NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.9289 8.3549 109.7391 45.5440 0.0000 172.9192 2 S 4.4752 8.1515 115.2814 55.4880 64.4591 172.1833 3 P 4.2814 0.0000 0.0000 62.8794 32.3662 175.8266 4 P 4.5753 0.0000 0.0000 61.9962 30.9306 177.4742 5 E 4.5943 7.5554 110.5489 57.0914 31.3058 174.6096 6 A 4.4024 7.3322 119.4189 52.3587 21.5236 176.7591 7 D 4.4907 7.6221 118.8610 54.6533 40.7226 175.2979 8 P 3.6924 0.0000 0.0000 65.4136 31.7023 178.3616 9 R 4.3062 8.4820 116.5825 57.1924 30.9191 178.0822 10 L 4.1753 7.2346 116.8473 56.0442 42.2057 178.1279 11 I 4.0059 8.3390 118.3802 62.6998 37.4800 176.9611 12 E 4.2145 7.5512 118.1365 58.9677 29.7015 177.7854 13 S 4.6446 7.9146 112.7604 59.6172 63.7353 175.6773 14 L 4.3608 7.5408 122.2683 57.3342 42.5124 178.2999 15 S 4.1632 8.6740 113.2126 60.8687 62.2389 175.9232 16 Q 4.0047 7.6317 123.4004 59.5114 28.9458 178.1530 17 M 4.5915 8.1091 117.6075 58.3479 31.2771 178.0127 18 L 4.0599 8.2208 121.2251 57.8708 42.3106 178.5076 19 S 4.2478 8.0191 112.4199 61.2996 62.4854 175.4575 20 M 4.1079 7.9619 120.2364 57.0651 32.6282 176.1834 21 G 4.0143 7.8552 107.8634 46.6065 0.0000 172.3768 22 F 5.2137 8.2153 116.2356 55.8285 43.1964 175.6620 23 S 4.1643 8.1327 117.5515 58.3984 65.4227 174.0276 24 D 3.9938 8.4143 126.8358 54.1080 41.1263 176.3842 25 E 4.4243 7.8769 127.2588 54.9547 29.7143 176.6801 26 G 3.7030 9.0326 115.0608 45.1704 0.0000 174.6294 27 G 3.9821 7.6958 108.8790 45.0661 0.0000 174.8105 28 W 4.4910 7.3573 117.2729 57.3831 28.5986 177.7155 29 L 3.5864 6.9662 122.1521 58.4334 41.1659 178.8325 30 T 3.9204 7.7037 108.7002 64.8992 68.7146 176.2110 31 R 3.9183 8.0635 120.9452 58.7546 29.7283 178.3297 32 L 4.0005 9.1227 120.9037 58.7250 42.1391 178.5495 33 L 3.9497 8.2544 118.6602 58.1737 41.3702 179.4116 34 Q 3.3502 8.3078 118.6123 59.1724 28.9226 179.1343 35 T 4.0850 7.5637 108.5531 62.9577 69.1724 174.8264 36 K 4.5114 7.1271 121.7743 57.1532 33.1504 175.3698 37 N 3.8762 9.0587 111.0954 54.2335 36.4086 173.6251 38 Y 3.5379 7.5839 115.3132 59.3122 35.5604 167.6902 39 D 4.9523 7.9006 120.4302 52.2032 43.4958 176.4999 40 I 4.2348 8.3931 119.1796 61.6017 38.7125 178.0232 41 G 3.4865 8.5236 110.2032 48.4469 0.0000 174.5305 42 A 4.2472 8.5627 122.4002 53.0622 20.0158 179.4093 43 A 4.1664 7.7493 117.7374 55.5472 18.6353 179.8967 44 L 3.9498 8.2859 117.8087 57.6240 41.2613 179.0345 45 D 5.1827 7.8964 120.2568 56.8175 40.8639 178.1737 46 T 4.1960 7.6017 107.3769 62.5599 70.1366 175.1463 47 I 4.2413 7.6126 116.5132 61.1411 37.7907 176.3874 48 Q 3.9557 8.2957 115.0728 57.2973 26.2662 174.3548 49 Y 4.8780 7.3833 116.1449 56.4398 37.9895 175.6649 50 S 4.6415 8.1993 112.8391 57.0539 62.5603 173.5651 51 K 4.1981 7.5362 115.6979 55.6808 34.4229 174.5871 52 H 4.3047 9.0411 122.9021 56.1417 28.7227 175.2286 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 G 8.35 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 2 S 8.15 4.48 0.00 4.19 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 3 P 0.00 4.28 0.00 2.15 1.99 0.00 3.57 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 2.11 0.00 4 P 0.00 4.58 0.00 2.06 2.11 0.00 3.71 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.09 0.00 5 E 7.56 4.59 0.00 2.01 1.95 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 2.17 2.28 0.00 6 A 7.33 4.40 1.20 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 0.00 0.00 0.00 7 D 7.62 4.49 0.00 2.74 2.27 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 0.00 8 P 0.00 3.69 0.00 2.18 2.10 0.00 3.57 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.11 0.00 9 R 8.48 4.31 0.00 1.27 1.80 0.00 3.28 0.00 0.00 3.22 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.89 0.00 10 L 7.23 4.18 0.00 1.58 1.59 0.82 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 11 I 8.34 4.01 1.83 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 1.39 0.61 0.91 0.00 0.00 12 E 7.55 4.21 0.00 2.33 1.92 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 2.27 2.39 0.00 13 S 7.91 4.64 0.00 4.04 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 14 L 7.54 4.36 0.00 1.69 1.85 0.93 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 15 S 8.67 4.16 0.00 3.87 4.05 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 16 Q 7.63 4.00 0.00 2.52 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.66 6.98 0.00 0.00 0.00 0.00 0.00 2.48 2.60 0.00 17 M 8.11 4.59 0.00 2.50 2.57 0.00 0.00 0.00 0.00 0.00 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.78 2.87 0.00 18 L 8.22 4.06 0.00 1.77 1.76 0.91 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 19 S 8.02 4.25 0.00 4.01 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 20 M 7.96 4.11 0.00 1.85 2.22 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.77 0.00 21 G 7.86 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 22 F 8.22 5.21 0.00 3.01 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 23 S 8.13 4.16 0.00 3.77 3.58 0.00 0.00 0.00 0.00 0.00 0.00 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 D 8.41 3.99 0.00 2.42 2.27 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 0.00 25 E 7.88 4.42 0.00 2.85 2.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.46 2.64 0.00 26 G 9.03 3.70 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 0.00 0.00 0.00 27 G 7.70 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 0.00 0.00 0.00 28 W 7.36 4.49 0.00 3.64 3.37 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 29 L 6.97 3.59 0.00 0.94 1.46 0.73 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 30 T 7.70 3.92 4.42 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 1.21 0.00 0.00 31 R 8.06 3.92 0.00 2.05 2.09 0.00 3.19 0.00 0.00 3.32 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.91 0.00 32 L 9.12 4.00 0.00 2.18 2.33 1.01 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 33 L 8.25 3.95 0.00 2.00 1.82 1.06 1.08 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 34 Q 8.31 3.35 0.00 2.02 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 7.16 0.00 0.00 0.00 0.00 0.00 2.36 2.11 0.00 35 T 7.56 4.09 4.21 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 1.22 0.00 0.00 36 K 7.13 4.51 0.00 1.53 1.80 0.00 1.82 0.00 0.00 1.75 0.00 0.00 2.99 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.32 1.42 7.81 37 N 9.06 3.88 0.00 2.97 2.89 0.00 0.00 6.38 7.58 0.00 0.00 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 Y 7.58 3.54 0.00 3.17 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 39 D 7.90 4.95 0.00 2.96 2.53 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 0.00 0.00 0.00 0.00 40 I 8.39 4.23 1.94 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.39 1.10 0.00 0.00 41 G 8.52 3.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.56 4.25 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.75 4.17 1.64 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 0.00 0.00 44 L 8.29 3.95 0.00 1.99 1.85 1.10 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 45 D 7.90 5.18 0.00 2.85 2.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 T 7.60 4.20 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 0.85 0.00 0.00 47 I 7.61 4.24 1.72 0.00 0.00 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.01 1.23 0.00 0.00 48 Q 8.30 3.96 0.00 1.94 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.55 7.54 0.00 0.00 0.00 0.00 0.00 2.22 2.45 0.00 49 Y 7.38 4.88 0.00 3.05 2.67 0.00 0.00 0.00 0.00 0.00 0.00 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 S 8.20 4.64 0.00 3.84 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 51 K 7.54 4.20 0.00 1.72 1.66 0.00 1.84 0.00 0.00 1.72 0.00 0.00 2.98 0.00 0.00 2.73 0.00 0.00 0.00 0.00 1.27 1.40 7.81 52 H 9.04 4.30 0.00 3.11 3.18 0.00 5.98 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