NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 E 2.6666 8.4449 120.1656 56.0266 30.7784 174.6725 2 Q 4.2609 7.9295 117.0510 54.8245 30.9537 171.8345 3 C 4.7062 7.8655 110.8792 55.2947 42.0040 173.8311 4 G 3.8016 8.7231 108.1750 44.8815 0.0000 174.3950 5 R 4.2114 8.6172 115.1116 58.7918 29.5075 177.5570 6 Q 4.2094 7.9384 115.4494 56.8751 29.6482 175.6426 7 A 4.5213 7.1005 122.0522 51.2541 19.0922 176.8402 8 G 3.6758 9.0359 104.6459 47.1801 0.0000 174.8762 9 G 3.8826 8.6542 105.8452 45.1599 0.0000 174.8884 10 K 4.0541 7.6864 119.2596 56.2970 32.6081 176.5268 11 L 4.6332 8.0724 121.6645 53.8704 42.9001 177.6174 12 C 4.5308 8.3774 118.5522 56.1647 37.8299 172.1794 13 P 4.4835 0.0000 0.0000 62.7044 31.6714 175.3874 14 N 3.8609 9.3903 114.5412 54.8708 37.2178 173.7758 15 N 4.2696 8.4651 108.3378 53.6791 36.3622 174.6183 16 L 4.3063 7.5848 117.4092 54.7804 42.6563 176.4138 17 C 4.7347 8.8419 119.3077 57.1547 38.0960 171.9921 18 C 5.3519 9.0023 123.9885 54.9269 45.4691 173.6964 19 S 4.8292 9.4364 122.3358 57.7141 63.3622 175.2463 20 Q 3.8654 8.3886 118.4935 58.1940 28.0856 177.1931 21 W 4.8910 7.9553 116.5158 56.4724 29.7877 176.4771 22 G 3.8808 8.5983 107.4888 45.2411 0.0000 172.8598 23 W 5.2537 8.1398 117.7125 54.7056 32.9608 175.1154 24 C 5.2598 9.6916 121.3724 56.3348 40.4522 173.4675 25 G 2.9776 8.3471 109.1969 45.8979 0.0000 173.5985 26 S 4.6643 8.3257 113.3382 57.9457 64.8900 173.9977 27 T 4.5863 7.5740 111.5358 59.7655 71.1908 174.9789 28 D 4.4550 8.8454 120.9383 57.7791 40.4270 179.0834 29 E 3.7536 8.2172 115.7680 58.7234 29.5872 177.6410 30 Y 4.4159 8.1011 116.7647 59.1807 39.1634 176.1744 31 C 4.7683 8.1615 115.2878 56.2161 40.9620 173.4312 32 S 4.7783 7.7709 116.3645 56.6910 63.0192 173.2517 33 P 4.3502 0.0000 0.0000 65.5149 31.3639 178.4008 34 D 4.3582 7.8276 117.1267 56.8622 40.9578 176.7590 35 H 4.7369 8.1714 115.4371 54.9775 28.8939 174.5952 36 N 4.3379 7.9350 114.9123 53.7362 36.2952 174.1089 37 C 4.3031 7.3313 114.1730 57.4815 44.3417 173.2606 38 Q 4.1388 9.0569 125.6791 57.9537 29.2467 176.1485 39 S 4.5372 7.9111 109.3651 58.0726 65.3730 173.4404 40 N 4.2976 8.6757 115.6173 54.6275 35.9204 175.4226 41 C 4.7122 8.1229 113.0861 57.1534 41.7283 174.1543 42 K 4.7073 7.9909 120.7351 56.8928 34.7029 176.5771 43 D 4.2682 8.3899 120.4190 55.0542 38.3472 176.0665 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 1 E 8.44 2.67 0.00 1.63 1.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.47 0.00 2 Q 7.93 4.26 0.00 2.05 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.59 0.00 0.00 0.00 0.00 0.00 2.33 2.34 0.00 3 C 7.87 4.71 0.00 3.20 3.13 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 4 G 8.72 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 0.00 0.00 0.00 5 R 8.62 4.21 0.00 1.89 2.05 0.00 3.04 0.00 0.00 3.18 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.59 0.00 6 Q 7.94 4.21 0.00 1.93 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 7.53 0.00 0.00 0.00 0.00 0.00 2.42 2.44 0.00 7 A 7.10 4.52 1.17 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 8 G 9.04 3.68 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 0.00 0.00 0.00 9 G 8.65 3.88 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 0.00 0.00 0.00 10 K 7.69 4.05 0.00 1.88 1.72 0.00 1.64 0.00 0.00 1.63 0.00 0.00 2.91 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.44 1.63 7.81 11 L 8.07 4.63 0.00 1.63 1.58 0.96 0.92 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 12 C 8.38 4.53 0.00 3.14 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 13 P 0.00 4.48 0.00 2.18 1.97 0.00 3.75 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 2.12 2.07 0.00 14 N 9.39 3.86 0.00 2.79 2.82 0.00 0.00 7.01 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 15 N 8.47 4.27 0.00 2.89 2.88 0.00 0.00 7.18 7.85 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 16 L 7.58 4.31 0.00 1.55 1.70 0.89 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 17 C 8.84 4.73 0.00 3.12 3.20 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 18 C 9.00 5.35 0.00 3.02 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 19 S 9.44 4.83 0.00 3.94 4.16 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 0.00 0.00 0.00 0.00 20 Q 8.39 3.87 0.00 1.60 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.23 6.95 0.00 0.00 0.00 0.00 0.00 1.86 1.16 0.00 21 W 7.96 4.89 0.00 3.61 3.39 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 22 G 8.60 3.88 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 0.00 0.00 0.00 23 W 8.14 5.25 0.00 3.57 3.31 0.00 0.00 0.00 0.00 0.00 0.00 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 C 9.69 5.26 0.00 3.00 3.03 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 0.00 0.00 0.00 25 G 8.35 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 0.00 0.00 0.00 26 S 8.33 4.66 0.00 3.75 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 27 T 7.57 4.59 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 1.26 0.00 0.00 28 D 8.85 4.45 0.00 2.75 2.86 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 0.00 0.00 0.00 29 E 8.22 3.75 0.00 1.87 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 2.17 1.48 0.00 30 Y 8.10 4.42 0.00 3.09 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 31 C 8.16 4.77 0.00 3.09 3.15 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 32 S 7.77 4.78 0.00 3.96 3.87 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 33 P 0.00 4.35 0.00 2.20 2.07 0.00 3.65 0.00 0.00 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.11 0.00 34 D 7.83 4.36 0.00 2.55 2.62 0.00 0.00 0.00 0.00 0.00 0.00 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 H 8.17 4.74 0.00 3.28 3.21 0.00 5.77 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 N 7.93 4.34 0.00 2.80 2.75 0.00 0.00 6.78 7.00 0.00 0.00 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 C 7.33 4.30 0.00 3.11 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 38 Q 9.06 4.14 0.00 2.11 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.41 0.00 0.00 0.00 0.00 0.00 2.28 2.35 0.00 39 S 7.91 4.54 0.00 3.95 3.90 0.00 0.00 0.00 0.00 0.00 0.00 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 N 8.68 4.30 0.00 2.95 2.93 0.00 0.00 6.99 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 41 C 8.12 4.71 0.00 2.87 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 42 K 7.99 4.71 0.00 1.65 1.79 0.00 1.77 0.00 0.00 1.78 0.00 0.00 2.98 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.40 1.38 7.81 43 D 8.39 4.27 0.00 2.59 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