NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 11 T 4.1162 8.1744 115.2429 63.2349 68.6832 173.6373 12 I 3.0256 8.1625 122.5767 60.7628 35.8190 171.7478 13 T 4.3499 8.0829 116.0475 59.6347 71.7715 174.3348 14 P 4.2290 0.0000 0.0000 66.2136 31.2767 179.0105 15 S 4.2173 7.9779 111.8703 60.9236 62.9323 176.0482 16 L 3.7521 8.0845 124.8931 57.6072 41.7001 178.7324 17 K 4.1518 7.9688 119.4853 59.3882 32.2710 178.9248 18 G 3.6050 8.0954 106.1266 47.6496 0.0000 175.3414 19 F 4.1369 8.0984 122.9299 61.1775 39.2982 177.3193 20 F 4.4834 7.8357 117.3705 60.7923 38.6668 177.5374 21 I 3.7752 8.2033 119.7651 64.5126 36.9417 178.5265 22 G 3.8334 8.2289 106.1538 46.8025 0.0000 175.6875 23 L 3.8506 7.9658 122.8411 57.2127 41.9695 178.6832 24 L 4.0259 8.5448 121.1382 57.7130 42.0661 178.7710 25 S 4.3298 8.3740 114.1032 60.6110 62.7533 176.6954 26 G 3.4358 7.8619 109.3472 47.6034 0.0000 175.4611 27 A 3.9361 7.5392 124.2844 54.7330 18.2343 179.5270 28 V 3.4909 7.6560 116.5135 66.4250 31.6492 178.2674 29 V 3.5913 7.2864 117.1522 66.1521 31.2760 177.9153 30 L 4.1596 8.0291 118.7376 58.4488 41.3600 178.7859 31 G 3.7261 8.9146 105.8853 46.9147 0.0000 175.0500 32 L 3.8376 8.6297 120.4299 57.6130 42.0847 180.2276 33 T 3.8955 7.9077 114.7936 66.9287 68.4925 176.9251 34 F 3.9221 8.9793 119.5601 60.5938 38.8919 176.6656 35 A 4.1057 9.1520 122.1279 53.7763 17.9526 179.3580 36 V 3.5066 8.3285 114.6787 66.0518 31.8409 178.5893 37 L 3.8636 8.0251 118.2574 58.0630 41.2666 179.4279 38 I 3.5884 7.9293 119.1360 64.8029 37.3329 178.0280 39 A 4.0980 8.1675 121.5693 55.1235 18.1150 179.6521 40 I 3.6991 7.9297 118.1049 64.2282 37.0014 178.6030 41 S 4.2339 8.2915 115.5242 60.6089 63.8781 174.5548 42 Q 4.4831 7.5003 124.7165 53.5671 27.0409 175.4695 43 I 4.4589 6.4838 114.3863 60.9614 42.7706 174.8820 44 D 4.7230 6.9844 122.1592 52.3250 41.7440 176.6719 45 K 5.3467 8.5891 132.7390 57.4255 33.7884 174.7906 46 V 3.6778 7.7392 112.4507 62.9919 31.9529 176.2318 47 Q 4.1151 8.3486 120.1718 56.6956 28.1461 174.2198 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 11 T 8.17 4.12 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 1.23 0.00 0.00 12 I 8.16 3.03 1.95 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.60 0.95 0.00 0.00 13 T 8.08 4.35 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 1.19 0.00 0.00 14 P 0.00 4.23 0.00 2.17 2.17 0.00 3.58 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.18 0.00 15 S 7.98 4.22 0.00 4.01 4.10 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 0.00 0.00 0.00 16 L 8.08 3.75 0.00 1.53 1.92 0.73 -0.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 17 K 7.97 4.15 0.00 1.92 2.00 0.00 1.83 0.00 0.00 1.85 0.00 0.00 2.98 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.55 1.59 7.81 18 G 8.10 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 F 8.10 4.14 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 20 F 7.84 4.48 0.00 3.28 2.93 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 0.00 0.00 0.00 21 I 8.20 3.78 2.06 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.07 0.92 0.00 0.00 22 G 8.23 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 0.00 0.00 0.00 23 L 7.97 3.85 0.00 1.21 1.69 0.79 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 24 L 8.54 4.03 0.00 1.79 1.74 0.89 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 25 S 8.37 4.33 0.00 4.06 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 0.00 26 G 7.86 3.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 7.54 3.94 1.32 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 0.00 0.00 0.00 0.00 0.00 0.00 28 V 7.66 3.49 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.00 0.00 0.98 0.00 0.00 29 V 7.29 3.59 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 0.99 0.00 0.00 0.98 0.00 0.00 30 L 8.03 4.16 0.00 1.87 1.55 0.83 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 31 G 8.91 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.63 3.84 0.00 1.70 1.79 0.93 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 33 T 7.91 3.90 4.66 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 1.33 0.00 0.00 34 F 8.98 3.92 0.00 3.19 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 35 A 9.15 4.11 1.36 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 0.00 0.00 0.00 36 V 8.33 3.51 2.12 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 1.01 0.00 0.00 0.96 0.00 0.00 37 L 8.03 3.86 0.00 1.63 1.44 0.58 0.64 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 38 I 7.93 3.59 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 1.71 0.75 0.92 0.00 0.00 39 A 8.17 4.10 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 I 7.93 3.70 1.84 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.56 0.89 0.00 0.00 41 S 8.29 4.23 0.00 4.00 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 42 Q 7.50 4.48 0.00 2.22 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.53 6.68 0.00 0.00 0.00 0.00 0.00 2.32 2.31 0.00 43 I 6.48 4.46 2.05 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 1.46 0.61 0.90 0.00 0.00 44 D 6.98 4.72 0.00 2.64 2.63 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 0.00 0.00 0.00 0.00 45 K 8.59 5.35 0.00 1.93 1.93 0.00 1.76 0.00 0.00 1.70 0.00 0.00 2.87 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.15 1.14 7.81 46 V 7.74 3.68 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 0.74 0.00 0.00 0.93 0.00 0.00 47 Q 8.35 4.12 0.00 2.10 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.91 6.65 0.00 0.00 0.00 0.00 0.00 2.38 2.35 0.00