NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.9779 8.2127 109.7435 45.2532 0.0000 174.0238 2 I 3.3682 7.9404 117.6505 62.9556 37.5384 172.8351 3 V 3.5298 8.3532 120.1519 66.0161 31.8248 177.3461 4 E 3.9769 8.1247 117.7837 59.0749 29.1282 178.8423 5 Q 4.1712 7.7580 117.3952 57.8276 29.1943 176.5972 6 C 4.6733 8.3698 116.2574 57.9051 41.4702 174.5986 7 C 4.2832 7.9054 119.8332 62.0137 31.8221 174.8529 8 T 3.8966 7.9348 114.7715 66.4244 68.2383 174.7146 9 S 4.6623 7.4722 113.7542 56.7409 64.4797 172.5993 10 I 4.5918 7.9818 113.3661 59.3391 39.5386 173.3487 11 C 5.1544 8.2696 114.9824 54.0055 39.1604 173.3688 12 S 4.8448 8.9522 115.5378 56.7359 64.5273 175.3482 13 L 4.0371 8.3916 120.5659 58.0720 41.0647 179.4758 14 Y 4.1031 7.7158 116.5558 61.1013 37.6788 178.3165 15 Q 4.1476 8.1652 118.4800 58.7064 28.6895 178.5938 16 L 4.3054 7.7558 118.6995 57.2495 41.5534 178.4170 17 E 4.1770 7.9784 118.3214 58.0356 29.4018 177.8189 18 N 4.4043 7.7391 115.3443 55.5447 38.6740 175.5529 19 Y 4.4931 7.2845 116.2557 57.0324 38.8034 175.1465 20 C 4.5237 7.1428 118.4893 58.8605 29.4067 173.5345 21 N 4.5415 8.6377 119.4753 53.6863 38.2174 175.1237 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 G 8.21 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 2 I 7.94 3.37 0.56 0.00 0.00 0.40 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 1.24 0.61 0.00 0.00 3 V 8.35 3.53 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 1.06 0.00 0.00 0.87 0.00 0.00 4 E 8.12 3.98 0.00 2.11 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 2.40 2.46 0.00 5 Q 7.76 4.17 0.00 2.04 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 6.79 0.00 0.00 0.00 0.00 0.00 2.41 2.64 0.00 6 C 8.37 4.67 0.00 3.02 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 7 C 7.91 4.28 0.00 2.90 3.14 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 0.00 0.00 0.00 8 T 7.93 3.90 4.43 0.00 0.00 0.00 0.00 0.00 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 9 S 7.47 4.66 0.00 3.84 4.02 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 10 I 7.98 4.59 1.89 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 1.48 0.83 0.92 0.00 0.00 11 C 8.27 5.15 0.00 3.20 3.28 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 12 S 8.95 4.84 0.00 4.19 4.12 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 13 L 8.39 4.04 0.00 1.51 1.60 0.85 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 14 Y 7.72 4.10 0.00 3.13 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 15 Q 8.17 4.15 0.00 2.38 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.81 0.00 0.00 0.00 0.00 0.00 2.44 2.49 0.00 16 L 7.76 4.31 0.00 2.00 1.78 0.93 0.77 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 E 7.98 4.18 0.00 2.07 1.94 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 2.30 2.33 0.00 18 N 7.74 4.40 0.00 2.22 2.46 0.00 0.00 6.90 7.32 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 19 Y 7.28 4.49 0.00 3.09 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 20 C 7.14 4.52 0.00 3.01 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 21 N 8.64 4.54 0.00 2.72 2.73 0.00 0.00 6.84 7.56 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