NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 F 4.8561 8.3249 119.3332 57.4560 39.3373 173.4478 2 L 4.6293 7.8356 125.3202 52.2747 44.0509 176.4439 3 D 4.4602 8.9876 122.3884 57.4758 41.7762 178.8856 4 G 4.1299 8.3681 105.5091 47.5989 0.0000 175.2389 5 I 3.4536 7.8553 122.4029 64.4633 36.8422 177.8841 6 D 4.3503 8.3875 119.1138 57.2567 40.8012 178.4620 7 K 4.1060 7.9497 119.3996 59.4730 32.1579 178.5221 8 A 4.0046 7.7392 121.0554 55.1646 18.2253 179.5554 9 Q 3.9557 7.8604 116.3572 59.1187 28.5373 178.6584 10 E 4.0092 7.8346 119.5127 58.8441 29.9104 177.7958 11 E 4.5359 7.8277 116.3958 56.3223 29.8110 177.1621 12 C 4.1769 7.9378 121.4171 63.0509 31.2891 175.5505 13 E 4.0189 8.2236 118.3266 59.2882 29.1138 178.7826 14 K 4.0836 8.1195 119.2717 59.4898 32.6086 177.9107 15 Y 4.1873 8.0761 115.0204 58.4764 38.4157 176.1259 16 H 3.8298 8.5621 117.0288 57.5903 27.7437 176.5959 17 S 4.5968 8.8619 122.4412 60.5767 63.5229 174.8563 18 N 4.6510 8.1544 120.7748 51.9115 36.6232 175.6259 19 W 4.3646 8.0240 119.9110 59.1510 28.7529 178.6534 20 R 3.1418 6.4486 118.5026 58.7696 29.3708 178.5911 21 A 3.9213 7.3628 119.2092 55.2168 18.3560 179.3420 22 M 3.2336 7.7787 115.9918 58.5030 32.2456 178.0042 23 A 4.0906 8.3409 121.2506 55.5028 18.3094 179.8401 24 S 4.0696 7.7741 112.6577 61.7488 62.9312 176.3862 25 D 4.3912 7.9152 120.8446 56.8273 40.7135 177.9066 26 F 4.4029 8.2870 114.8797 56.1529 40.0074 175.2486 27 N 4.2429 8.1612 115.5693 54.5650 36.5132 173.9185 28 L 4.8306 7.6327 115.3663 51.9205 45.2204 175.3978 29 P 4.5386 0.0000 0.0000 61.8307 32.1715 175.5338 30 P 4.2213 0.0000 0.0000 65.7518 31.0706 178.9942 31 V 3.4656 7.6710 116.7115 66.0785 31.4623 178.0775 32 V 3.6140 7.6960 117.3053 65.6144 31.4477 177.7713 33 A 3.9734 7.8975 120.0509 55.2861 18.3211 179.5905 34 K 3.6110 7.9329 117.1151 59.4027 31.8411 179.1556 35 E 3.8843 7.9393 119.4706 59.3254 29.5044 178.9675 36 I 3.6853 7.9223 119.9736 64.3713 36.9274 178.6022 37 V 3.6030 7.4642 117.3530 65.8694 31.4841 177.7065 38 A 4.0921 8.1401 119.4886 54.3794 18.1730 178.8671 39 S 4.4179 7.3267 112.7589 59.2831 64.0883 174.8570 40 C 4.1901 7.6020 122.4378 59.6462 32.0855 174.1662 41 D 4.5442 8.7122 126.4362 56.9745 41.0785 178.9198 42 K 4.0646 8.0700 117.8106 59.5107 32.2301 177.9009 43 C 4.3316 7.9218 113.5228 61.1745 28.1895 174.4954 44 Q 4.0648 7.2554 120.1557 58.4217 29.1207 175.7610 45 L 4.3569 7.4389 118.4809 53.8962 42.8024 177.4990 46 K 4.1843 8.4864 119.9561 56.8631 32.0551 177.0867 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 F 8.32 4.86 0.00 3.14 3.08 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 0.00 0.00 0.00 0.00 2 L 7.84 4.63 0.00 1.81 1.61 0.97 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 3 D 8.99 4.46 0.00 2.72 2.75 0.00 0.00 0.00 0.00 0.00 0.00 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 8.37 4.13 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 0.00 0.00 0.00 5 I 7.86 3.45 1.94 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.32 0.85 0.00 0.00 6 D 8.39 4.35 0.00 2.74 2.74 0.00 0.00 0.00 0.00 0.00 0.00 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 K 7.95 4.11 0.00 1.91 2.11 0.00 1.93 0.00 0.00 2.07 0.00 0.00 3.04 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.67 1.61 7.81 8 A 7.74 4.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 7.86 3.96 0.00 2.27 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.11 6.73 0.00 0.00 0.00 0.00 0.00 2.36 2.49 0.00 10 E 7.83 4.01 0.00 2.07 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 0.00 2.35 2.38 0.00 11 E 7.83 4.54 0.00 2.35 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.43 0.00 12 C 7.94 4.18 0.00 3.12 3.07 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 0.00 0.00 0.00 0.00 13 E 8.22 4.02 0.00 2.00 2.00 0.00 0.00 0.00 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 2.38 0.00 14 K 8.12 4.08 0.00 1.64 1.54 0.00 1.68 0.00 0.00 1.44 0.00 0.00 2.93 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.05 1.33 7.81 15 Y 8.08 4.19 0.00 3.19 3.25 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 0.00 16 H 8.56 3.83 0.00 3.32 2.98 0.00 5.84 0.00 0.00 0.00 0.00 7.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 S 8.86 4.60 0.00 3.95 4.01 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 18 N 8.15 4.65 0.00 3.03 2.73 0.00 0.00 6.66 7.02 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 19 W 8.02 4.36 0.00 3.65 3.37 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 20 R 6.45 3.14 0.00 1.23 1.49 0.00 2.64 0.00 0.00 2.92 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.50 0.00 21 A 7.36 3.92 1.43 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 0.00 0.00 0.00 22 M 7.78 3.23 0.00 2.09 1.30 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.37 2.47 0.00 23 A 8.34 4.09 1.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 S 7.77 4.07 0.00 4.07 3.91 0.00 0.00 0.00 0.00 0.00 0.00 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 D 7.92 4.39 0.00 2.68 2.34 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 0.00 26 F 8.29 4.40 0.00 2.98 3.10 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 27 N 8.16 4.24 0.00 2.86 2.87 0.00 0.00 6.74 8.26 0.00 0.00 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 L 7.63 4.83 0.00 1.64 1.55 0.88 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 29 P 0.00 4.54 0.00 2.20 2.17 0.00 3.68 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.91 0.00 30 P 0.00 4.22 0.00 2.06 1.87 0.00 3.66 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.47 0.00 31 V 7.67 3.47 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 1.16 0.00 0.00 0.91 0.00 0.00 32 V 7.70 3.61 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.95 0.00 0.00 0.95 0.00 0.00 33 A 7.90 3.97 1.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 K 7.93 3.61 0.00 1.62 1.58 0.00 1.27 0.00 0.00 1.16 0.00 0.00 2.13 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.42 0.62 7.81 35 E 7.94 3.88 0.00 2.14 2.06 0.00 0.00 0.00 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 2.49 0.00 36 I 7.92 3.69 2.01 0.00 0.00 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.62 0.89 0.00 0.00 37 V 7.46 3.60 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.78 0.00 0.00 1.07 0.00 0.00 38 A 8.14 4.09 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 39 S 7.33 4.42 0.00 3.96 3.91 0.00 0.00 0.00 0.00 0.00 0.00 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 C 7.60 4.19 0.00 3.00 2.83 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 41 D 8.71 4.54 0.00 2.75 2.69 0.00 0.00 0.00 0.00 0.00 0.00 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 8.07 4.06 0.00 1.76 1.87 0.00 1.75 0.00 0.00 1.70 0.00 0.00 2.98 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.45 1.46 7.81 43 C 7.92 4.33 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 44 Q 7.26 4.06 0.00 2.22 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.11 7.11 0.00 0.00 0.00 0.00 0.00 2.36 2.37 0.00 45 L 7.44 4.36 0.00 1.81 1.58 0.92 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 46 K 8.49 4.18 0.00 1.76 1.73 0.00 1.79 0.00 0.00 1.76 0.00 0.00 3.04 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.46 1.45 7.81