NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 R 4.3168 8.1133 121.1215 56.2595 32.0832 173.6631 2 I 4.5765 8.2431 125.2034 59.6268 38.7783 174.3922 3 C 4.8445 10.0277 126.8600 55.9283 42.6270 172.5916 4 R 5.2998 8.7158 122.0024 54.5648 31.8514 175.2459 5 R 4.6055 8.8636 125.2385 53.6734 33.2535 174.7694 6 R 4.1143 8.5118 122.9354 56.3828 29.7972 176.2084 7 S 4.0397 8.9059 118.8706 58.2214 62.6994 172.6496 8 A 4.2440 8.3062 130.5181 53.9566 18.1984 177.4729 9 G 4.0370 8.9748 111.3466 45.2858 0.0000 172.9984 10 F 4.3224 7.5528 122.0780 57.8242 39.8229 176.0410 11 K 4.0404 7.2904 127.9426 55.7173 31.3503 178.7463 12 G 3.8638 7.6912 117.1820 45.8344 0.0000 171.8337 13 P 4.8782 0.0000 0.0000 61.5603 32.2440 177.3269 14 C 4.8900 8.5078 121.3520 55.9515 42.0952 173.1164 15 V 3.6251 8.0115 122.9416 64.7385 31.9316 176.4177 16 S 4.5958 7.9148 116.5604 56.7740 62.8091 173.6283 17 N 4.2612 8.6969 128.1470 56.2807 38.3960 176.9615 18 K 3.9099 8.0894 120.3095 59.8582 32.2584 178.4567 19 N 4.5477 8.3369 116.4097 56.1302 38.3861 176.7128 20 C 3.9541 8.0974 120.2232 59.2278 44.6055 175.2493 21 A 3.9262 8.0147 122.5001 55.1701 17.9009 179.3233 22 Q 3.8885 8.1752 117.8572 59.5304 29.2582 178.4479 23 V 3.6359 8.2441 119.5677 66.3965 31.3645 177.4460 24 C 4.4592 8.4264 116.0626 60.4124 41.0645 175.9407 25 M 4.2370 8.2514 121.7174 57.8526 31.2862 178.4221 26 Q 4.0243 8.6118 119.1846 59.5048 29.3032 178.2690 27 E 4.2897 8.1741 117.7614 57.5689 29.5244 177.8138 28 G 4.0886 8.3141 107.0604 45.1896 0.0000 172.9790 29 W 4.3613 8.5756 119.2780 53.9191 31.2361 176.3015 30 G 3.7663 8.5453 109.5880 49.1291 0.0000 173.7057 31 G 4.4649 9.1625 106.0393 43.5715 0.0000 170.3266 32 G 4.6270 8.5982 105.5831 44.3311 0.0000 172.2084 33 N 5.1300 9.4211 119.2458 51.4195 42.8465 172.6564 34 C 5.0387 8.8530 121.0583 55.3934 41.5515 172.7204 35 D 4.9537 8.9516 123.8654 51.9888 42.1497 178.0368 36 G 3.8542 8.9410 111.1790 46.6594 0.0000 172.5136 37 P 4.5460 0.0000 0.0000 62.4639 31.5572 178.0043 38 L 3.9837 8.1316 122.4978 56.2176 41.2702 176.5329 39 R 4.2391 7.8996 115.1394 57.3804 30.0721 175.7237 40 R 4.7585 8.0294 118.5202 54.6780 33.8686 172.8332 41 C 5.1298 8.7994 124.5170 54.7232 45.0962 172.3920 42 K 5.1020 9.0763 123.1108 54.7730 35.6858 174.3225 43 C 5.5872 9.1905 119.4782 55.3481 43.6948 173.0723 44 M 6.3000 9.9107 119.7029 52.7055 34.0344 174.5861 45 R 4.9118 8.4293 117.9319 54.2305 33.8293 174.0486 46 R 4.5736 8.2868 118.5351 56.3524 30.8070 176.0929 47 C 4.4970 9.2407 117.4836 55.6673 42.5930 173.7490 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 R 8.11 4.32 0.00 1.91 1.86 0.00 3.13 0.00 0.00 3.34 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 2 I 8.24 4.58 1.88 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.82 0.99 0.00 0.00 3 C 10.03 4.84 0.00 2.94 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 4 R 8.72 5.30 0.00 1.68 1.86 0.00 3.27 0.00 0.00 3.19 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.70 0.00 5 R 8.86 4.61 0.00 1.50 0.66 0.00 2.21 0.00 0.00 2.68 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 1.19 0.00 6 R 8.51 4.11 0.00 1.78 1.87 0.00 3.15 0.00 0.00 3.09 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.53 0.00 7 S 8.91 4.04 0.00 3.73 3.77 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 0.00 0.00 0.00 8 A 8.31 4.24 1.22 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 0.00 0.00 0.00 0.00 0.00 0.00 9 G 8.97 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 10 F 7.55 4.32 0.00 2.96 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 11 K 7.29 4.04 0.00 1.37 1.51 0.00 1.77 0.00 0.00 1.59 0.00 0.00 2.92 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.29 1.26 7.81 12 G 7.69 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 0.00 0.00 0.00 13 P 0.00 4.88 0.00 2.25 2.10 0.00 3.33 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.91 0.00 14 C 8.51 4.89 0.00 2.81 3.38 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 0.00 15 V 8.01 3.63 2.12 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 0.84 0.00 0.00 0.96 0.00 0.00 16 S 7.91 4.60 0.00 3.98 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 17 N 8.70 4.26 0.00 2.85 2.85 0.00 0.00 6.64 7.25 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 18 K 8.09 3.91 0.00 1.84 1.85 0.00 1.73 0.00 0.00 1.84 0.00 0.00 2.98 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.54 1.56 7.81 19 N 8.34 4.55 0.00 3.08 3.04 0.00 0.00 6.99 7.84 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 20 C 8.10 3.95 0.00 2.13 2.78 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 21 A 8.01 3.93 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 8.18 3.89 0.00 2.19 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 6.72 0.00 0.00 0.00 0.00 0.00 2.40 2.40 0.00 23 V 8.24 3.64 2.28 0.00 0.00 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 1.16 0.00 0.00 24 C 8.43 4.46 0.00 3.23 3.33 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 25 M 8.25 4.24 0.00 2.10 2.27 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.79 2.63 0.00 26 Q 8.61 4.02 0.00 2.15 2.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 7.05 0.00 0.00 0.00 0.00 0.00 2.42 2.45 0.00 27 E 8.17 4.29 0.00 2.37 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 2.33 2.47 0.00 28 G 8.31 4.09 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 W 8.58 4.36 0.00 3.45 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 30 G 8.55 3.77 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 0.00 0.00 0.00 0.00 0.00 0.00 31 G 9.16 4.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.60 4.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 N 9.42 5.13 0.00 2.57 2.64 0.00 0.00 7.00 7.59 0.00 0.00 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 C 8.85 5.04 0.00 2.79 2.96 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 35 D 8.95 4.95 0.00 2.73 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 36 G 8.94 3.85 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 0.00 0.00 0.00 37 P 0.00 4.55 0.00 2.24 2.27 0.00 3.87 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 2.07 1.98 0.00 38 L 8.13 3.98 0.00 1.94 1.90 0.92 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.37 0.00 0.00 0.00 0.00 0.00 0.00 39 R 7.90 4.24 0.00 1.87 1.99 0.00 3.24 0.00 0.00 3.12 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 1.73 0.00 40 R 8.03 4.76 0.00 1.92 1.87 0.00 3.11 0.00 0.00 3.10 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.58 0.00 41 C 8.80 5.13 0.00 2.42 2.33 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 42 K 9.08 5.10 0.00 1.75 1.60 0.00 1.75 0.00 0.00 1.62 0.00 0.00 2.80 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.29 1.28 7.81 43 C 9.19 5.59 0.00 2.40 2.99 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 44 M 9.91 6.30 0.00 2.12 2.20 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.66 2.53 0.00 45 R 8.43 4.91 0.00 1.47 1.71 0.00 2.36 0.00 0.00 2.34 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.78 0.00 46 R 8.29 4.57 0.00 1.60 1.81 0.00 3.11 0.00 0.00 3.22 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.56 0.00 47 C 9.24 4.50 0.00 2.83 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