NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 G 3.9861 8.3549 109.7420 45.7719 0.0000 173.3914 4 E 4.5459 8.5066 116.2690 55.4323 30.9171 175.8911 5 R 4.1252 8.8866 121.0707 59.2090 31.5036 177.1698 6 T 4.0075 7.7682 113.8987 63.3689 69.3499 174.2925 7 V 4.3218 8.1203 125.4647 61.3612 33.8932 173.8077 8 Y 4.9497 8.5067 125.2020 56.2567 39.7365 175.3144 9 C 4.2944 9.1657 123.3961 59.7463 32.1906 173.7729 10 N 4.5638 8.6786 122.3605 54.9661 38.8906 176.4424 11 V 3.9045 7.8318 116.8679 64.6752 32.4183 176.1463 12 H 4.7672 7.6151 120.1607 52.8645 27.6756 174.8038 13 K 3.8613 8.1925 122.7070 59.7610 32.4025 178.0822 14 H 4.7482 8.1015 113.0561 55.1984 29.2247 173.3626 15 E 4.9102 8.5635 121.5217 54.1060 31.1259 173.9625 16 P 4.5422 0.0000 0.0000 62.2519 32.9089 176.3370 17 L 4.4377 8.5920 122.7402 54.8206 41.4646 177.0392 18 V 4.5126 8.5401 116.0307 60.7406 34.0780 175.1826 19 L 5.2216 8.1087 120.3569 52.6935 46.3139 175.2441 20 F 5.0433 8.8176 121.9445 56.6617 42.7150 173.1845 21 C 4.4710 8.6162 128.1739 58.7652 31.4995 173.9516 22 E 4.0171 9.0066 127.6802 59.5709 29.1135 179.1895 23 S 4.1826 8.2604 114.8797 60.9829 62.9967 174.6121 24 C 4.4627 7.8141 114.0981 58.6249 29.4840 172.9473 25 D 4.0050 7.7283 119.4640 55.0688 38.5964 173.4093 26 T 4.6950 5.9368 107.2847 59.7299 73.0220 174.8259 27 L 4.9088 8.5997 123.9832 55.1778 42.7196 176.2084 28 T 4.7942 8.9278 112.4303 60.3200 73.0861 172.3303 29 C 5.0115 8.2563 116.6758 56.4467 32.8413 174.7768 30 R 3.7723 8.6802 117.1503 59.7756 29.4743 178.9965 31 D 4.2513 7.8757 117.8093 57.3600 40.8353 178.4010 32 C 4.1247 7.8406 116.7590 62.9399 27.9936 175.8408 33 Q 3.7885 7.8173 119.8527 59.0965 28.6591 177.9173 34 L 4.1008 7.7320 118.8023 57.1023 42.1063 177.2834 35 N 4.4511 8.3725 116.1014 54.2910 38.5928 176.6141 36 A 3.9755 8.2149 129.9381 55.2159 19.5482 178.4143 37 H 4.4594 8.0735 112.3576 54.9479 29.2348 173.9985 38 K 3.7316 7.4076 120.2627 58.4781 32.0250 176.4050 39 D 4.5636 8.9280 123.6007 55.0668 38.6666 173.5238 40 H 4.7435 8.1334 116.6500 55.5169 29.9624 174.9576 41 Q 4.4692 8.8561 119.6087 56.0314 29.8674 175.0375 42 Y 5.3494 7.7368 119.8116 56.4870 41.4127 173.5242 43 Q 4.7217 8.8592 116.9112 54.2104 33.7704 175.0940 44 F 4.6243 9.0485 120.8568 57.1740 39.9916 176.4584 45 L 4.0161 9.1287 125.8131 58.1572 41.5119 178.9501 46 E 3.9615 8.1192 116.7786 57.4764 29.9307 176.0587 47 D 5.1142 8.2179 123.0289 54.6671 41.2589 174.0114 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 3 G 8.35 3.99 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 0.00 0.00 0.00 4 E 8.51 4.55 0.00 2.02 1.95 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 2.21 2.36 0.00 5 R 8.89 4.13 0.00 1.81 1.97 0.00 3.21 0.00 0.00 3.22 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.65 0.00 6 T 7.77 4.01 4.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.70 0.00 0.00 7 V 8.12 4.32 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 1.06 0.00 0.00 0.93 0.00 0.00 8 Y 8.51 4.95 0.00 2.98 3.06 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 0.00 0.00 0.00 9 C 9.17 4.29 0.00 2.94 3.14 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 N 8.68 4.56 0.00 2.76 2.86 0.00 0.00 6.85 7.68 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 11 V 7.83 3.90 1.91 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 0.57 0.00 0.00 0.89 0.00 0.00 12 H 7.62 4.77 0.00 3.31 3.25 0.00 5.91 0.00 0.00 0.00 0.00 6.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 K 8.19 3.86 0.00 1.63 1.90 0.00 1.35 0.00 0.00 1.62 0.00 0.00 2.99 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.34 1.29 7.81 14 H 8.10 4.75 0.00 3.17 3.33 0.00 5.69 0.00 0.00 0.00 0.00 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 15 E 8.56 4.91 0.00 2.12 1.92 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 2.32 2.55 0.00 16 P 0.00 4.54 0.00 1.91 1.67 0.00 3.84 0.00 0.00 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.01 0.00 17 L 8.59 4.44 0.00 1.49 1.69 0.93 0.76 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 18 V 8.54 4.51 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 0.00 0.00 1.08 0.00 0.00 19 L 8.11 5.22 0.00 1.51 1.27 0.58 -0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.69 0.00 0.00 0.00 0.00 0.00 0.00 20 F 8.82 5.04 0.00 3.09 2.91 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 21 C 8.62 4.47 0.00 2.73 2.49 0.00 0.00 0.00 0.00 0.00 0.00 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 E 9.01 4.02 0.00 2.03 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 2.52 2.40 0.00 23 S 8.26 4.18 0.00 3.74 3.76 0.00 0.00 0.00 0.00 0.00 0.00 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 C 7.81 4.46 0.00 2.86 2.91 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 7.73 4.00 0.00 2.80 2.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 T 5.94 4.69 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 1.19 0.00 0.00 27 L 8.60 4.91 0.00 1.62 1.70 0.99 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 28 T 8.93 4.79 4.07 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 0.93 0.00 0.00 29 C 8.26 5.01 0.00 3.13 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 30 R 8.68 3.77 0.00 1.85 2.01 0.00 3.19 0.00 0.00 3.44 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.79 0.00 31 D 7.88 4.25 0.00 2.14 2.32 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 32 C 7.84 4.12 0.00 3.15 2.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 Q 7.82 3.79 0.00 1.77 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 7.03 0.00 0.00 0.00 0.00 0.00 1.16 1.74 0.00 34 L 7.73 4.10 0.00 1.60 1.66 0.89 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 35 N 8.37 4.45 0.00 2.86 2.63 0.00 0.00 6.73 8.22 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 36 A 8.21 3.98 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 H 8.07 4.46 0.00 3.28 3.25 0.00 5.66 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 K 7.41 3.73 0.00 1.96 1.71 0.00 1.89 0.00 0.00 1.69 0.00 0.00 3.01 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.45 1.44 7.81 39 D 8.93 4.56 0.00 2.91 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 40 H 8.13 4.74 0.00 3.14 3.27 0.00 5.67 0.00 0.00 0.00 0.00 6.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 Q 8.86 4.47 0.00 1.99 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.12 6.55 0.00 0.00 0.00 0.00 0.00 2.36 2.43 0.00 42 Y 7.74 5.35 0.00 2.91 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 43 Q 8.86 4.72 0.00 2.10 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 7.03 0.00 0.00 0.00 0.00 0.00 2.27 2.63 0.00 44 F 9.05 4.62 0.00 3.17 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 45 L 9.13 4.02 0.00 1.65 1.78 0.95 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 46 E 8.12 3.96 0.00 1.94 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 2.34 0.00 47 D 8.22 5.11 0.00 2.89 2.86 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