NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.8987 8.3549 109.7363 45.7587 0.0000 173.3076 2 S 4.5006 8.3348 123.4424 54.3377 62.6021 173.0202 3 S 4.6486 8.0024 125.2700 58.6181 64.2834 175.5275 4 G 3.9642 8.2371 106.0385 47.9847 0.0000 173.5509 5 S 4.4172 7.9477 123.1173 59.0827 63.8065 176.1128 6 S 4.4614 8.1383 118.0745 59.8737 63.6893 173.8816 7 G 3.5583 8.6381 115.4021 45.7877 0.0000 172.3273 8 T 3.8303 7.4191 107.7957 65.2483 68.0398 174.9860 9 G 4.0620 8.9188 114.2678 44.8015 0.0000 170.9859 10 E 4.7109 8.2576 116.0607 54.4425 32.2661 174.7157 11 N 5.0154 8.3278 118.3848 50.7452 42.7154 173.6153 12 P 3.9794 0.0000 0.0000 64.7514 31.7890 176.1644 13 Y 4.8229 7.1000 117.4134 55.6807 38.8849 172.3980 14 E 4.9597 8.4434 121.4042 53.6710 32.0166 173.6092 15 C 4.0185 9.5117 128.8323 59.8841 31.8815 173.8142 16 C 4.1119 8.8853 127.6619 62.2885 31.4590 174.4469 17 E 3.9764 7.9246 118.0863 59.2465 29.2999 177.4943 18 C 4.4725 7.8071 111.3073 60.1224 31.6571 174.3201 19 G 4.2900 7.7614 109.1004 46.0655 0.0000 173.9021 20 K 4.6219 8.1901 117.6100 54.3706 35.5161 177.4386 21 V 4.8738 8.3989 124.4888 62.1750 33.3831 174.1907 22 F 4.8322 9.0930 122.6707 56.5385 42.8573 174.9958 23 S 4.6555 9.1015 114.1351 60.3200 63.7476 175.2698 24 R 4.6105 7.4850 118.3768 53.7922 33.1205 176.2293 25 K 2.9624 7.3229 123.8157 59.7204 32.2428 177.6880 26 D 4.2212 7.8599 118.0385 57.9557 40.5336 179.0128 27 Q 4.0315 7.8600 117.7212 59.0987 29.1302 179.0878 28 L 2.4867 7.2277 120.4250 57.5609 42.2065 178.5818 29 V 3.4070 7.8026 118.6478 66.4516 31.1436 177.9954 30 S 4.1132 7.5413 110.1747 61.1193 62.2140 175.3646 31 H 4.4640 8.4319 121.3992 59.2318 29.8735 177.2344 32 Q 4.0921 7.8797 118.7977 58.2710 28.2485 178.5652 33 K 3.9254 7.7737 119.5065 59.0938 32.2367 177.4660 34 T 4.4447 7.4022 111.8475 62.5796 67.6411 173.5320 35 H 4.9492 7.6744 115.1731 52.6914 32.6241 173.3191 36 S 4.0181 7.8174 114.7526 58.0944 62.5349 174.1285 37 G 4.2352 8.2779 116.0629 44.0474 0.0000 172.1583 38 Q 3.9420 8.0711 118.2068 56.8899 27.7638 176.1483 39 S 4.2456 7.9719 114.4144 58.2029 64.6329 174.6450 40 G 3.9261 8.0879 116.1055 44.6435 0.0000 171.0623 41 P 4.3647 0.0000 0.0000 62.6569 29.4804 176.2221 42 S 4.4986 8.0959 120.8191 58.1007 64.5471 174.8913 43 S 4.2517 8.5395 115.7412 60.7195 63.2713 174.9648 44 G 4.0495 8.0162 112.0728 45.8048 0.0000 172.9850 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 G 8.35 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 S 8.33 4.50 0.00 3.92 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 3 S 8.00 4.65 0.00 3.91 3.87 0.00 0.00 0.00 0.00 0.00 0.00 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 8.24 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 S 7.95 4.42 0.00 3.99 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6 S 8.14 4.46 0.00 3.86 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 G 8.64 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 T 7.42 3.83 4.24 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 1.21 0.00 0.00 9 G 8.92 4.06 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 0.00 0.00 0.00 10 E 8.26 4.71 0.00 1.99 1.86 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 2.14 2.23 0.00 11 N 8.33 5.02 0.00 2.72 2.64 0.00 0.00 6.91 8.04 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 12 P 0.00 3.98 0.00 1.33 1.84 0.00 3.45 0.00 0.00 3.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.67 1.53 0.00 13 Y 7.10 4.82 0.00 2.86 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 14 E 8.44 4.96 0.00 1.98 1.88 0.00 0.00 0.00 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 2.32 0.00 15 C 9.51 4.02 0.00 3.18 3.21 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 16 C 8.89 4.11 0.00 2.98 2.94 0.00 0.00 0.00 0.00 0.00 0.00 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 E 7.92 3.98 0.00 1.64 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 2.13 0.00 18 C 7.81 4.47 0.00 3.13 3.15 0.00 0.00 0.00 0.00 0.00 0.00 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 G 7.76 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 0.00 0.00 0.00 0.00 20 K 8.19 4.62 0.00 1.82 1.63 0.00 1.70 0.00 0.00 1.75 0.00 0.00 2.81 0.00 0.00 2.69 0.00 0.00 0.00 0.00 1.37 1.44 7.81 21 V 8.40 4.87 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 0.99 0.00 0.00 22 F 9.09 4.83 0.00 2.88 2.98 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 23 S 9.10 4.66 0.00 3.94 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 24 R 7.48 4.61 0.00 1.79 1.88 0.00 3.19 0.00 0.00 3.28 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.62 0.00 25 K 7.32 2.96 0.00 1.18 1.49 0.00 1.47 0.00 0.00 1.82 0.00 0.00 3.15 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.39 1.41 7.81 26 D 7.86 4.22 0.00 2.66 2.65 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 7.86 4.03 0.00 2.35 2.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.23 6.96 0.00 0.00 0.00 0.00 0.00 2.45 2.64 0.00 28 L 7.23 2.49 0.00 1.21 1.46 0.66 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 0.00 0.00 0.00 0.00 29 V 7.80 3.41 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 0.83 0.00 0.00 0.86 0.00 0.00 30 S 7.54 4.11 0.00 3.88 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31 H 8.43 4.46 0.00 3.23 3.12 0.00 5.84 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 Q 7.88 4.09 0.00 2.07 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.64 0.00 0.00 0.00 0.00 0.00 2.40 2.48 0.00 33 K 7.77 3.93 0.00 1.92 1.86 0.00 1.67 0.00 0.00 1.61 0.00 0.00 2.95 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.45 1.64 7.81 34 T 7.40 4.44 4.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.00 0.00 35 H 7.67 4.95 0.00 3.24 3.35 0.00 5.75 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 36 S 7.82 4.02 0.00 3.82 3.95 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 37 G 8.28 4.24 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 0.00 38 Q 8.07 3.94 0.00 2.17 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 6.73 0.00 0.00 0.00 0.00 0.00 2.32 2.34 0.00 39 S 7.97 4.25 0.00 3.78 3.73 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.09 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 0.00 0.00 0.00 41 P 0.00 4.36 0.00 2.19 2.12 0.00 3.76 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.95 0.00 42 S 8.10 4.50 0.00 4.00 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 43 S 8.54 4.25 0.00 3.88 3.94 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.02 4.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00