NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 F 4.7956 8.3249 115.8115 55.4927 40.7961 177.0953 2 V 2.8287 7.4278 115.2207 61.4444 31.0782 169.9809 3 N 4.8783 8.4618 124.5520 53.8619 42.4503 173.5961 4 Q 4.0005 9.4322 119.3534 59.7596 28.9741 178.7713 5 H 4.2731 8.3845 115.7792 58.1225 30.0428 175.2047 6 L 4.7433 8.2649 117.0922 54.5935 44.0131 178.2086 7 C 4.2866 8.1832 118.4641 62.1583 31.6779 175.4471 8 G 4.4386 8.8394 108.9887 46.7786 0.0000 175.5666 9 S 4.1568 7.5602 114.9643 60.6715 62.8747 175.0839 10 H 5.0304 7.7350 120.0523 55.7993 29.7695 176.7447 11 L 4.1003 7.6755 120.8742 57.7772 41.5107 179.5797 12 V 3.5894 7.5442 112.0509 64.1698 30.9196 178.2997 13 E 4.3031 7.8067 117.0779 59.6113 29.3915 179.2190 14 A 3.7327 7.8554 119.9424 54.4325 18.2882 179.2798 15 L 3.5945 7.6703 117.9227 58.1471 41.7200 179.2306 16 Y 4.0339 7.7700 116.3138 58.8600 37.9333 177.3549 17 L 3.4880 6.5101 121.9603 57.7091 42.1409 178.6272 18 V 3.6215 7.2059 117.5581 66.0969 31.9215 177.5939 19 C 4.2608 7.7016 116.0645 61.4594 27.8270 174.6914 20 G 3.9830 8.7493 108.7358 45.9902 0.0000 173.5306 21 E 4.2612 8.4868 122.2844 56.3539 30.8918 176.5589 22 R 4.6090 7.5262 117.7453 54.6018 32.6837 174.9105 23 G 4.5924 7.7459 107.7806 46.2162 0.0000 172.2430 24 F 4.3881 8.0080 112.4339 56.2924 39.7324 172.7693 25 F 4.7026 7.6881 117.0638 55.1481 39.2893 174.3110 26 Y 4.7889 8.5025 126.4389 55.7203 40.6063 174.1262 27 T 4.4252 7.7836 117.0991 58.9364 69.8734 173.0069 28 P 4.3661 0.0000 0.0000 62.8822 30.4759 176.8100 29 K 4.4138 7.4673 118.6522 58.4620 34.8841 175.3985 30 T 4.1441 7.4815 117.8479 64.0211 69.7653 173.0938 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 4.80 0.00 3.10 3.29 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 0.00 2 V 7.43 2.83 2.13 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 0.50 0.00 0.00 1.00 0.00 0.00 3 N 8.46 4.88 0.00 2.78 2.73 0.00 0.00 6.64 7.19 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 4 Q 9.43 4.00 0.00 2.14 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.58 6.56 0.00 0.00 0.00 0.00 0.00 2.46 2.41 0.00 5 H 8.38 4.27 0.00 3.15 3.39 0.00 5.92 0.00 0.00 0.00 0.00 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6 L 8.26 4.74 0.00 1.74 1.67 0.95 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 7 C 8.18 4.29 0.00 3.07 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 8 G 8.84 4.44 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 9 S 7.56 4.16 0.00 4.02 3.93 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 10 H 7.73 5.03 0.00 3.16 3.37 0.00 5.63 0.00 0.00 0.00 0.00 6.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 L 7.68 4.10 0.00 1.81 1.76 1.05 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 12 V 7.54 3.59 2.17 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 0.15 0.00 0.00 0.81 0.00 0.00 13 E 7.81 4.30 0.00 2.27 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 0.00 2.43 2.57 0.00 14 A 7.86 3.73 1.24 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 0.00 0.00 0.00 15 L 7.67 3.59 0.00 1.41 0.32 1.05 0.35 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 16 Y 7.77 4.03 0.00 3.31 3.32 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 17 L 6.51 3.49 0.00 1.28 1.68 0.69 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 18 V 7.21 3.62 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 0.90 0.00 0.00 0.88 0.00 0.00 19 C 7.70 4.26 0.00 3.20 2.99 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 0.00 0.00 0.00 20 G 8.75 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.49 4.26 0.00 1.98 2.02 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 0.00 2.28 2.27 0.00 22 R 7.53 4.61 0.00 1.86 1.90 0.00 3.12 0.00 0.00 3.24 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.78 0.00 23 G 7.75 4.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.01 4.39 0.00 2.90 2.81 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 25 F 7.69 4.70 0.00 3.08 3.09 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 0.00 0.00 0.00 26 Y 8.50 4.79 0.00 3.05 2.79 0.00 0.00 0.00 0.00 0.00 0.00 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 7.78 4.43 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 1.17 0.00 0.00 28 P 0.00 4.37 0.00 2.21 2.16 0.00 3.52 0.00 0.00 3.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 2.00 0.00 29 K 7.47 4.41 0.00 1.63 1.77 0.00 1.77 0.00 0.00 1.67 0.00 0.00 2.95 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.28 1.38 7.81 30 T 7.48 4.14 4.23 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 1.21 0.00 0.00