NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 P 4.4958 0.0000 0.0000 62.6524 33.3275 174.8226 2 I 4.9101 8.3299 122.2310 58.9836 40.3884 173.0831 3 A 4.7459 9.3433 128.8792 50.0330 22.2268 174.1679 4 Q 4.9269 8.7772 123.5528 54.2471 31.4317 174.5294 5 I 4.5126 9.1708 127.5820 59.8340 40.2618 174.0844 6 H 5.1968 8.8491 124.7446 54.4473 29.8775 174.5829 7 I 4.6525 8.3664 116.1809 58.6753 41.3542 174.8628 8 L 4.6141 8.3467 123.0340 54.3951 42.2542 176.9246 9 E 4.1584 8.7676 120.8018 57.0899 29.8639 175.6443 10 G 3.6957 9.1409 112.0639 46.2056 0.0000 175.1809 11 R 4.1561 7.7499 118.2025 56.0574 30.9491 176.7396 12 S 4.5685 8.2447 115.5135 57.7338 65.7146 175.1530 13 D 4.4076 8.4423 121.2321 57.1775 40.4859 178.9447 14 E 3.9561 8.0714 118.9492 59.5583 29.5234 179.1186 15 Q 4.0174 7.9097 117.5542 58.9578 28.6547 179.1272 16 K 3.9709 7.9882 119.1439 59.2804 32.0664 179.0957 17 E 3.9184 8.3689 119.7808 59.5366 29.5021 179.0753 18 T 3.8785 8.0735 115.9027 66.2617 68.4187 176.3851 19 L 3.9256 8.0220 122.4527 58.4327 42.1697 179.1076 20 I 3.6800 7.9831 119.8695 64.3107 37.0028 178.5464 21 R 3.8651 7.8815 119.3935 59.4614 30.0297 178.3490 22 E 3.9566 8.7843 118.8107 59.5212 29.3886 179.6427 23 V 3.6166 8.1709 118.6186 65.8521 31.4804 178.2229 24 S 4.1007 7.9021 114.5022 61.7650 62.6644 176.5342 25 E 3.9290 8.2409 120.9067 59.2844 29.1820 179.2746 26 A 3.9885 8.1219 120.7576 55.2516 18.3746 179.8083 27 I 3.6463 8.0122 118.4985 64.4332 37.2147 178.4868 28 S 4.1617 8.2257 114.1038 61.5663 61.8964 176.5308 29 R 3.9093 8.2797 120.8508 59.3941 29.6320 179.1343 30 S 4.1726 7.9124 113.4215 61.4116 62.8557 175.6112 31 L 4.2642 8.0239 116.9556 53.9110 42.5591 175.5837 32 D 4.3425 7.4825 115.7834 55.5568 39.5226 172.5857 33 A 4.8308 7.8546 121.1607 49.1246 22.4352 174.8180 34 P 4.3094 0.0000 0.0000 62.4975 31.8468 177.2192 35 L 3.8832 8.8164 125.1897 58.2475 42.0126 178.7174 36 T 4.0635 7.8625 107.0591 63.4082 68.9367 174.9347 37 S 4.4252 8.1106 116.0054 58.5036 63.7376 173.9551 38 V 4.2252 7.3935 122.6304 62.4475 32.0281 175.1943 39 R 4.7383 8.7196 127.0155 54.3328 32.9768 175.0812 40 V 4.8425 8.3724 122.4479 61.1231 34.4329 174.3386 41 I 4.5025 9.1623 128.6089 59.5476 39.9363 174.4211 42 I 4.6282 8.3888 127.6795 60.0411 38.9068 175.0395 43 T 4.4655 8.9952 125.3639 61.7676 70.4184 173.6572 44 E 4.8651 8.7501 126.4779 55.8190 30.9717 175.6512 45 M 4.7633 8.9636 123.6703 53.2333 34.8791 175.4395 46 A 4.4760 8.5524 125.0195 51.6118 19.3129 178.6280 47 K 4.1299 9.2776 121.5740 59.3430 32.2820 178.4146 48 G 3.8764 7.9771 104.8952 46.3850 0.0000 173.5293 49 H 4.9699 8.5937 116.1214 55.1689 29.7618 173.5944 50 F 5.1648 8.1547 122.7204 56.1421 41.6127 173.8967 51 G 4.2365 8.1793 115.7372 43.6207 0.0000 171.8866 52 I 4.1372 7.8286 122.5208 60.0729 40.0222 176.1308 53 G 3.6054 9.8564 112.8499 46.4084 0.0000 174.5124 54 G 3.9129 8.4977 107.7923 44.6594 0.0000 173.8754 55 E 4.6948 7.6290 118.9406 54.0564 32.2731 175.6568 56 L 4.5683 8.0763 120.4483 54.6123 43.5767 178.5426 57 A 4.1391 8.7660 124.4875 55.0381 18.3845 180.2072 58 S 4.2275 8.0547 112.0927 61.8972 63.0502 176.0406 59 K 4.1938 7.8243 121.1783 58.3554 32.2376 177.0895 60 V 3.7907 8.3457 124.1582 62.0245 31.4161 176.0179 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 P 0.00 4.50 0.00 2.13 2.24 0.00 3.60 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 1.97 2.01 0.00 2 I 8.33 4.91 1.87 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 1.27 0.79 0.90 0.00 0.00 3 A 9.34 4.75 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 4 Q 8.78 4.93 0.00 2.03 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.77 6.63 0.00 0.00 0.00 0.00 0.00 2.14 2.28 0.00 5 I 9.17 4.51 1.83 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.84 0.88 0.00 0.00 6 H 8.85 5.20 0.00 2.90 3.07 0.00 5.84 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 I 8.37 4.65 1.82 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 1.17 1.03 0.86 0.00 0.00 8 L 8.35 4.61 0.00 1.54 1.64 1.02 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 9 E 8.77 4.16 0.00 1.95 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 2.31 2.27 0.00 10 G 9.14 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 11 R 7.75 4.16 0.00 1.78 1.87 0.00 3.24 0.00 0.00 3.26 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.84 0.00 12 S 8.24 4.57 0.00 4.23 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 13 D 8.44 4.41 0.00 2.70 2.75 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 0.00 0.00 0.00 0.00 14 E 8.07 3.96 0.00 2.05 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 0.00 2.40 2.46 0.00 15 Q 7.91 4.02 0.00 2.23 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.81 0.00 0.00 0.00 0.00 0.00 2.37 2.40 0.00 16 K 7.99 3.97 0.00 1.97 1.84 0.00 1.65 0.00 0.00 1.55 0.00 0.00 2.99 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.44 1.72 7.81 17 E 8.37 3.92 0.00 2.27 2.00 0.00 0.00 0.00 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 2.34 0.00 18 T 8.07 3.88 4.40 0.00 0.00 0.00 0.00 0.00 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 19 L 8.02 3.93 0.00 1.84 1.88 0.91 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 20 I 7.98 3.68 2.00 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 0.92 0.90 0.00 0.00 21 R 7.88 3.87 0.00 1.99 2.06 0.00 3.09 0.00 0.00 3.16 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.66 0.00 22 E 8.78 3.96 0.00 2.01 1.98 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 2.51 2.46 0.00 23 V 8.17 3.62 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 1.11 0.00 0.00 0.98 0.00 0.00 24 S 7.90 4.10 0.00 4.08 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 25 E 8.24 3.93 0.00 2.11 2.00 0.00 0.00 0.00 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 2.57 0.00 26 A 8.12 3.99 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 27 I 8.01 3.65 1.99 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 1.40 0.76 0.91 0.00 0.00 28 S 8.23 4.16 0.00 3.96 4.02 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 29 R 8.28 3.91 0.00 1.87 1.96 0.00 3.19 0.00 0.00 3.16 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.88 0.00 30 S 7.91 4.17 0.00 4.05 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 31 L 8.02 4.26 0.00 1.72 1.70 0.92 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 32 D 7.48 4.34 0.00 2.84 2.69 0.00 0.00 0.00 0.00 0.00 0.00 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 7.85 4.83 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 34 P 0.00 4.31 0.00 2.23 2.21 0.00 3.72 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 1.95 0.00 35 L 8.82 3.88 0.00 1.74 1.73 0.92 0.76 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 36 T 7.86 4.06 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 1.21 0.00 0.00 37 S 8.11 4.43 0.00 3.98 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 38 V 7.39 4.23 2.17 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 0.76 0.00 0.00 0.93 0.00 0.00 39 R 8.72 4.74 0.00 1.79 1.78 0.00 3.11 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 1.53 1.53 0.00 40 V 8.37 4.84 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 0.80 0.00 0.00 0.92 0.00 0.00 41 I 9.16 4.50 1.84 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 1.21 0.83 0.87 0.00 0.00 42 I 8.39 4.63 1.84 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.53 0.87 0.00 0.00 43 T 9.00 4.47 3.79 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 1.14 0.00 0.00 44 E 8.75 4.87 0.00 1.83 1.85 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 2.24 2.30 0.00 45 M 8.96 4.76 0.00 1.91 1.86 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.46 0.00 46 A 8.55 4.48 1.12 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 47 K 9.28 4.13 0.00 1.76 1.94 0.00 1.71 0.00 0.00 1.73 0.00 0.00 3.00 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.53 1.45 7.81 48 G 7.98 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 49 H 8.59 4.97 0.00 3.22 3.35 0.00 5.62 0.00 0.00 0.00 0.00 6.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 F 8.15 5.16 0.00 2.99 2.92 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 51 G 8.18 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 0.00 0.00 0.00 0.00 52 I 7.83 4.14 1.71 0.00 0.00 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 -0.27 0.83 0.00 0.00 53 G 9.86 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 G 8.50 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 55 E 7.63 4.69 0.00 1.98 1.80 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 2.20 2.20 0.00 56 L 8.08 4.57 0.00 1.68 1.59 0.93 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 57 A 8.77 4.14 1.49 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 58 S 8.05 4.23 0.00 4.04 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 59 K 7.82 4.19 0.00 1.92 1.82 0.00 1.74 0.00 0.00 1.75 0.00 0.00 3.07 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.42 1.48 7.81 60 V 8.35 3.79 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 0.65 0.00 0.00 1.00 0.00 0.00