NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.2777 8.2649 123.5851 51.6004 20.5296 176.7062 2 V 4.1308 7.4262 108.7916 58.9924 33.0974 173.0514 3 D 4.7092 9.1999 126.7397 52.7370 40.7949 174.3520 4 F 4.8291 8.3589 119.5246 57.9060 46.3067 174.9340 5 S 4.9564 7.5897 113.7925 57.0736 65.6836 174.4586 6 S 4.5947 8.5420 111.2902 59.1783 63.6184 176.0317 7 C 4.0189 8.5024 130.5724 58.9547 37.2333 173.1721 8 A 4.6664 7.8015 115.1080 52.3394 18.5351 178.7345 9 R 4.1285 8.0551 122.1271 58.1851 30.8526 176.5313 10 M 3.1006 7.9616 114.9660 56.4602 30.5543 176.7583 11 D 4.6042 7.4559 115.5269 54.4789 40.5821 177.4885 12 V 3.8938 7.4873 111.4804 60.0883 32.2679 173.9846 13 P 4.2846 0.0000 0.0000 65.7215 30.8649 176.4322 14 G 3.4574 8.1567 109.1505 45.4409 0.0000 175.1512 15 L 4.0999 7.8482 121.9185 58.2421 40.6223 178.6885 16 S 4.2389 8.1771 114.0267 61.1318 62.2024 175.9494 17 K 4.4957 7.6767 123.0629 59.0555 32.1014 178.9559 18 V 3.6930 7.7357 117.7236 65.5618 31.4478 177.6869 19 A 4.0709 8.6016 121.3384 54.4406 18.2744 179.0359 20 Q 4.2555 8.0318 115.4890 58.2282 29.1292 178.4748 21 G 3.6249 7.8954 107.8443 47.2052 0.0000 175.5444 22 L 4.1142 7.7966 121.4049 58.6442 40.9893 178.5588 23 C 4.4009 7.9454 117.4772 59.4447 39.6996 176.0388 24 I 3.7784 8.0457 120.5406 64.0729 37.7960 178.1133 25 S 4.1558 7.8296 116.0671 61.5094 62.4706 176.7687 26 S 4.0877 8.2162 115.9142 61.9188 62.8443 175.7644 27 C 4.4918 7.8563 117.9694 58.3952 38.5026 175.2970 28 K 4.0866 8.0437 122.6874 57.7936 31.6124 178.0560 29 F 3.9781 7.9855 120.3913 61.4311 39.2676 176.5542 30 Q 4.0887 8.2039 115.6904 56.5659 28.5182 176.2580 31 N 4.5100 9.0539 117.4897 54.2446 36.3645 174.6937 32 C 5.2130 7.1643 108.9643 57.1668 40.8750 174.6326 33 G 3.9874 7.9998 107.3744 46.0602 0.0000 172.5237 34 T 4.5854 8.4848 122.3420 60.1436 69.3540 173.7120 35 G 4.1342 8.6132 116.5170 46.3103 0.0000 172.5105 36 H 5.0716 9.0861 122.3278 54.0221 32.8947 170.8282 37 C 4.5409 9.0145 118.2226 55.1144 35.5262 172.1865 38 E 4.3465 9.1772 128.3393 55.1303 28.8560 173.9933 39 K 5.0443 8.2243 125.1303 54.0026 34.9287 173.8006 40 R 4.4518 8.8399 121.0500 56.5655 33.2079 175.1132 41 G 3.9528 8.0322 107.9985 46.3366 0.0000 173.8071 42 G 4.0644 8.4953 106.8834 45.0211 0.0000 174.7392 43 R 4.5383 7.7968 121.9346 53.0379 30.8338 171.0688 44 P 4.4919 0.0000 0.0000 62.8792 32.0195 175.8756 45 T 4.5452 8.4230 121.4538 61.9714 71.4560 173.3373 46 C 5.3428 8.6816 125.3621 55.1672 44.5787 172.0621 47 V 4.1970 8.4091 117.4284 60.3539 33.0658 174.2397 48 C 5.8277 8.8781 122.2260 54.5909 42.6351 173.6572 49 D 4.5247 8.6242 123.1775 52.4750 41.5596 176.5261 50 R 4.4731 8.2353 126.1955 54.7732 30.3887 174.1087 51 C 4.7361 8.2253 116.5984 55.7840 44.8342 173.1572 52 G 4.0317 9.0044 114.8888 46.1669 0.0000 173.3756 53 R 4.1597 8.4012 123.9964 56.2911 30.2763 175.2241 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 A 8.26 4.28 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 2 V 7.43 4.13 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.73 0.00 0.00 0.93 0.00 0.00 3 D 9.20 4.71 0.00 2.57 2.44 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 4 F 8.36 4.83 0.00 3.05 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 5 S 7.59 4.96 0.00 3.88 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 6 S 8.54 4.59 0.00 3.95 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 7 C 8.50 4.02 0.00 3.22 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 8 A 7.80 4.67 1.28 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 0.00 0.00 0.00 0.00 0.00 0.00 9 R 8.06 4.13 0.00 1.90 2.13 0.00 3.39 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 1.65 1.67 0.00 10 M 7.96 3.10 0.00 2.18 2.11 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.51 0.00 11 D 7.46 4.60 0.00 2.80 2.77 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 12 V 7.49 3.89 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 0.72 0.00 0.00 0.94 0.00 0.00 13 P 0.00 4.28 0.00 2.03 2.14 0.00 3.67 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 2.03 2.11 0.00 14 G 8.16 3.46 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 15 L 7.85 4.10 0.00 1.93 1.94 0.92 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 16 S 8.18 4.24 0.00 3.91 3.92 0.00 0.00 0.00 0.00 0.00 0.00 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 K 7.68 4.50 0.00 2.02 1.78 0.00 1.73 0.00 0.00 1.67 0.00 0.00 2.91 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.43 1.30 7.81 18 V 7.74 3.69 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 1.07 0.00 0.00 0.93 0.00 0.00 19 A 8.60 4.07 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 8.03 4.26 0.00 2.29 2.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.93 0.00 0.00 0.00 0.00 0.00 2.51 2.34 0.00 21 G 7.90 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 22 L 7.80 4.11 0.00 1.94 1.91 0.94 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 23 C 7.95 4.40 0.00 3.18 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 24 I 8.05 3.78 1.90 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.57 0.94 0.00 0.00 25 S 7.83 4.16 0.00 4.04 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 26 S 8.22 4.09 0.00 3.94 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 27 C 7.86 4.49 0.00 3.17 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 0.00 28 K 8.04 4.09 0.00 1.97 2.02 0.00 1.75 0.00 0.00 1.74 0.00 0.00 2.88 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.43 1.46 7.81 29 F 7.99 3.98 0.00 3.09 3.14 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 0.00 30 Q 8.20 4.09 0.00 2.33 2.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.71 6.02 0.00 0.00 0.00 0.00 0.00 2.63 2.54 0.00 31 N 9.05 4.51 0.00 2.80 2.94 0.00 0.00 6.71 7.52 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 32 C 7.16 5.21 0.00 2.98 3.02 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 0.00 0.00 0.00 33 G 8.00 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 34 T 8.48 4.59 4.25 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 1.33 0.00 0.00 35 G 8.61 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 36 H 9.09 5.07 0.00 3.07 3.15 0.00 5.61 0.00 0.00 0.00 0.00 6.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 C 9.01 4.54 0.00 2.99 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 38 E 9.18 4.35 0.00 2.14 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 0.00 2.28 2.30 0.00 39 K 8.22 5.04 0.00 1.77 1.63 0.00 1.62 0.00 0.00 2.44 0.00 0.00 2.94 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.37 1.26 7.81 40 R 8.84 4.45 0.00 1.78 1.71 0.00 3.25 0.00 0.00 3.23 8.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.60 0.00 41 G 8.03 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 0.00 0.00 0.00 42 G 8.50 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 43 R 7.80 4.54 0.00 1.91 1.80 0.00 3.23 0.00 0.00 3.39 7.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.64 0.00 44 P 0.00 4.49 0.00 2.12 2.09 0.00 3.80 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.00 0.00 45 T 8.42 4.55 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 1.22 0.00 0.00 46 C 8.68 5.34 0.00 2.96 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 47 V 8.41 4.20 2.11 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 0.82 0.00 0.00 1.06 0.00 0.00 48 C 8.88 5.83 0.00 2.82 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 49 D 8.62 4.52 0.00 2.65 2.64 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.24 4.47 0.00 1.96 1.90 0.00 3.23 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 1.60 1.66 0.00 51 C 8.23 4.74 0.00 3.13 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 52 G 9.00 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 53 R 8.40 4.16 0.00 1.74 1.76 0.00 3.26 0.00 0.00 3.25 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.57 0.00