NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 11 T 4.1126 8.1744 115.2430 63.1917 68.7020 173.6184 12 I 3.0250 8.1574 122.5319 60.7621 35.8099 171.7575 13 T 4.3455 8.0601 116.1187 59.6627 71.7331 174.3116 14 P 4.2281 0.0000 0.0000 66.1852 31.2283 179.0172 15 S 4.2212 7.9722 111.9224 60.9260 62.9486 176.0715 16 L 3.7624 8.0636 124.8563 57.6339 41.7241 178.7426 17 K 4.1497 7.9750 119.4895 59.3808 32.2926 178.9343 18 G 3.6105 8.1276 106.1707 47.6046 0.0000 175.3597 19 F 4.1412 8.1557 122.9866 61.1802 39.3125 177.2986 20 F 4.4659 7.8130 117.2083 60.8161 38.6726 177.5152 21 I 3.7759 8.1541 119.6735 64.5338 36.9266 178.5029 22 G 3.8628 8.1715 106.0581 46.7568 0.0000 175.6600 23 L 3.8635 7.9645 122.7854 57.1564 41.9743 178.6223 24 L 4.0512 8.5256 121.1037 57.6457 41.8954 178.7085 25 S 4.3367 8.2569 114.0288 60.5444 62.7682 176.6705 26 G 3.3844 7.8518 109.3798 47.5529 0.0000 175.4651 27 A 3.9256 7.5054 124.1518 54.7723 18.2634 179.5020 28 V 3.5455 7.6348 116.5390 66.4833 31.6338 178.3150 29 V 3.6052 7.2886 117.1706 66.0992 31.2407 177.9404 30 L 4.1597 8.0337 118.8179 58.4075 41.3544 178.7699 31 G 3.7214 9.0090 106.1790 47.0099 0.0000 175.0608 32 L 3.8056 8.7081 120.4660 57.6141 42.0276 180.2015 33 T 3.8929 7.9099 114.7922 66.9403 68.5156 176.9140 34 F 3.8748 8.9359 119.5467 60.6266 38.8889 176.7112 35 A 4.0879 9.1706 122.1383 53.9741 18.0056 179.3278 36 V 3.5132 8.3664 114.7576 66.0336 31.8185 178.6595 37 L 3.8650 8.0849 118.3693 58.0509 41.2753 179.4189 38 I 3.5994 7.9141 118.8517 64.6899 37.4451 178.1016 39 A 4.0933 8.1480 121.4517 55.2587 18.1315 179.7618 40 I 3.7122 7.8243 117.6974 64.1683 36.9692 178.6233 41 S 4.2312 8.2604 115.5984 60.5981 63.9020 174.5540 42 Q 4.4867 7.4207 124.4085 53.5743 27.0542 175.4793 43 I 4.4574 6.4772 114.3737 60.9875 42.7932 174.8987 44 D 4.7170 6.9778 122.0462 52.3181 41.7435 176.6728 45 K 5.3507 8.5859 132.7717 57.4304 33.8064 174.8017 46 V 3.6808 7.7435 112.4576 63.0062 31.9575 176.2397 47 Q 4.1139 8.3465 120.1550 56.6932 28.1538 174.2275 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 4.11 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 8.06 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 2.17 0.00 15 S 7.97 4.22 0.00 4.02 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 8.06 3.76 0.00 1.54 1.92 0.66 -0.29 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 1.99 0.00 1.82 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 8.13 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.16 4.14 0.00 3.09 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 7.81 4.47 0.00 3.27 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 8.15 3.78 2.07 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 1.04 0.92 0.00 0.00 22 G 8.17 3.86 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 0.00 0.00 0.00 23 L 7.96 3.86 0.00 1.22 1.68 0.80 0.48 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 8.53 4.05 0.00 1.78 1.74 0.89 1.08 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 25 S 8.26 4.34 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 7.85 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 0.00 0.00 0.00 27 A 7.51 3.93 1.28 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 0.00 0.00 28 V 7.63 3.55 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 1.06 0.00 0.00 0.95 0.00 0.00 29 V 7.29 3.61 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 0.99 0.00 0.00 30 L 8.03 4.16 0.00 1.89 1.55 0.83 0.86 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 9.01 3.72 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 0.00 0.00 0.00 32 L 8.71 3.81 0.00 1.69 1.79 0.93 0.68 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 3.89 4.67 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 1.35 0.00 0.00 34 F 8.94 3.87 0.00 3.21 3.16 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 35 A 9.17 4.09 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.37 3.51 2.24 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 1.01 0.00 0.00 0.96 0.00 0.00 37 L 8.08 3.86 0.00 1.60 1.44 0.56 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 38 I 7.91 3.60 1.89 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 1.71 0.75 0.92 0.00 0.00 39 A 8.15 4.09 1.38 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 0.00 0.00 40 I 7.82 3.71 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 8.26 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 7.42 4.49 0.00 2.24 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 2.04 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 2.61 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 1.61 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 4.11 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