NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 0 A 4.2778 8.3645 123.5825 50.6105 20.8643 177.5211 1 N 4.7174 8.1167 115.7104 49.7029 38.7236 176.0176 2 Q 4.4114 8.2980 123.8595 55.9520 31.1471 174.9198 3 A 4.7501 8.5989 128.2948 51.2670 21.1013 175.8529 4 S 5.1798 8.7715 116.0135 56.2804 67.4725 173.4783 5 V 4.2677 8.5019 121.9529 62.8355 32.4242 175.0029 6 V 4.8388 8.6913 127.2542 60.5483 35.0394 174.3352 7 A 4.4327 8.9536 129.9198 52.5630 18.7298 177.4020 8 N 4.7248 9.1755 122.1433 54.6008 39.6182 174.2163 9 Q 4.6202 7.5462 114.0150 55.3547 31.7187 173.6162 10 L 4.2037 8.4820 122.3786 55.4105 42.9966 175.9469 11 I 4.3643 8.7317 127.9240 59.0419 38.5280 173.7044 12 P 4.6322 0.0000 0.0000 62.0655 32.0211 176.4601 13 I 3.6521 8.3742 122.6203 61.9386 38.7473 174.9494 14 N 4.2404 8.6339 123.3224 54.9967 36.7381 174.3532 15 T 4.7223 7.5973 112.5737 61.2364 72.1632 173.9529 16 A 4.3332 8.6838 128.3791 51.9005 19.2052 177.1405 17 L 4.2571 9.1761 124.2841 55.0402 42.9957 176.5640 18 T 4.8881 8.3078 112.2810 59.4660 72.2565 174.8976 19 L 4.0013 8.6133 121.9143 57.9436 41.8682 180.0914 20 V 3.6667 7.1625 117.5033 65.7723 31.6774 176.6802 21 M 4.2729 8.1072 118.2950 56.5418 32.1969 175.2077 22 M 5.2604 7.8709 118.4537 53.4193 34.9838 175.1908 23 R 4.6889 9.0081 120.3340 54.3856 33.3225 174.3037 24 S 5.1924 8.3513 113.0406 56.6872 64.7684 172.4979 25 E 4.6926 8.7530 125.6371 55.0083 33.6142 174.0966 26 V 4.2761 8.3413 125.4921 62.1934 31.8445 175.3895 27 V 4.6411 8.3025 120.3685 59.6327 35.5444 175.1506 28 T 4.6483 8.0536 110.2794 58.9875 71.3882 172.2337 29 P 4.4327 0.0000 0.0000 62.3397 32.1111 175.9265 30 V 3.8653 8.1848 119.2580 62.7956 32.7804 176.0526 31 G 4.3176 8.3846 115.2337 45.6890 0.0000 173.1389 32 I 4.0572 8.6863 124.8651 60.4304 38.3522 174.2855 33 P 4.7118 0.0000 0.0000 63.0215 31.7662 177.3568 34 A 4.0848 8.9842 124.9189 55.0217 18.0637 179.6198 35 E 4.1240 8.1353 114.4942 58.6757 30.1445 177.8192 36 D 4.6814 8.3524 119.7449 54.7603 41.2468 177.8122 37 I 3.6976 7.6636 122.2809 64.2427 37.0173 176.0721 38 P 4.2892 0.0000 0.0000 65.8661 30.9052 178.8189 39 R 4.0683 7.7562 115.5719 59.2020 30.2362 178.7457 40 L 4.2350 7.8516 117.5938 55.5595 41.7293 177.4201 41 V 3.8252 6.7283 117.9529 64.4098 31.7183 176.3777 42 S 4.0419 9.0840 122.0492 59.0229 61.6397 170.4842 43 M 4.4760 8.0586 120.7970 55.1773 33.3756 175.2099 44 Q 5.3235 8.3915 118.7696 53.6782 32.1658 175.4653 45 V 4.5625 8.2373 115.2498 60.7406 33.2908 176.0988 46 N 4.9772 8.8154 120.2284 52.8355 38.3911 174.2743 47 R 4.6744 7.5059 113.8158 55.0021 32.2910 174.4579 48 A 4.2584 8.6146 122.7070 52.2048 19.3861 177.1985 49 V 4.2170 8.8417 122.9251 60.2682 33.5914 173.4121 50 P 4.6688 0.0000 0.0000 61.9623 32.7038 175.9767 51 L 3.9924 8.4476 123.5928 57.0949 42.1866 177.7964 52 G 3.9730 8.9883 113.8954 45.6059 0.0000 173.5871 53 T 4.1838 7.6371 117.6994 63.3690 69.7578 174.2185 54 T 4.4407 8.3961 123.0772 63.3917 69.4548 174.1778 55 L 4.1680 8.9084 127.6849 54.8433 42.7423 176.3256 56 M 4.7662 8.4372 123.1152 52.6537 34.6040 174.9718 57 P 3.9427 0.0000 0.0000 65.9253 31.5543 178.1097 58 D 4.6029 8.0027 114.4369 55.1409 39.7689 176.5118 59 M 4.4507 8.1651 119.2815 54.9468 32.9450 175.4862 60 V 4.7287 7.3449 119.7869 60.5261 33.2851 174.8702 61 R 4.2143 8.6861 127.7795 57.5067 30.2075 177.2873 62 G 3.9506 9.0042 110.9930 45.3729 0.0000 172.5519 63 Y 4.1870 7.6626 120.7495 56.9626 39.3752 174.6684 64 A 4.2848 7.4550 128.5799 50.4585 22.2674 175.6224 65 A 3.8553 8.2205 124.6080 52.2478 18.7263 177.1238 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 0 A 8.36 4.28 1.24 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 1 N 8.12 4.72 0.00 2.82 2.67 0.00 0.00 6.55 6.57 0.00 0.00 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 Q 8.30 4.41 0.00 2.06 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.84 0.00 0.00 0.00 0.00 0.00 2.32 2.31 0.00 3 A 8.60 4.75 1.24 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 4 S 8.77 5.18 0.00 3.72 3.71 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 5 V 8.50 4.27 2.02 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 0.94 0.00 0.00 0.92 0.00 0.00 6 V 8.69 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 1.05 0.00 0.00 0.97 0.00 0.00 7 A 8.95 4.43 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 N 9.18 4.72 0.00 2.70 2.97 0.00 0.00 7.08 6.70 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 9 Q 7.55 4.62 0.00 2.05 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.61 6.69 0.00 0.00 0.00 0.00 0.00 2.23 2.34 0.00 10 L 8.48 4.20 0.00 1.67 1.62 0.92 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 11 I 8.73 4.36 1.86 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 1.22 0.63 0.90 0.00 0.00 12 P 0.00 4.63 0.00 1.93 1.98 0.00 3.69 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 2.02 2.08 0.00 13 I 8.37 3.65 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 1.34 0.73 0.91 0.00 0.00 14 N 8.63 4.24 0.00 2.90 2.87 0.00 0.00 6.76 6.98 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 15 T 7.60 4.72 4.41 0.00 0.00 0.00 0.00 0.00 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 16 A 8.68 4.33 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 17 L 9.18 4.26 0.00 1.75 1.60 0.97 0.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 18 T 8.31 4.89 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 19 L 8.61 4.00 0.00 1.73 1.77 0.92 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 20 V 7.16 3.67 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 0.81 0.00 0.00 0.93 0.00 0.00 21 M 8.11 4.27 0.00 2.13 2.19 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 2.61 2.50 0.00 22 M 7.87 5.26 0.00 1.86 1.93 0.00 0.00 0.00 0.00 0.00 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.42 0.00 23 R 9.01 4.69 0.00 1.83 2.03 0.00 2.70 0.00 0.00 3.09 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.52 0.00 24 S 8.35 5.19 0.00 3.86 3.74 0.00 0.00 0.00 0.00 0.00 0.00 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 8.75 4.69 0.00 2.07 1.70 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 2.21 2.25 0.00 26 V 8.34 4.28 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 0.84 0.00 0.00 0.93 0.00 0.00 27 V 8.30 4.64 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 0.82 0.00 0.00 0.92 0.00 0.00 28 T 8.05 4.65 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 29 P 0.00 4.43 0.00 2.19 2.10 0.00 3.75 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.95 0.00 30 V 8.18 3.87 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 0.80 0.00 0.00 0.93 0.00 0.00 31 G 8.38 4.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 I 8.69 4.06 1.71 0.00 0.00 0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.81 0.50 0.77 0.00 0.00 33 P 0.00 4.71 0.00 2.27 2.21 0.00 3.77 0.00 0.00 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.04 0.00 34 A 8.98 4.08 1.34 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 0.00 0.00 0.00 0.00 0.00 35 E 8.14 4.12 0.00 2.15 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 0.00 2.30 2.36 0.00 36 D 8.35 4.68 0.00 3.01 2.86 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 37 I 7.66 3.70 1.94 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 1.52 1.06 0.91 0.00 0.00 38 P 0.00 4.29 0.00 2.17 2.12 0.00 3.71 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.20 0.00 39 R 7.76 4.07 0.00 2.11 2.07 0.00 3.17 0.00 0.00 3.43 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.71 0.00 40 L 7.85 4.24 0.00 1.88 1.72 0.85 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 41 V 6.73 3.83 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 0.76 0.00 0.00 0.99 0.00 0.00 42 S 9.08 4.04 0.00 4.05 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 43 M 8.06 4.48 0.00 2.01 2.14 0.00 0.00 0.00 0.00 0.00 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.66 2.56 0.00 44 Q 8.39 5.32 0.00 1.99 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.98 0.00 0.00 0.00 0.00 0.00 2.44 2.20 0.00 45 V 8.24 4.56 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 0.82 0.00 0.00 0.96 0.00 0.00 46 N 8.82 4.98 0.00 2.85 3.04 0.00 0.00 6.67 7.03 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 47 R 7.51 4.67 0.00 1.79 1.89 0.00 3.03 0.00 0.00 3.22 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.62 0.00 48 A 8.61 4.26 1.24 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 49 V 8.84 4.22 2.06 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 1.00 0.00 0.00 0.93 0.00 0.00 50 P 0.00 4.67 0.00 2.10 1.95 0.00 3.66 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.08 0.00 51 L 8.45 3.99 0.00 1.57 1.59 0.99 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 52 G 8.99 3.97 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 0.00 0.00 0.00 53 T 7.64 4.18 4.28 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 1.19 0.00 0.00 54 T 8.40 4.44 4.22 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 1.24 0.00 0.00 55 L 8.91 4.17 0.00 1.56 1.48 0.94 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 56 M 8.44 4.77 0.00 2.04 1.98 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.62 0.00 57 P 0.00 3.94 0.00 2.24 2.38 0.00 3.58 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 2.13 0.00 58 D 8.00 4.60 0.00 2.79 2.81 0.00 0.00 0.00 0.00 0.00 0.00 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 M 8.17 4.45 0.00 2.05 2.17 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.40 0.00 60 V 7.34 4.73 2.05 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 1.09 0.00 0.00 0.80 0.00 0.00 61 R 8.69 4.21 0.00 1.85 1.88 0.00 3.25 0.00 0.00 3.24 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.70 0.00 62 G 9.00 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 63 Y 7.66 4.19 0.00 2.95 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 64 A 7.46 4.28 1.06 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 65 A 8.22 3.86 1.24 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