NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 F 4.9060 8.3244 115.8811 56.3553 39.9596 175.2800 2 V 3.2748 7.1468 120.7236 64.2572 32.0436 174.8152 3 N 4.5974 7.4122 118.8768 50.3149 37.7481 172.4013 4 Q 4.3730 7.0357 117.1564 55.6036 31.4493 173.8688 5 H 4.3695 8.7272 115.7558 55.4459 28.7754 175.0946 6 L 4.7297 8.5126 124.9064 53.1326 43.6179 175.7192 7 C 4.9623 8.1502 120.7391 58.5902 32.9737 175.3477 8 G 3.8079 8.4468 110.8732 46.5150 0.0000 177.4532 9 S 4.1281 8.6367 117.6880 61.2195 63.1096 176.3040 10 H 4.2618 8.2569 118.4564 58.5193 28.2831 177.4803 11 L 3.9266 7.7819 121.8427 58.0503 42.0861 178.8844 12 V 3.2362 7.4844 118.2071 65.9276 31.3678 177.9078 13 E 4.0202 8.2679 118.1707 59.1522 29.2031 179.1290 14 A 4.2786 7.8143 120.8843 55.2983 18.4013 179.6785 15 L 3.6481 7.6167 117.5082 57.7854 41.3405 179.1356 16 Y 4.2950 7.6525 119.4306 60.8281 38.5639 178.2648 17 L 3.7914 7.8540 118.5894 57.5674 41.8139 179.4557 18 V 3.7593 7.9264 117.5318 66.3740 31.9999 177.7856 19 C 4.3123 8.5696 116.6645 60.7487 28.4631 175.0642 20 G 3.6171 8.2873 109.9283 46.5963 0.0000 176.2041 21 E 4.2141 8.7876 122.4449 58.1608 29.6255 178.1337 22 R 3.9185 7.7758 117.9112 57.0689 30.2873 177.6309 23 G 3.9151 9.4978 104.5302 45.2696 0.0000 171.2170 24 F 4.8876 7.4204 112.3958 56.0720 40.1882 172.8934 25 F 4.9921 8.4009 115.0234 55.0340 40.1005 173.5978 26 Y 4.7920 9.0072 124.6696 56.2991 39.9741 175.1866 27 T 4.3407 8.0255 124.0013 60.7729 69.8814 171.9599 28 P 4.0908 0.0000 0.0000 64.8973 31.6276 178.0541 29 K 4.2526 7.6125 118.4044 54.5510 30.7273 176.3484 30 A 4.3296 7.9392 124.5422 51.9408 19.1918 176.9768 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 4.91 0.00 3.18 3.17 0.00 0.00 0.00 0.00 0.00 0.00 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 V 7.15 3.27 1.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.57 0.00 0.00 -0.03 0.00 0.00 3 N 7.41 4.60 0.00 2.69 2.71 0.00 0.00 6.73 7.69 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 4 Q 7.04 4.37 0.00 2.10 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.75 6.99 0.00 0.00 0.00 0.00 0.00 2.16 2.33 0.00 5 H 8.73 4.37 0.00 3.19 3.29 0.00 5.64 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6 L 8.51 4.73 0.00 1.59 1.59 0.90 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 7 C 8.15 4.96 0.00 2.89 2.77 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.45 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 S 8.64 4.13 0.00 4.01 4.14 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 10 H 8.26 4.26 0.00 3.37 3.39 0.00 5.63 0.00 0.00 0.00 0.00 6.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 L 7.78 3.93 0.00 1.81 1.77 0.90 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 12 V 7.48 3.24 2.01 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 0.96 0.00 0.00 0.24 0.00 0.00 13 E 8.27 4.02 0.00 2.22 2.01 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 2.29 2.57 0.00 14 A 7.81 4.28 1.34 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 0.00 0.00 15 L 7.62 3.65 0.00 0.88 0.21 0.69 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 16 Y 7.65 4.30 0.00 3.24 3.19 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 0.00 0.00 0.00 0.00 17 L 7.85 3.79 0.00 1.98 1.73 0.67 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 18 V 7.93 3.76 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 0.78 0.00 0.00 0.90 0.00 0.00 19 C 8.57 4.31 0.00 3.26 3.23 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 0.00 0.00 0.00 0.00 20 G 8.29 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.79 4.21 0.00 1.97 2.03 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 2.30 2.28 0.00 22 R 7.78 3.92 0.00 2.10 2.05 0.00 3.23 0.00 0.00 3.25 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.60 0.00 23 G 9.50 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 F 7.42 4.89 0.00 3.01 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 25 F 8.40 4.99 0.00 3.17 3.04 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 0.00 0.00 0.00 26 Y 9.01 4.79 0.00 3.14 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 27 T 8.03 4.34 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 1.24 0.00 0.00 28 P 0.00 4.09 0.00 1.92 1.99 0.00 3.45 0.00 0.00 3.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 1.15 0.00 29 K 7.61 4.25 0.00 1.71 1.74 0.00 1.71 0.00 0.00 1.69 0.00 0.00 2.97 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.34 1.34 7.81 30 A 7.94 4.33 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