NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 5 G 4.0081 8.3549 109.7334 45.3455 0.0000 176.4187 6 K 4.2485 8.9424 127.9940 56.2862 32.4683 173.0405 7 E 4.8286 9.4472 126.3246 55.8055 33.7113 174.7302 8 L 5.2951 8.7319 119.8573 53.3748 46.3819 176.2453 9 V 4.9540 8.5204 113.7562 59.6214 36.5121 174.2366 10 L 4.7616 8.8788 126.1712 54.1544 43.7052 175.3995 11 A 4.5903 8.9717 129.1972 51.8900 18.8428 178.0799 12 L 3.8339 9.0212 124.3460 57.4286 42.3078 176.9942 13 Y 4.7459 7.5241 112.9589 55.8085 42.2563 174.8871 14 D 4.8713 8.6777 120.7477 54.9598 42.1829 174.9734 15 Y 4.9972 8.9772 119.5237 56.5873 42.8100 173.0511 16 Q 4.6323 7.0896 125.2068 53.5169 31.6150 174.7388 17 E 4.3601 8.2893 124.6987 56.7992 30.1778 177.0469 18 K 4.6072 9.1163 119.1723 55.5838 33.5002 176.1639 19 S 4.5890 7.7060 111.3478 56.7186 65.6127 174.9623 20 P 4.3452 0.0000 0.0000 65.5243 31.3399 177.8530 21 R 4.2121 7.9795 115.6385 58.6747 30.0363 176.4418 22 E 4.9492 7.7263 116.5713 56.1567 30.3381 176.8593 23 V 4.7091 8.4998 114.1977 59.9228 35.7395 175.7128 24 T 4.6757 8.5789 119.3351 63.9227 69.5283 173.7629 25 M 4.9766 9.2087 121.0123 54.2938 35.5158 173.4628 26 K 5.1120 9.1246 118.2244 53.9614 36.0117 176.1470 27 K 4.1265 9.2308 125.1336 58.0962 32.5545 176.5933 28 G 4.0545 9.0827 114.7680 45.3405 0.0000 173.8054 29 D 4.3927 7.9581 119.9445 54.9679 41.9698 176.4333 30 I 4.5176 8.4064 124.2350 60.6946 37.0777 175.4776 31 L 4.4762 8.9242 127.9192 54.1665 44.0882 176.5787 32 T 4.5188 8.1233 118.3407 61.9155 69.7605 173.4333 33 L 4.3652 8.7441 130.2673 54.9772 42.8290 176.2554 34 L 4.2366 9.0274 128.3450 56.3097 43.8841 176.1963 35 N 4.9008 7.7983 119.0370 51.3921 41.1874 175.2189 36 S 2.9829 8.5270 119.6002 59.4097 63.8096 176.4772 37 T 3.8073 7.9108 111.0848 65.0617 68.0718 174.5016 38 N 4.5331 8.1782 116.6590 53.5212 39.2262 175.2798 39 K 4.7405 8.9633 124.3496 56.7737 32.7946 175.2807 40 D 4.3796 7.9174 114.4405 55.4548 43.3251 176.5441 41 W 4.8483 7.9962 123.8639 55.2995 28.9218 175.4160 42 W 4.9571 8.8330 125.2262 56.2865 30.2882 175.3663 43 K 4.6417 9.1011 125.6906 55.5624 33.2009 175.8329 44 V 4.9348 8.8135 119.7624 59.4692 36.5835 174.2361 45 E 4.8054 9.1328 125.1801 55.3916 30.7133 175.9457 46 V 4.2983 8.6683 127.0598 60.9907 33.7704 172.9816 47 N 4.3934 8.6684 123.9491 53.9652 38.6323 174.1996 48 D 4.7300 7.6083 113.5502 53.6399 41.8905 174.7865 49 R 4.5595 8.4228 120.1069 55.4320 33.9961 174.1797 50 Q 4.6855 8.8340 125.3269 54.5609 28.5549 174.6119 51 G 4.2260 8.9340 111.0293 43.9449 0.0000 168.9509 52 F 5.3734 9.0506 118.7204 56.9187 40.6957 175.9006 53 V 5.0743 9.3240 115.0398 58.7511 36.1617 173.2558 54 P 3.3546 0.0000 0.0000 62.1942 31.3003 177.4435 55 A 2.9322 8.1265 127.2081 54.4558 18.1582 178.7081 56 A 3.7203 7.2942 117.7109 55.4407 18.5065 178.4693 57 Y 5.0844 6.9765 112.0559 58.3470 38.3987 175.5377 58 V 5.0261 7.4073 110.9735 59.6242 36.2696 175.0144 59 K 4.5921 8.9547 123.2944 54.3273 35.4120 175.2648 60 K 4.2380 9.2090 126.6817 57.7081 31.9190 176.6868 61 L 4.3284 8.8578 126.5349 57.2608 42.6261 177.1788 62 D 4.1700 7.7889 122.4393 53.9438 38.7821 175.1137 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 G 8.35 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 6 K 8.94 4.25 0.00 1.81 1.72 0.00 1.70 0.00 0.00 1.68 0.00 0.00 2.92 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.41 1.50 7.81 7 E 9.45 4.83 0.00 1.96 1.84 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 2.12 2.15 0.00 8 L 8.73 5.30 0.00 1.76 1.50 0.97 0.87 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 9 V 8.52 4.95 2.23 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 0.93 0.00 0.00 1.06 0.00 0.00 10 L 8.88 4.76 0.00 1.69 1.54 0.89 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 11 A 8.97 4.59 1.41 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 0.00 0.00 0.00 12 L 9.02 3.83 0.00 1.54 1.30 1.02 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 13 Y 7.52 4.75 0.00 2.38 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 14 D 8.68 4.87 0.00 2.57 2.78 0.00 0.00 0.00 0.00 0.00 0.00 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 Y 8.98 5.00 0.00 3.40 3.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 16 Q 7.09 4.63 0.00 1.89 1.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.68 0.00 0.00 0.00 0.00 0.00 2.08 2.21 0.00 17 E 8.29 4.36 0.00 2.19 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 2.33 2.34 0.00 18 K 9.12 4.61 0.00 1.74 1.82 0.00 1.84 0.00 0.00 1.98 0.00 0.00 3.10 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.40 1.57 7.81 19 S 7.71 4.59 0.00 3.89 3.80 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 0.00 0.00 0.00 20 P 0.00 4.35 0.00 2.21 2.24 0.00 3.73 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.96 0.00 21 R 7.98 4.21 0.00 2.29 2.28 0.00 2.66 0.00 0.00 3.17 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.64 0.00 22 E 7.73 4.95 0.00 2.03 2.18 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 2.00 1.95 0.00 23 V 8.50 4.71 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.69 0.00 0.00 1.08 0.00 0.00 24 T 8.58 4.68 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 1.25 0.00 0.00 25 M 9.21 4.98 0.00 2.20 2.22 0.00 0.00 0.00 0.00 0.00 2.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.75 2.75 0.00 26 K 9.12 5.11 0.00 1.95 1.72 0.00 1.72 0.00 0.00 1.59 0.00 0.00 2.79 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.37 1.50 7.81 27 K 9.23 4.13 0.00 1.91 1.71 0.00 1.73 0.00 0.00 1.63 0.00 0.00 2.80 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.30 1.44 7.81 28 G 9.08 4.05 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 0.00 0.00 0.00 0.00 0.00 0.00 29 D 7.96 4.39 0.00 2.74 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 30 I 8.41 4.52 1.88 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 1.35 0.49 0.92 0.00 0.00 31 L 8.92 4.48 0.00 1.66 1.63 1.03 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 32 T 8.12 4.52 4.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 33 L 8.74 4.37 0.00 1.80 1.51 0.83 0.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 34 L 9.03 4.24 0.00 1.57 1.73 0.88 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 0.00 0.00 0.00 0.00 35 N 7.80 4.90 0.00 2.65 2.73 0.00 0.00 6.78 7.54 0.00 0.00 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 S 8.53 2.98 0.00 3.10 2.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 T 7.91 3.81 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 1.18 0.00 0.00 38 N 8.18 4.53 0.00 3.14 3.08 0.00 0.00 7.37 7.92 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 39 K 8.96 4.74 0.00 1.98 2.04 0.00 1.78 0.00 0.00 1.75 0.00 0.00 2.98 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.36 1.51 7.81 40 D 7.92 4.38 0.00 2.49 2.28 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 0.00 41 W 8.00 4.85 0.00 3.02 3.17 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 0.00 0.00 0.00 0.00 42 W 8.83 4.96 0.00 3.29 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 43 K 9.10 4.64 0.00 1.60 1.50 0.00 1.17 0.00 0.00 1.43 0.00 0.00 2.68 0.00 0.00 2.46 0.00 0.00 0.00 0.00 0.97 0.21 7.81 44 V 8.81 4.93 2.27 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 0.86 0.00 0.00 1.00 0.00 0.00 45 E 9.13 4.81 0.00 2.00 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 2.27 2.24 0.00 46 V 8.67 4.30 2.13 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 0.89 0.00 0.00 0.99 0.00 0.00 47 N 8.67 4.39 0.00 2.87 2.85 0.00 0.00 6.96 8.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 D 7.61 4.73 0.00 2.77 2.67 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.42 4.56 0.00 1.91 1.75 0.00 3.13 0.00 0.00 3.17 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.65 0.00 50 Q 8.83 4.69 0.00 1.89 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.16 6.56 0.00 0.00 0.00 0.00 0.00 2.26 2.37 0.00 51 G 8.93 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 52 F 9.05 5.37 0.00 3.05 3.25 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 53 V 9.32 5.07 2.23 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 1.13 0.00 0.00 1.13 0.00 0.00 54 P 0.00 3.35 0.00 1.00 0.76 0.00 3.32 0.00 0.00 2.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.78 0.00 55 A 8.13 2.93 -0.17 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 0.00 0.00 0.00 0.00 0.00 0.00 56 A 7.29 3.72 0.56 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 0.00 0.00 57 Y 6.98 5.08 0.00 3.04 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 58 V 7.41 5.03 2.23 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 0.86 0.00 0.00 0.83 0.00 0.00 59 K 8.95 4.59 0.00 1.83 1.62 0.00 1.58 0.00 0.00 1.70 0.00 0.00 2.97 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.34 1.47 7.81 60 K 9.21 4.24 0.00 1.76 1.83 0.00 1.87 0.00 0.00 1.49 0.00 0.00 2.67 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.71 1.57 7.81 61 L 8.86 4.33 0.00 1.67 1.73 0.94 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 62 D 7.79 4.17 0.00 2.75 2.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00