NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 6 T 4.2878 8.1593 115.2419 61.2390 69.1908 173.2382 7 V 3.9453 7.3795 119.5460 59.7079 33.7917 174.6186 8 F 4.8009 7.9846 123.9542 57.0551 40.6941 177.2945 9 S 4.4305 9.2633 120.3428 57.9757 65.0209 175.3906 10 Q 3.9403 8.5898 123.0407 59.3543 28.8475 178.3728 11 A 3.9654 7.9318 121.2306 55.2555 18.4436 179.3610 12 Q 3.7780 7.7173 116.4598 59.0812 28.7058 179.1296 13 L 3.6587 7.8573 119.8063 57.8861 41.5941 179.2850 14 C 4.0326 8.0782 116.3380 62.8790 28.0503 176.1838 15 A 3.9434 7.7814 122.1815 54.9963 17.9556 179.7751 16 L 3.6530 7.6201 117.5640 57.7410 41.3816 179.9100 17 K 4.2312 8.1289 118.8462 59.2177 31.4416 179.0293 18 D 4.3301 8.4272 118.9878 57.4154 41.1886 178.3467 19 R 3.8202 7.8616 118.8732 59.3950 29.8981 178.1590 20 F 4.6657 8.1930 120.8993 60.8586 39.3829 176.8455 21 Q 3.9466 7.8377 116.8965 57.9651 28.5266 177.7763 22 K 4.5036 7.2277 118.2190 56.8601 32.9070 176.8698 23 Q 4.2989 8.3882 119.0811 54.5275 31.4109 175.5366 24 K 3.3642 8.4787 123.4935 57.8239 32.6863 176.8475 25 Y 4.5163 7.8206 115.8834 56.1332 39.6671 174.3168 26 L 4.8340 8.0109 124.8780 52.9293 43.8552 177.5691 27 S 4.4830 8.6668 117.0719 57.8329 65.2724 175.6070 28 L 4.1634 8.3668 122.0137 58.0258 41.3379 179.4850 29 Q 3.9913 8.0852 119.0296 59.4141 28.9876 178.3294 30 Q 4.1124 8.1790 119.0590 59.2131 28.7385 178.5638 31 M 4.0438 8.2413 119.8036 57.9706 31.9766 178.6709 32 Q 4.1194 8.4099 119.9978 59.1947 29.1970 177.8794 33 E 3.9278 8.3078 119.6796 59.5183 29.7033 179.1748 34 L 3.9703 8.1006 120.4707 58.2180 42.1586 179.1754 35 S 4.1843 8.3213 114.1252 61.2850 62.7102 176.8292 36 S 4.0712 8.0727 118.8346 61.6236 62.4072 176.0643 37 I 3.7077 7.2048 120.6553 64.9569 37.0611 178.1964 38 L 3.9822 7.7145 117.2664 54.9207 42.4577 176.2777 39 N 4.1524 7.7021 116.4347 54.8206 37.3281 172.9518 40 L 4.9646 7.7936 116.5893 51.9396 46.2058 178.0534 41 S 4.3990 8.3596 115.5674 58.5953 64.8341 174.9641 42 Y 4.1108 8.6410 124.1222 60.7797 38.6740 178.1887 43 K 3.8238 8.3488 120.1350 59.6110 32.2940 178.4828 44 Q 4.1110 8.7992 118.4425 59.1516 28.8028 178.9171 45 V 3.6932 7.8030 119.1400 65.9080 31.4251 177.8668 46 K 3.8225 8.3842 119.5852 59.9665 31.9911 178.9188 47 T 3.9372 8.4889 116.3457 66.2014 68.2484 176.3840 48 W 4.0750 8.5398 130.3603 60.6085 30.7123 178.0570 49 F 3.7820 8.4481 117.1366 60.3885 38.3742 177.3320 50 Q 3.9354 7.9998 118.8504 59.3576 28.6921 177.8226 51 N 4.1651 8.0960 116.4035 56.5559 38.7793 176.9209 52 Q 3.5817 7.4693 119.0111 58.9990 28.7344 179.3254 53 R 4.2776 8.2492 119.2106 59.7017 29.9255 178.8386 54 M 4.3242 8.0076 116.7390 57.4189 31.9342 178.3739 55 K 4.1014 7.7030 118.7779 57.4972 32.7133 176.9254 56 C 4.6736 6.9453 113.6950 57.2687 31.3929 174.3735 57 K 4.0843 8.4691 122.9236 59.6406 31.8257 178.8649 58 R 4.4190 7.6845 111.6703 56.3943 29.3390 176.4018 59 W 5.0452 8.0274 116.3187 56.9339 29.7962 175.6534 60 Q 5.0004 7.9086 123.4727 55.4452 28.4030 175.4735 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 T 8.16 4.29 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 1.18 0.00 0.00 7 V 7.38 3.95 1.98 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 0.77 0.00 0.00 0.86 0.00 0.00 8 F 7.98 4.80 0.00 3.00 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 9 S 9.26 4.43 0.00 4.03 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 10 Q 8.59 3.94 0.00 2.14 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.94 0.00 0.00 0.00 0.00 0.00 2.43 2.44 0.00 11 A 7.93 3.97 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 12 Q 7.72 3.78 0.00 2.16 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.75 0.00 0.00 0.00 0.00 0.00 2.23 2.33 0.00 13 L 7.86 3.66 0.00 1.84 1.70 1.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 14 C 8.08 4.03 0.00 3.10 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 15 A 7.78 3.94 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 16 L 7.62 3.65 0.00 0.56 0.13 -0.45 0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 17 K 8.13 4.23 0.00 1.98 1.91 0.00 1.75 0.00 0.00 1.63 0.00 0.00 3.01 0.00 0.00 3.22 0.00 0.00 0.00 0.00 1.61 1.67 7.81 18 D 8.43 4.33 0.00 2.92 2.79 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 19 R 7.86 3.82 0.00 2.03 2.12 0.00 3.25 0.00 0.00 3.14 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.86 0.00 20 F 8.19 4.67 0.00 3.16 3.21 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 7.84 3.95 0.00 2.18 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.62 0.00 0.00 0.00 0.00 0.00 2.39 2.73 0.00 22 K 7.23 4.50 0.00 1.69 1.84 0.00 1.69 0.00 0.00 1.70 0.00 0.00 3.17 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.41 1.61 7.81 23 Q 8.39 4.30 0.00 2.15 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.10 6.82 0.00 0.00 0.00 0.00 0.00 2.28 2.32 0.00 24 K 8.48 3.36 0.00 1.54 1.34 0.00 0.79 0.00 0.00 0.61 0.00 0.00 2.49 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.07 1.23 7.81 25 Y 7.82 4.52 0.00 2.93 2.85 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 26 L 8.01 4.83 0.00 1.14 1.36 0.74 0.51 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 27 S 8.67 4.48 0.00 4.07 4.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.37 4.16 0.00 1.76 1.88 0.98 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 29 Q 8.09 3.99 0.00 2.12 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.91 0.00 0.00 0.00 0.00 0.00 2.65 2.45 0.00 30 Q 8.18 4.11 0.00 2.36 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.59 0.00 0.00 0.00 0.00 0.00 2.36 2.39 0.00 31 M 8.24 4.04 0.00 1.99 2.15 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.27 0.00 32 Q 8.41 4.12 0.00 2.29 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.78 0.00 0.00 0.00 0.00 0.00 2.29 2.43 0.00 33 E 8.31 3.93 0.00 2.20 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 2.33 2.49 0.00 34 L 8.10 3.97 0.00 1.84 1.74 0.91 0.77 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 35 S 8.32 4.18 0.00 4.41 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 0.00 36 S 8.07 4.07 0.00 4.10 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 37 I 7.20 3.71 1.96 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 1.73 0.72 0.88 0.00 0.00 38 L 7.71 3.98 0.00 1.63 1.59 0.83 0.70 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 39 N 7.70 4.15 0.00 2.76 2.84 0.00 0.00 6.93 7.63 0.00 0.00 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 L 7.79 4.96 0.00 1.57 1.53 0.26 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 0.00 0.00 0.00 0.00 41 S 8.36 4.40 0.00 4.14 4.08 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 42 Y 8.64 4.11 0.00 3.01 2.96 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 0.00 0.00 0.00 0.00 43 K 8.35 3.82 0.00 2.00 1.89 0.00 1.85 0.00 0.00 1.89 0.00 0.00 2.99 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.57 1.61 7.81 44 Q 8.80 4.11 0.00 2.44 2.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.56 0.00 0.00 0.00 0.00 0.00 2.51 2.49 0.00 45 V 7.80 3.69 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 0.88 0.00 0.00 46 K 8.38 3.82 0.00 1.24 1.74 0.00 1.19 0.00 0.00 1.54 0.00 0.00 2.96 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.36 1.34 7.81 47 T 8.49 3.94 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 1.25 0.00 0.00 48 W 8.54 4.08 0.00 3.73 3.38 0.00 0.00 0.00 0.00 0.00 0.00 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 F 8.45 3.78 0.00 3.34 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 50 Q 8.00 3.94 0.00 2.12 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.73 0.00 0.00 0.00 0.00 0.00 2.36 2.43 0.00 51 N 8.10 4.17 0.00 2.54 2.67 0.00 0.00 7.17 7.30 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 52 Q 7.47 3.58 0.00 1.30 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.79 0.00 0.00 0.00 0.00 0.00 1.16 1.16 0.00 53 R 8.25 4.28 0.00 2.00 2.05 0.00 2.58 0.00 0.00 2.43 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.99 0.00 54 M 8.01 4.32 0.00 1.97 2.22 0.00 0.00 0.00 0.00 0.00 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.63 2.90 0.00 55 K 7.70 4.10 0.00 1.88 1.79 0.00 1.50 0.00 0.00 1.67 0.00 0.00 2.94 0.00 0.00 2.74 0.00 0.00 0.00 0.00 1.41 1.39 7.81 56 C 6.95 4.67 0.00 2.09 2.01 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 57 K 8.47 4.08 0.00 1.73 1.82 0.00 1.60 0.00 0.00 1.83 0.00 0.00 2.95 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.51 1.39 7.81 58 R 7.68 4.42 0.00 1.93 1.96 0.00 2.95 0.00 0.00 3.14 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 1.41 0.00 59 W 8.03 5.05 0.00 3.44 3.09 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 0.00 0.00 0.00 0.00 60 Q 7.91 5.00 0.00 2.16 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.09 6.55 0.00 0.00 0.00 0.00 0.00 2.42 2.54 0.00