NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 6 E 4.3482 8.3033 121.4753 56.3331 31.8538 177.8343 7 E 3.8306 8.2490 118.0961 59.2713 29.5743 175.7959 8 E 3.9060 9.2231 119.3022 59.5516 29.6447 179.2845 9 I 3.6391 7.4936 120.1883 64.4277 37.1847 178.3895 10 R 4.7451 8.5081 116.1869 58.5966 29.5484 178.2825 11 E 3.9760 8.1361 120.7884 59.1654 28.2723 178.3465 12 A 4.0669 7.7773 120.4137 54.9064 18.3991 179.5339 13 F 4.5574 7.5773 115.1810 60.7023 38.7821 177.5588 14 R 4.3057 7.5996 118.8263 58.7968 29.8385 177.9668 15 V 3.6945 7.0968 115.7878 66.7705 31.4624 177.5056 16 F 4.2708 7.5842 113.5192 58.7551 39.4309 175.1295 17 D 4.5659 8.5912 117.4202 54.0235 41.8967 175.7462 18 K 4.1854 8.8640 125.5457 57.5140 34.1785 175.3172 19 D 4.8487 9.3096 116.8120 51.3742 42.8114 175.1917 20 G 4.3712 7.6346 109.8538 43.6525 0.0000 171.6246 21 N 5.1238 8.0485 117.6375 53.3955 40.9446 175.3820 22 G 3.7946 7.9369 109.3003 45.1148 0.0000 175.5862 23 Y 4.9233 7.9867 121.7266 55.8098 41.4171 172.6807 24 I 4.5333 7.9103 112.6099 59.1687 40.6970 175.1214 25 S 4.4505 8.3632 117.3253 58.1110 63.4881 175.7818 26 A 4.0487 8.6765 123.4109 54.7171 17.9452 180.3806 27 A 3.9488 7.8172 118.4865 55.5782 19.0292 179.1059 28 D 4.2052 7.9202 116.9756 57.0305 40.8419 178.4264 29 L 3.8564 7.4906 120.7525 58.4083 42.2422 178.9993 30 R 4.0587 7.6879 117.8247 59.9292 29.7104 177.8570 31 H 4.2676 7.9024 113.9653 57.7555 28.9415 176.8734 32 V 4.1008 8.2583 120.1054 64.5097 31.6850 177.2754 33 M 4.0682 7.7648 118.6514 58.8383 31.5051 178.4901 34 T 3.8385 7.9602 108.5695 64.7144 68.7174 174.8275 35 N 4.5994 8.4064 118.3304 53.8276 40.1128 175.4960 36 L 4.0909 6.8669 116.9464 56.2243 42.1442 177.6139 37 G 3.8512 8.9958 108.6724 46.0718 0.0000 174.3754 38 E 4.4970 8.3640 118.6930 55.6005 34.0816 175.1964 39 K 4.1853 8.4361 121.4823 55.7822 30.8820 176.3440 40 L 4.4736 7.9940 126.2229 53.4392 43.3606 177.0755 41 T 4.2858 8.2126 110.7685 61.1128 70.7554 175.1335 42 D 4.3983 8.6357 125.4852 57.3495 39.0242 178.5781 43 E 3.8706 8.4173 119.2603 59.6283 29.3761 179.0760 44 E 3.9710 8.2307 116.2601 59.9409 29.5685 179.8492 45 V 3.5609 8.1429 118.4843 66.7355 31.6166 177.0215 46 D 4.2277 8.3568 117.9860 56.6714 40.9334 177.3162 47 E 3.9291 8.1990 119.1183 59.9934 29.4881 179.0670 48 M 3.9289 8.1878 117.8057 58.3979 32.3098 177.9953 49 I 4.1910 7.1947 118.7598 63.1368 38.0010 177.9890 50 R 3.9118 8.2509 119.1284 59.4960 29.8944 177.6643 51 E 4.0475 7.7644 117.9664 59.6442 29.9049 177.0952 52 A 3.8152 8.2988 119.4504 54.9269 18.8183 176.5219 53 D 4.3810 7.8491 113.0006 53.2164 39.6376 176.5826 54 I 4.2658 7.3934 124.5967 59.8457 40.1497 176.1214 55 D 4.3802 8.6520 127.1227 53.0167 39.6257 172.8700 56 G 3.8433 8.4511 108.4934 46.4480 0.0000 173.7384 57 D 4.1620 9.6121 120.7766 53.0329 39.5573 173.3088 58 G 3.0839 5.3800 116.2885 44.9039 0.0000 172.7019 59 Q 4.7092 8.1124 125.8992 53.6201 33.2370 174.4116 60 V 4.2317 7.9977 124.3775 61.4245 33.4727 174.2890 61 N 4.5771 8.7268 127.1020 53.8466 39.4266 174.8391 62 Y 3.7566 8.9044 127.6599 60.9365 39.4065 177.7085 63 E 3.7223 8.2453 119.5892 59.0661 29.9575 177.9406 64 D 4.4007 8.0933 118.3332 57.5777 41.0030 178.9497 65 F 3.9791 8.6047 121.0764 61.5665 39.2509 177.0717 66 V 3.7743 7.5885 116.1124 66.4060 31.3549 177.8974 67 Q 4.0529 7.8482 116.8819 59.1531 28.9336 177.6300 68 M 3.7542 7.7995 119.5553 59.0462 31.7913 178.6448 69 M 3.8162 7.1666 116.9925 58.1172 32.6919 178.4902 70 T 4.5024 7.5441 111.5428 62.1776 67.9888 174.1789 71 A 4.4590 7.7444 121.6904 53.0953 21.2068 176.9971 72 K 4.1389 7.8658 117.5396 56.9876 32.9929 176.5777 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 6 E 8.30 4.35 0.00 2.08 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 2.29 2.44 0.00 7 E 8.25 3.83 0.00 2.16 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 2.45 2.50 0.00 8 E 9.22 3.91 0.00 2.02 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 0.00 2.43 2.45 0.00 9 I 7.49 3.64 2.15 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.74 1.28 0.00 0.00 10 R 8.51 4.75 0.00 2.36 2.61 0.00 2.96 0.00 0.00 3.30 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.75 0.00 11 E 8.14 3.98 0.00 2.16 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 0.00 2.31 2.37 0.00 12 A 7.78 4.07 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 13 F 7.58 4.56 0.00 3.33 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 14 R 7.60 4.31 0.00 2.01 2.00 0.00 3.34 0.00 0.00 2.99 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.56 0.00 15 V 7.10 3.69 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 0.77 0.00 0.00 1.01 0.00 0.00 16 F 7.58 4.27 0.00 3.11 3.04 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 17 D 8.59 4.57 0.00 2.73 2.56 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.86 4.19 0.00 1.69 1.74 0.00 1.83 0.00 0.00 1.68 0.00 0.00 3.05 0.00 0.00 2.76 0.00 0.00 0.00 0.00 1.28 1.46 7.81 19 D 9.31 4.85 0.00 2.64 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 20 G 7.63 4.37 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 0.00 21 N 8.05 5.12 0.00 2.56 2.67 0.00 0.00 6.70 7.96 0.00 0.00 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 G 7.94 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 23 Y 7.99 4.92 0.00 3.03 2.93 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 24 I 7.91 4.53 1.85 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.83 0.91 0.00 0.00 25 S 8.36 4.45 0.00 3.76 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 26 A 8.68 4.05 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 7.82 3.95 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 28 D 7.92 4.21 0.00 2.47 2.12 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 29 L 7.49 3.86 0.00 1.85 1.94 0.82 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 30 R 7.69 4.06 0.00 1.95 2.12 0.00 3.15 0.00 0.00 3.17 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.70 0.00 31 H 7.90 4.27 0.00 3.34 3.42 0.00 5.70 0.00 0.00 0.00 0.00 6.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 V 8.26 4.10 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 1.05 0.00 0.00 1.10 0.00 0.00 33 M 7.76 4.07 0.00 2.12 2.39 0.00 0.00 0.00 0.00 0.00 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.68 2.81 0.00 34 T 7.96 3.84 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 1.22 0.00 0.00 35 N 8.41 4.60 0.00 2.67 2.87 0.00 0.00 7.30 7.66 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 36 L 6.87 4.09 0.00 1.74 1.70 1.10 0.73 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 37 G 9.00 3.85 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 0.00 0.00 0.00 0.00 0.00 0.00 38 E 8.36 4.50 0.00 1.92 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 2.19 2.25 0.00 39 K 8.44 4.19 0.00 1.71 1.76 0.00 1.77 0.00 0.00 1.71 0.00 0.00 2.80 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.39 1.46 7.81 40 L 7.99 4.47 0.00 1.68 1.60 0.92 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 41 T 8.21 4.29 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 42 D 8.64 4.40 0.00 2.89 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 43 E 8.42 3.87 0.00 2.03 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 2.41 2.43 0.00 44 E 8.23 3.97 0.00 2.03 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 2.32 2.45 0.00 45 V 8.14 3.56 2.22 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 1.09 0.00 0.00 0.97 0.00 0.00 46 D 8.36 4.23 0.00 2.91 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 47 E 8.20 3.93 0.00 2.06 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 2.31 2.38 0.00 48 M 8.19 3.93 0.00 1.97 2.32 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 2.62 2.56 0.00 49 I 7.19 4.19 1.90 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 1.53 0.90 0.95 0.00 0.00 50 R 8.25 3.91 0.00 1.89 2.05 0.00 3.25 0.00 0.00 3.14 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.68 0.00 51 E 7.76 4.05 0.00 1.93 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 2.30 2.30 0.00 52 A 8.30 3.82 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 53 D 7.85 4.38 0.00 2.66 2.72 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 54 I 7.39 4.27 1.82 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 1.27 0.78 0.81 0.00 0.00 55 D 8.65 4.38 0.00 2.85 2.71 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 56 G 8.45 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 D 9.61 4.16 0.00 2.81 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 58 G 5.38 3.08 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 Q 8.11 4.71 0.00 1.66 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.92 0.00 0.00 0.00 0.00 0.00 2.47 2.39 0.00 60 V 8.00 4.23 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 1.12 0.00 0.00 1.00 0.00 0.00 61 N 8.73 4.58 0.00 2.85 2.86 0.00 0.00 6.96 7.79 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 62 Y 8.90 3.76 0.00 2.63 2.94 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 63 E 8.25 3.72 0.00 2.10 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 2.33 2.35 0.00 64 D 8.09 4.40 0.00 2.95 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 65 F 8.60 3.98 0.00 3.13 3.30 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 66 V 7.59 3.77 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 1.01 0.00 0.00 0.80 0.00 0.00 67 Q 7.85 4.05 0.00 2.21 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.51 0.00 0.00 0.00 0.00 0.00 2.41 2.41 0.00 68 M 7.80 3.75 0.00 1.82 1.94 0.00 0.00 0.00 0.00 0.00 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.54 0.00 69 M 7.17 3.82 0.00 1.89 2.00 0.00 0.00 0.00 0.00 0.00 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.39 1.91 0.00 70 T 7.54 4.50 4.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 71 A 7.74 4.46 1.25 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 0.00 0.00 0.00 72 K 7.87 4.14 0.00 1.84 1.76 0.00 1.57 0.00 0.00 1.70 0.00 0.00 2.82 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.31 1.38 7.81