 1.37 7.81 31 N 7.16 4.65 0.00 2.52 2.76 0.00 0.00 7.25 7.53 0.00 0.00 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 G 7.92 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 33 A 7.75 4.66 1.23 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 0.00 0.00 0.00 34 K 8.85 4.06 0.00 1.76 1.94 0.00 1.85 0.00 0.00 1.78 0.00 0.00 2.96 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.46 1.39 7.81 35 S 7.68 4.65 0.00 4.06 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 36 G 9.19 4.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Y 8.07 5.03 0.00 3.29 3.08 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 38 C 9.29 4.56 0.00 2.88 2.42 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 8.60 4.67 0.00 2.16 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.54 0.00 0.00 0.00 0.00 0.00 2.61 2.35 0.00 40 W 9.23 4.43 0.00 3.57 3.19 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 0.00 41 V 7.46 4.59 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 0.79 0.00 0.00 1.02 0.00 0.00 42 G 8.31 4.01 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 0.00 0.00 0.00 43 K 9.07 3.71 0.00 1.71 1.85 0.00 1.69 0.00 0.00 1.51 0.00 0.00 2.89 0.00 0.00 2.79 0.00 0.00 0.00 0.00 0.42 1.20 7.81 44 Y 7.94 4.67 0.00 2.24 2.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 G 8.02 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 46 N 9.01 4.75 0.00 2.82 2.81 0.00 0.00 6.66 7.98 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 47 G 8.43 4.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 C 8.54 4.96 0.00 2.92 2.90 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 49 W 8.80 4.79 0.00 2.81 1.86 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 50 C 8.34 5.24 0.00 2.52 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 51 I 8.51 4.62 1.90 0.00 0.00 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 1.20 0.97 0.00 0.00 52 E 9.09 3.67 0.00 2.10 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 2.23 2.23 0.00 53 L 7.90 4.43 0.00 1.60 1.51 0.85 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 54 P 0.00 4.79 0.00 2.20 1.92 0.00 3.69 0.00 0.00 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.05 0.00 55 D 8.86 4.71 0.00 2.65 2.94 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 56 N 8.19 4.64 0.00 2.83 2.94 0.00 0.00 5.95 7.68 0.00 0.00 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 V 7.19 4.33 2.14 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 0.76 0.00 0.00 0.92 0.00 0.00 58 P 0.00 4.65 0.00 2.31 1.93 0.00 3.59 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.07 0.00 59 I 7.95 5.03 1.88 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 0.63 0.81 0.00 0.00 60 K 8.92 4.10 0.00 1.54 1.60 0.00 1.45 0.00 0.00 1.33 0.00 0.00 2.16 0.00 0.00 2.19 0.00 0.00 0.00 0.00 0.30 0.21 7.81 61 G 8.76 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 62 P 0.00 4.25 0.00 2.09 2.08 0.00 3.71 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 2.10 2.23 0.00 63 G 8.50 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 0.00 0.00 0.00 64 K 8.14 4.25 0.00 1.87 1.82 0.00 1.58 0.00 0.00 1.65 0.00 0.00 3.00 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.40 1.46 7.81 65 C 8.67 4.74 0.00 2.92 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 66 H 8.47 4.53 0.00 3.21 3.21 0.00 5.84 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00