NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 5 T 4.3358 8.1744 110.9441 61.2547 70.5703 173.5132 6 N 4.7870 7.9529 119.5306 53.0750 39.3027 172.8929 7 S 4.3695 8.1925 112.2391 57.8652 64.7528 172.9855 8 D 4.8486 8.5402 121.9269 54.7185 42.3982 174.5047 9 F 5.3862 7.8323 115.7444 55.6588 41.6063 173.7248 10 V 4.4946 9.0954 112.6244 59.6508 34.6462 175.0538 11 V 4.7982 8.5284 124.1432 61.6485 33.4407 174.5596 12 I 5.0027 8.9334 128.6156 59.3312 40.6250 174.1437 13 K 5.0491 9.2937 128.6209 54.3281 34.4676 174.9927 14 A 4.4535 8.7377 130.3822 52.1253 19.2378 177.4026 15 L 4.8073 8.6918 121.3374 54.5345 42.7985 175.6743 16 E 4.7306 7.6845 115.7464 55.0666 32.6419 174.2134 17 D 4.4702 8.7222 120.3791 53.5991 42.1419 175.9767 18 G 4.0117 8.6634 105.0732 46.4130 0.0000 173.9037 19 V 3.9266 7.4812 118.3300 62.7436 33.0004 174.2413 20 N 5.2134 9.1758 124.9361 51.5824 41.1840 173.9746 21 V 4.5396 8.6212 123.9900 61.4610 33.3270 174.2648 22 I 4.4662 8.7271 130.2314 59.8044 39.3320 175.0982 23 G 4.2317 8.9485 114.0187 44.6122 0.0000 172.4132 24 L 5.4669 9.3848 126.7234 53.1331 44.0745 176.3702 25 T 4.6131 8.8420 114.0234 61.7914 69.4529 174.1762 26 R 3.9995 8.6311 125.9032 57.2826 30.6375 175.0647 27 G 3.7592 8.9560 109.7667 44.1345 0.0000 173.7026 28 A 4.1649 8.7470 121.4789 54.4259 18.5858 177.6549 29 D 4.9192 7.3655 114.9020 53.0892 42.9520 176.7820 30 T 4.5479 8.2595 122.5497 61.5411 68.2799 172.7660 31 R 4.5533 8.3142 121.9715 53.8754 32.5459 175.8513 32 F 5.2864 8.4976 116.8001 57.3893 39.6180 175.4587 33 H 5.0074 8.4908 119.8889 56.2009 30.5740 174.0869 34 H 4.7065 7.5306 116.7885 55.1108 33.1978 172.2748 35 S 4.8955 8.2962 119.8124 56.4221 65.3289 172.5649 36 E 4.4858 8.9585 126.5135 54.3554 31.2186 174.6753 37 K 4.7344 8.6277 126.9823 55.9121 33.2572 176.1189 38 L 4.9656 8.7817 125.3701 53.1003 44.5076 176.0447 39 D 5.0198 9.2012 123.2564 52.6202 43.1705 175.8194 40 K 3.7844 9.0983 122.2942 59.3799 32.0961 176.9751 41 G 4.0584 8.8425 115.5747 45.0481 0.0000 173.1806 42 E 4.2674 8.1198 119.9734 56.1614 30.8646 175.8721 43 V 4.8529 8.3180 122.5986 61.0153 34.0461 174.2011 44 L 4.6569 9.0383 130.1280 53.3489 44.4346 174.8653 45 I 4.9870 8.5102 127.0834 59.7504 38.7913 174.6402 46 A 4.7733 8.8923 129.0993 50.0928 22.0152 175.1456 47 Q 4.9591 8.4735 119.5990 54.1751 31.4315 175.3669 48 F 4.5288 8.3669 120.0714 57.8806 39.6950 175.4390 49 T 4.7314 8.8238 112.5048 60.0635 71.8626 173.1375 50 E 4.0454 8.9025 120.9208 59.3237 29.7726 177.3727 51 H 4.5972 8.1949 114.2765 56.3647 29.8186 174.1835 52 T 5.6148 8.1647 116.3483 60.8692 71.0277 174.4402 53 S 5.0083 9.2119 119.7627 58.1472 64.7952 173.8860 54 A 5.0825 8.0341 121.9068 50.8893 22.6159 174.8707 55 I 4.9725 8.6299 121.5648 59.3098 40.2344 174.8042 56 K 4.5588 8.9073 128.1481 54.5504 34.6731 174.6896 57 V 4.7712 8.4193 126.9804 61.3383 33.3109 174.6023 58 R 4.4820 8.9265 127.6697 55.7329 32.4135 176.4225 59 G 3.9828 8.9968 109.4968 43.8971 0.0000 172.2818 60 K 4.5023 8.8676 120.1804 56.3268 32.9331 175.6237 61 A 5.1234 9.1821 128.3951 51.0464 23.6224 173.7964 62 Y 4.8599 9.2602 121.2933 56.0029 41.1575 174.5615 63 I 4.9298 8.1340 127.4142 59.5009 40.7518 174.6920 64 Q 4.8329 8.8181 124.6839 54.3547 32.2377 174.6675 65 T 4.8773 8.4548 113.5879 59.1923 72.2692 174.8736 66 R 3.8100 8.5286 120.6755 59.0696 29.9649 176.4077 67 H 4.7751 7.5635 113.3673 55.7940 29.0904 173.5440 68 G 3.7151 7.5514 106.2662 44.2270 0.0000 173.2877 69 V 4.7497 7.6038 110.7463 59.9745 34.5227 175.1627 70 I 4.2809 7.6356 120.4025 60.4798 42.1269 172.6367 71 E 5.3051 8.6232 125.2349 54.3206 32.0585 176.0834 72 S 4.4339 8.7868 120.0962 58.2196 64.6672 172.9278 73 E 4.8486 8.7659 121.8737 54.4685 32.1061 176.3072 74 G 3.7306 8.6638 111.6888 45.7763 0.0000 173.4148 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 5 T 8.17 4.34 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 1.22 0.00 0.00 6 N 7.95 4.79 0.00 2.78 2.82 0.00 0.00 7.11 6.75 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 7 S 8.19 4.37 0.00 4.10 3.94 0.00 0.00 0.00 0.00 0.00 0.00 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 D 8.54 4.85 0.00 2.79 2.66 0.00 0.00 0.00 0.00 0.00 0.00 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 F 7.83 5.39 0.00 3.09 2.95 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 10 V 9.10 4.49 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 0.66 0.00 0.00 0.85 0.00 0.00 11 V 8.53 4.80 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 1.04 0.00 0.00 1.18 0.00 0.00 12 I 8.93 5.00 1.87 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 1.09 0.62 0.91 0.00 0.00 13 K 9.29 5.05 0.00 1.90 1.83 0.00 1.64 0.00 0.00 1.62 0.00 0.00 2.86 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.37 1.39 7.81 14 A 8.74 4.45 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 15 L 8.69 4.81 0.00 1.55 1.70 0.95 0.74 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 16 E 7.68 4.73 0.00 1.92 1.89 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 2.19 2.34 0.00 17 D 8.72 4.47 0.00 2.58 2.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 18 G 8.66 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 19 V 7.48 3.93 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 1.00 0.00 0.00 20 N 9.18 5.21 0.00 2.61 2.57 0.00 0.00 6.36 7.22 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 21 V 8.62 4.54 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 0.98 0.00 0.00 0.89 0.00 0.00 22 I 8.73 4.47 1.41 0.00 0.00 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.60 0.28 -0.37 0.00 0.00 23 G 8.95 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 0.00 0.00 0.00 0.00 24 L 9.38 5.47 0.00 1.87 1.70 0.98 -0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 0.00 0.00 0.00 0.00 0.00 0.00 25 T 8.84 4.61 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 1.39 0.00 0.00 26 R 8.63 4.00 0.00 1.89 1.98 0.00 3.37 0.00 0.00 3.23 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.61 0.00 27 G 8.96 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.75 4.16 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 29 D 7.37 4.92 0.00 2.80 2.57 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 0.00 0.00 0.00 0.00 30 T 8.26 4.55 4.26 0.00 0.00 0.00 0.00 0.00 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 0.00 0.00 31 R 8.31 4.55 0.00 2.00 2.05 0.00 2.79 0.00 0.00 3.35 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.65 0.00 32 F 8.50 5.29 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 33 H 8.49 5.01 0.00 3.15 3.49 0.00 5.79 0.00 0.00 0.00 0.00 6.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 H 7.53 4.71 0.00 3.27 3.03 0.00 5.80 0.00 0.00 0.00 0.00 6.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 S 8.30 4.90 0.00 3.61 3.51 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.96 4.49 0.00 2.12 1.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 2.30 0.00 37 K 8.63 4.73 0.00 1.64 1.72 0.00 1.59 0.00 0.00 1.67 0.00 0.00 3.03 0.00 0.00 2.72 0.00 0.00 0.00 0.00 1.40 1.50 7.81 38 L 8.78 4.97 0.00 1.56 1.54 0.91 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 39 D 9.20 5.02 0.00 2.58 2.66 0.00 0.00 0.00 0.00 0.00 0.00 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 K 9.10 3.78 0.00 1.61 1.86 0.00 1.76 0.00 0.00 1.70 0.00 0.00 3.01 0.00 0.00 3.18 0.00 0.00 0.00 0.00 1.46 1.41 7.81 41 G 8.84 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 42 E 8.12 4.27 0.00 2.07 1.87 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 2.32 2.33 0.00 43 V 8.32 4.85 2.09 0.00 0.00 0.00 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 0.96 0.00 0.00 44 L 9.04 4.66 0.00 1.74 1.47 0.90 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.00 0.00 0.00 0.00 0.00 0.00 45 I 8.51 4.99 1.74 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.74 0.58 0.00 0.00 46 A 8.89 4.77 1.13 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 47 Q 8.47 4.96 0.00 1.95 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.68 6.89 0.00 0.00 0.00 0.00 0.00 2.40 2.37 0.00 48 F 8.37 4.53 0.00 3.08 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 T 8.82 4.73 4.30 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 1.28 0.00 0.00 50 E 8.90 4.05 0.00 1.94 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 0.00 2.06 2.26 0.00 51 H 8.19 4.60 0.00 3.22 3.19 0.00 5.81 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 T 8.16 5.61 4.34 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 1.34 0.00 0.00 53 S 9.21 5.01 0.00 3.84 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 54 A 8.03 5.08 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 55 I 8.63 4.97 1.84 0.00 0.00 0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.60 0.86 0.00 0.00 56 K 8.91 4.56 0.00 1.81 1.55 0.00 1.72 0.00 0.00 1.62 0.00 0.00 2.88 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.33 1.39 7.81 57 V 8.42 4.77 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 0.85 0.00 0.00 0.90 0.00 0.00 58 R 8.93 4.48 0.00 1.75 1.79 0.00 3.16 0.00 0.00 3.20 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.54 0.00 59 G 9.00 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 60 K 8.87 4.50 0.00 1.89 1.72 0.00 1.66 0.00 0.00 1.66 0.00 0.00 2.92 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.46 1.42 7.81 61 A 9.18 5.12 1.22 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 0.00 0.00 62 Y 9.26 4.86 0.00 2.99 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 63 I 8.13 4.93 1.74 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 1.18 1.05 0.83 0.00 0.00 64 Q 8.82 4.83 0.00 1.92 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.55 0.00 0.00 0.00 0.00 0.00 2.10 2.03 0.00 65 T 8.45 4.88 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 1.15 0.00 0.00 66 R 8.53 3.81 0.00 1.61 1.77 0.00 3.12 0.00 0.00 3.20 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.59 0.00 67 H 7.56 4.78 0.00 3.19 3.25 0.00 5.68 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 68 G 7.55 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 69 V 7.60 4.75 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 0.70 0.00 0.00 0.97 0.00 0.00 70 I 7.64 4.28 1.82 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 1.08 0.84 0.00 0.00 71 E 8.62 5.31 0.00 1.89 1.86 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 2.53 2.43 0.00 72 S 8.79 4.43 0.00 3.95 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 73 E 8.77 4.85 0.00 1.84 1.88 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 2.21 2.28 0.00 74 G 8.66 3.73 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 0.00 0.00 0.00