NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 A 4.3426 8.2644 123.5846 52.7859 19.7696 176.9718 3 R 4.4320 8.3002 116.0847 56.2008 34.3171 173.0408 4 K 3.9925 8.9364 120.6665 57.7158 32.2850 178.0520 5 A 4.1177 9.1249 119.6094 55.0856 19.2637 179.5175 6 L 3.9099 7.8952 116.4663 58.1878 42.1227 179.1093 7 I 3.7719 8.8200 113.5975 64.6208 37.1346 177.8377 8 E 3.9279 8.0159 120.1527 58.3718 29.3744 178.9612 9 K 4.1597 8.3938 115.3019 57.8225 32.1557 177.0366 10 A 4.3825 7.7643 119.1212 53.1623 20.7584 178.4990 11 K 4.0175 7.6039 115.7960 58.1253 32.6564 178.2336 12 R 4.1583 7.3568 117.2917 56.0491 30.8219 176.8058 13 T 3.8291 9.0306 118.7187 66.6651 68.7759 174.6106 14 P 3.5250 0.0000 0.0000 62.1915 30.5515 175.8788 15 K 3.3035 9.4879 115.3696 58.2368 29.5008 172.7511 16 F 3.7964 7.9020 128.5373 56.8143 38.7676 175.2353 17 K 4.3611 8.5782 120.2649 59.0140 33.5868 179.1989 18 V 3.7148 8.0439 111.7970 64.2540 32.8568 178.4419 19 R 4.0898 7.7332 115.6257 55.5846 29.1814 181.3625 20 A 3.5531 8.2847 130.3509 53.9943 15.7694 175.8110 21 Y 5.0448 7.5966 128.6006 56.6318 41.3753 174.0636 22 T 3.5625 9.2196 113.2369 62.4174 67.3899 173.9886 23 R 4.0534 9.3658 130.2199 55.8470 28.9326 173.3919 24 C 3.6876 8.6976 124.5601 59.0736 32.0553 174.1856 25 V 3.8199 7.8067 126.6225 65.8671 33.1580 178.3942 26 R 4.1150 8.4470 117.3551 57.0456 28.6909 179.0017 27 C 3.9911 9.5057 118.8439 59.2028 30.4596 175.3645 28 G 3.9757 8.5193 107.9722 45.9577 0.0000 174.0709 29 R 4.0220 7.6501 119.6353 56.4225 30.5707 176.7867 30 A 4.8975 8.5449 124.3395 52.1393 21.3671 176.7413 31 R 4.4866 7.8691 113.3237 55.7911 32.4397 175.8330 32 S 3.6119 8.4400 115.3905 59.3418 59.5369 170.9094 33 V 4.9107 7.2923 112.1913 59.4804 34.9949 175.1859 34 Y 4.3972 8.9835 123.0696 56.9048 38.3255 176.2743 35 R 3.9601 9.0956 125.0001 59.5148 30.4257 178.4713 36 F 3.7584 8.4898 117.6652 60.5995 39.1495 175.6546 37 F 4.7546 7.8636 116.3617 56.2286 41.2009 174.9021 38 G 3.7920 9.5064 108.6324 45.5616 0.0000 171.8114 39 L 4.5444 7.4588 117.3020 53.8184 46.7008 175.0707 40 C 5.7822 8.6107 113.7670 55.8804 31.2487 174.7907 41 R 4.0606 8.7746 118.0842 60.0275 28.4825 178.4481 42 I 3.7747 7.6973 119.7690 64.0396 37.4536 177.4808 43 C 4.2983 7.9609 118.0899 62.2568 27.9497 175.4796 44 L 3.6919 7.9890 121.5830 58.7635 41.6405 179.2522 45 R 3.6643 7.5355 117.5346 58.5928 29.7760 178.1928 46 E 3.9095 7.9485 119.6740 59.0771 29.5820 178.6544 47 L 4.0022 8.1462 118.9381 57.6343 41.8220 178.9863 48 A 4.0578 7.7518 119.1481 55.2088 18.2936 178.7263 49 H 4.6157 7.6741 113.7181 57.9437 29.1076 177.0883 50 K 4.2881 8.2933 118.1099 56.5424 32.0341 178.3021 51 G 4.1546 8.0531 113.0676 46.1658 0.0000 176.1364 52 Q 3.8401 7.8349 117.2826 57.3709 29.1862 176.9730 53 L 4.5594 7.9827 118.9163 51.9570 42.2998 174.3812 54 P 4.0168 0.0000 0.0000 64.0916 31.4146 175.0547 55 G 4.0218 8.0368 115.3794 46.7563 0.0000 173.8974 56 V 3.3944 6.6669 126.5353 61.4962 30.5803 175.0753 57 R 4.6006 8.1207 127.2297 53.4642 32.8050 174.7910 58 K 3.8168 8.8289 123.8286 56.9171 33.2613 176.2399 59 A 4.4873 8.1948 124.9883 52.1436 17.6590 180.2557 60 S 4.5159 9.3902 113.0647 59.8682 61.9094 169.3366 61 W 3.8608 8.1629 119.0235 57.5527 27.2211 174.2905 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 2 A 8.26 4.34 1.29 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 0.00 0.00 3 R 8.30 4.43 0.00 1.84 1.88 0.00 3.24 0.00 0.00 3.21 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.70 0.00 4 K 8.94 3.99 0.00 1.87 1.48 0.00 1.70 0.00 0.00 1.83 0.00 0.00 3.02 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.44 1.48 7.81 5 A 9.12 4.12 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 6 L 7.90 3.91 0.00 1.68 1.88 1.00 0.87 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 7 I 8.82 3.77 1.87 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 0.62 1.01 0.00 0.00 8 E 8.02 3.93 0.00 2.00 2.03 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 2.40 2.31 0.00 9 K 8.39 4.16 0.00 1.72 1.99 0.00 1.81 0.00 0.00 1.78 0.00 0.00 3.07 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.54 1.52 7.81 10 A 7.76 4.38 1.01 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 11 K 7.60 4.02 0.00 1.73 1.84 0.00 1.69 0.00 0.00 1.68 0.00 0.00 3.01 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.42 1.71 7.81 12 R 7.36 4.16 0.00 1.79 1.85 0.00 3.21 0.00 0.00 3.22 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.84 0.00 13 T 9.03 3.83 4.23 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 1.21 0.00 0.00 14 P 0.00 3.52 0.00 2.11 2.18 0.00 3.67 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.13 0.00 15 K 9.49 3.30 0.00 1.86 2.04 0.00 1.95 0.00 0.00 1.82 0.00 0.00 2.99 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.14 1.38 7.81 16 F 7.90 3.80 0.00 3.24 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 17 K 8.58 4.36 0.00 1.97 2.09 0.00 1.58 0.00 0.00 1.85 0.00 0.00 3.02 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.51 1.51 7.81 18 V 8.04 3.71 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 0.73 0.00 0.00 0.95 0.00 0.00 19 R 7.73 4.09 0.00 1.88 1.10 0.00 3.52 0.00 0.00 3.34 7.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.71 0.00 20 A 8.28 3.55 1.40 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 0.00 0.00 0.00 21 Y 7.60 5.04 0.00 3.10 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 22 T 9.22 3.56 4.29 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 1.25 0.00 0.00 23 R 9.37 4.05 0.00 1.91 2.12 0.00 3.51 0.00 0.00 3.39 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.66 0.00 24 C 8.70 3.69 0.00 2.97 3.11 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 0.00 0.00 0.00 25 V 7.81 3.82 2.25 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 0.84 0.00 0.00 0.97 0.00 0.00 26 R 8.45 4.12 0.00 1.86 1.61 0.00 3.30 0.00 0.00 3.28 7.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.65 0.00 27 C 9.51 3.99 0.00 3.11 3.12 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 28 G 8.52 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 29 R 7.65 4.02 0.00 1.98 1.86 0.00 3.11 0.00 0.00 3.20 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.82 0.00 30 A 8.54 4.90 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 31 R 7.87 4.49 0.00 1.82 1.86 0.00 3.36 0.00 0.00 3.21 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.63 0.00 32 S 8.44 3.61 0.00 4.05 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 33 V 7.29 4.91 2.15 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 0.85 0.00 0.00 0.95 0.00 0.00 34 Y 8.98 4.40 0.00 3.41 3.22 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 35 R 9.10 3.96 0.00 1.95 2.04 0.00 3.19 0.00 0.00 3.30 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.70 0.00 36 F 8.49 3.76 0.00 2.89 2.73 0.00 0.00 0.00 0.00 0.00 0.00 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 F 7.86 4.75 0.00 3.12 3.07 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 0.00 0.00 0.00 0.00 38 G 9.51 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 0.00 0.00 0.00 0.00 39 L 7.46 4.54 0.00 1.78 1.59 0.91 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 40 C 8.61 5.78 0.00 3.16 3.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 R 8.77 4.06 0.00 2.24 2.44 0.00 3.01 0.00 0.00 3.39 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.82 0.00 42 I 7.70 3.77 1.89 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 1.65 0.94 0.92 0.00 0.00 43 C 7.96 4.30 0.00 2.97 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 L 7.99 3.69 0.00 1.68 1.68 0.19 0.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 45 R 7.54 3.66 0.00 1.61 1.79 0.00 3.19 0.00 0.00 3.04 7.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 1.24 0.00 46 E 7.95 3.91 0.00 2.28 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 2.29 2.33 0.00 47 L 8.15 4.00 0.00 1.63 1.64 0.91 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 48 A 7.75 4.06 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 49 H 7.67 4.62 0.00 3.50 3.31 0.00 5.62 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 50 K 8.29 4.29 0.00 1.89 1.82 0.00 1.72 0.00 0.00 1.65 0.00 0.00 2.89 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.46 1.63 7.81 51 G 8.05 4.15 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 0.00 0.00 0.00 52 Q 7.83 3.84 0.00 2.03 2.21 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 2.41 2.47 0.00 53 L 7.98 4.56 0.00 1.51 1.56 0.70 0.94 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 54 P 0.00 4.02 0.00 2.13 2.10 0.00 3.91 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.17 0.00 55 G 8.04 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 0.00 0.00 0.00 56 V 6.67 3.39 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 0.74 0.00 0.00 1.16 0.00 0.00 57 R 8.12 4.60 0.00 1.91 1.76 0.00 3.33 0.00 0.00 3.17 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.58 0.00 58 K 8.83 3.82 0.00 1.76 1.77 0.00 1.87 0.00 0.00 1.73 0.00 0.00 2.95 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.45 1.41 7.81 59 A 8.19 4.49 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 60 S 9.39 4.52 0.00 4.02 4.27 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 61 W 8.16 3.86 0.00 3.39 3.18 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 0.00 0.00 0.00 0.00