NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 5 S 4.4577 8.2929 117.0990 57.7190 64.0644 178.3299 6 E 4.0281 8.9892 124.0221 60.6485 29.1664 174.9716 7 E 4.1028 8.2715 118.0203 59.8698 30.2169 178.3030 8 V 3.6154 7.9961 120.2607 66.7815 31.6540 178.1598 9 E 4.0669 7.9992 119.6397 61.8592 29.4845 181.8196 10 R 4.1619 8.1123 121.4463 61.3785 29.4380 181.3247 11 K 4.2966 8.1293 119.9550 58.9181 32.0365 179.5831 12 L 4.0601 8.1568 120.3305 58.9209 40.4398 179.5833 13 K 4.0295 8.0958 119.6159 59.0183 31.9010 179.0110 14 E 3.9619 8.3919 119.7143 59.0126 29.4704 178.3925 15 F 4.1400 8.6312 121.2484 61.5306 39.3792 177.4050 16 V 3.2926 7.9328 117.6733 65.8128 31.3436 177.9509 17 R 3.8315 8.0642 118.5427 59.4104 29.9004 178.5386 18 R 3.8330 8.2983 118.9814 59.4508 30.0689 177.7375 19 H 3.7973 8.0539 118.3573 59.3765 29.6932 176.9974 20 Q 3.9377 8.1538 121.2295 59.0071 28.7821 177.7690 21 E 3.8837 8.2509 120.3789 59.2396 29.7313 178.6748 22 I 3.6392 8.0257 120.2478 64.7926 37.1079 178.4042 23 T 3.8156 7.8627 116.3157 66.6726 68.2808 176.4329 24 Q 3.9357 8.4059 121.6510 59.3781 29.1207 178.1694 25 E 4.0390 8.4725 119.9215 59.6475 29.3819 179.5788 26 T 3.9419 8.0724 115.8739 66.5070 68.5577 176.8997 27 L 4.0980 8.2293 121.2657 58.0258 41.5457 179.1440 28 H 4.2036 8.3291 118.1428 59.2178 29.7841 176.8201 29 E 4.1029 8.2821 122.5061 58.8206 29.4080 178.0347 30 Y 4.2325 8.4472 119.5767 60.9016 38.8064 177.9948 31 A 3.8247 8.1887 121.5554 55.1720 17.9402 179.6536 32 Q 3.8529 8.2220 116.6277 59.0340 28.8254 179.1786 33 K 3.9651 8.2305 119.7069 59.4696 32.0232 179.4759 34 L 3.9619 8.1705 119.8335 57.6391 41.3629 179.7933 35 G 3.5450 8.2989 106.0318 47.7442 0.0000 175.7951 36 L 3.9674 7.9245 121.3060 57.4587 41.6913 179.0232 37 N 4.2264 8.0622 117.0815 56.5747 38.9034 176.6434 38 Q 3.8602 8.2094 121.1117 59.3976 29.1126 178.1916 39 Q 3.9642 8.3024 118.9978 58.9336 28.7161 179.0157 40 A 3.9447 7.9140 121.5876 55.2974 18.5209 179.6193 41 I 3.5627 7.5578 116.9756 64.0892 38.0093 177.9372 42 E 3.8333 8.1416 119.6082 59.2834 29.2110 179.1089 43 Q 3.9928 8.5167 120.1829 58.8985 29.0915 177.8663 44 F 4.2317 8.3403 121.7884 61.4927 39.4550 177.1149 45 F 4.2543 8.1778 117.2654 60.5467 38.4386 177.8506 46 R 3.9349 7.9070 116.6941 59.3035 30.2539 178.4145 47 E 4.0494 8.2861 119.0392 59.2060 29.4295 178.5621 48 F 3.8857 8.0937 119.9043 61.3170 39.5209 176.7872 49 E 4.1209 8.3363 119.0161 59.2871 29.2401 178.2336 50 Q 4.2804 7.7583 125.1356 57.2798 28.4497 180.6175 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 5 S 8.29 4.46 0.00 3.67 2.89 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 6 E 8.99 4.03 0.00 2.05 1.99 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 2.31 1.99 0.00 7 E 8.27 4.10 0.00 2.03 1.97 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 2.38 2.37 0.00 8 V 8.00 3.62 2.22 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 0.96 0.00 0.00 0.92 0.00 0.00 9 E 8.00 4.07 0.00 2.04 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 2.25 2.21 0.00 10 R 8.11 4.16 0.00 1.81 1.97 0.00 3.23 0.00 0.00 3.17 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.54 0.00 11 K 8.13 4.30 0.00 1.92 1.90 0.00 1.67 0.00 0.00 1.73 0.00 0.00 3.00 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.58 1.59 7.81 12 L 8.16 4.06 0.00 1.88 2.06 0.97 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 13 K 8.10 4.03 0.00 1.96 1.92 0.00 1.68 0.00 0.00 1.59 0.00 0.00 2.90 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.48 1.56 7.81 14 E 8.39 3.96 0.00 2.20 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 0.00 2.34 2.40 0.00 15 F 8.63 4.14 0.00 3.16 3.33 0.00 0.00 0.00 0.00 0.00 0.00 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 V 7.93 3.29 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 0.00 0.00 1.11 0.00 0.00 17 R 8.06 3.83 0.00 2.04 2.02 0.00 3.14 0.00 0.00 3.09 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.62 0.00 18 R 8.30 3.83 0.00 1.97 1.94 0.00 3.19 0.00 0.00 3.08 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.61 0.00 19 H 8.05 3.80 0.00 2.70 3.14 0.00 5.64 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 Q 8.15 3.94 0.00 2.18 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.59 0.00 0.00 0.00 0.00 0.00 2.33 2.38 0.00 21 E 8.25 3.88 0.00 2.16 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 2.28 2.33 0.00 22 I 8.03 3.64 1.90 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.70 0.84 0.00 0.00 23 T 7.86 3.82 4.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 24 Q 8.41 3.94 0.00 2.26 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.81 0.00 0.00 0.00 0.00 0.00 2.34 2.44 0.00 25 E 8.47 4.04 0.00 2.11 1.99 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 2.34 2.45 0.00 26 T 8.07 3.94 4.25 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 1.16 0.00 0.00 27 L 8.23 4.10 0.00 2.00 1.78 0.95 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 28 H 8.33 4.20 0.00 3.31 3.48 0.00 5.61 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 E 8.28 4.10 0.00 2.09 2.15 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 2.36 2.20 0.00 30 Y 8.45 4.23 0.00 3.05 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 31 A 8.19 3.82 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 8.22 3.85 0.00 2.19 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.76 0.00 0.00 0.00 0.00 0.00 2.26 2.34 0.00 33 K 8.23 3.97 0.00 1.90 1.84 0.00 1.72 0.00 0.00 1.67 0.00 0.00 2.95 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.45 1.65 7.81 34 L 8.17 3.96 0.00 1.33 1.48 0.25 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 35 G 8.30 3.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 7.92 3.97 0.00 1.83 1.69 0.90 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 37 N 8.06 4.23 0.00 2.76 2.91 0.00 0.00 6.83 6.73 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 38 Q 8.21 3.86 0.00 2.19 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.54 0.00 0.00 0.00 0.00 0.00 2.31 2.46 0.00 39 Q 8.30 3.96 0.00 2.28 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.58 0.00 0.00 0.00 0.00 0.00 2.36 2.49 0.00 40 A 7.91 3.94 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 41 I 7.56 3.56 1.70 0.00 0.00 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 1.22 0.31 0.74 0.00 0.00 42 E 8.14 3.83 0.00 2.07 1.96 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 2.28 2.32 0.00 43 Q 8.52 3.99 0.00 2.19 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.79 0.00 0.00 0.00 0.00 0.00 2.39 2.46 0.00 44 F 8.34 4.23 0.00 3.23 3.22 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 45 F 8.18 4.25 0.00 3.17 2.92 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 46 R 7.91 3.93 0.00 1.98 2.01 0.00 3.18 0.00 0.00 3.17 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.86 0.00 47 E 8.29 4.05 0.00 2.06 2.21 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 2.31 2.36 0.00 48 F 8.09 3.89 0.00 2.26 2.68 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 0.00 0.00 0.00 0.00 49 E 8.34 4.12 0.00 2.22 1.99 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 2.34 2.34 0.00 50 Q 7.76 4.28 0.00 2.17 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.75 6.55 0.00 0.00 0.00 0.00 0.00 2.29 2.24 0.00