NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 21 S 4.4074 8.3193 115.2898 58.3631 63.8394 173.1493 22 T 4.5556 7.9213 116.5262 58.7350 72.9474 173.3325 23 A 4.1463 8.9243 124.3914 54.0789 18.9082 179.9810 24 A 4.4338 7.8633 118.0708 53.8501 19.6010 179.1931 25 G 3.6705 7.7250 103.0297 47.6815 0.0000 175.9077 26 Q 3.7764 8.0559 121.8402 58.5215 29.2550 176.8577 27 E 4.1809 8.0673 115.9302 56.8843 28.7668 176.8164 28 R 4.2893 7.5493 117.1781 58.2097 30.3468 177.4885 29 R 4.3605 7.8224 116.6230 57.9438 30.9679 177.8392 30 E 4.0595 7.8205 117.5207 58.0673 29.7432 178.1912 31 K 4.1288 7.9368 117.0387 57.2115 31.2582 178.1453 32 L 4.3133 7.4243 119.5150 56.5557 41.5902 177.8628 33 T 4.4668 7.3284 108.4715 61.3743 67.6188 175.5261 34 E 4.3608 7.5796 121.2712 57.6478 30.5186 176.6969 35 E 4.3048 7.6970 116.0266 57.6206 29.8536 178.3487 36 T 4.0807 7.4157 117.1104 66.4113 69.0350 176.4518 37 D 4.5337 7.9564 119.1642 56.6157 41.0454 178.2847 38 D 4.5328 7.6067 117.8933 56.4574 40.9207 178.0904 39 L 4.2098 7.4268 120.2758 57.4726 42.3084 178.6880 40 L 4.0009 8.5362 119.3291 57.1859 41.3001 178.4926 41 D 4.5522 7.5268 116.3379 55.8416 40.8837 177.7634 42 E 4.1871 7.7915 118.5976 58.2367 29.5412 178.5423 43 I 3.6888 7.8102 120.3731 64.5984 37.2025 177.3916 44 D 4.6910 7.7875 115.8941 55.1920 40.7798 177.3266 45 D 4.6584 7.5323 117.9706 54.9151 41.1615 177.5157 46 V 4.1270 7.4742 117.9516 63.9021 32.3653 176.7819 47 L 3.9838 7.6256 117.3022 55.8670 41.7645 177.6273 48 E 4.5082 8.1086 115.8571 56.5009 30.9257 176.6390 49 E 4.4149 8.0370 116.1591 56.6842 30.5503 176.1803 50 N 4.6226 7.5269 116.6463 53.8456 39.3345 174.2052 51 A 4.3197 7.7700 126.9752 53.0077 19.4363 176.6453 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 21 S 8.32 4.41 0.00 3.85 3.83 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 22 T 7.92 4.56 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 23 A 8.92 4.15 1.31 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 0.00 0.00 24 A 7.86 4.43 1.30 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 0.00 0.00 25 G 7.72 3.67 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 0.00 0.00 0.00 26 Q 8.06 3.78 0.00 2.23 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.89 6.75 0.00 0.00 0.00 0.00 0.00 2.35 2.29 0.00 27 E 8.07 4.18 0.00 1.96 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 2.26 2.29 0.00 28 R 7.55 4.29 0.00 2.05 1.89 0.00 3.13 0.00 0.00 3.17 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.65 0.00 29 R 7.82 4.36 0.00 1.89 1.95 0.00 3.17 0.00 0.00 3.34 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.87 0.00 30 E 7.82 4.06 0.00 2.15 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 2.51 0.00 31 K 7.94 4.13 0.00 1.79 1.83 0.00 1.76 0.00 0.00 1.82 0.00 0.00 2.92 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.48 1.51 7.81 32 L 7.42 4.31 0.00 1.77 1.70 0.92 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 33 T 7.33 4.47 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 34 E 7.58 4.36 0.00 2.35 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 2.22 2.36 0.00 35 E 7.70 4.30 0.00 2.17 1.96 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 2.30 2.44 0.00 36 T 7.42 4.08 4.29 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 1.21 0.00 0.00 37 D 7.96 4.53 0.00 2.72 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 38 D 7.61 4.53 0.00 2.66 2.70 0.00 0.00 0.00 0.00 0.00 0.00 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 L 7.43 4.21 0.00 1.96 1.80 0.92 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 40 L 8.54 4.00 0.00 1.68 1.70 0.92 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 41 D 7.53 4.55 0.00 2.71 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 42 E 7.79 4.19 0.00 2.10 1.93 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 2.28 2.34 0.00 43 I 7.81 3.69 2.00 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.56 0.95 0.00 0.00 44 D 7.79 4.69 0.00 2.70 2.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 D 7.53 4.66 0.00 2.79 2.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 V 7.47 4.13 2.08 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 1.10 0.00 0.00 0.95 0.00 0.00 47 L 7.63 3.98 0.00 1.62 1.70 0.92 0.85 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 48 E 8.11 4.51 0.00 2.10 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 2.31 2.33 0.00 49 E 8.04 4.41 0.00 2.13 2.10 0.00 0.00 0.00 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 2.34 0.00 50 N 7.53 4.62 0.00 2.69 2.87 0.00 0.00 6.97 7.84 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 51 A 7.77 4.32 1.22 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 0.00 0.00 0.00