NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 A 4.3368 8.2649 123.5742 52.2094 19.7312 177.4046 3 K 4.2239 9.3784 115.8902 63.0126 34.0141 178.0317 4 H 3.6367 8.6596 117.2462 54.6698 33.6421 175.0209 5 P 4.4102 0.0000 0.0000 62.8293 31.9704 175.5662 6 V 4.5373 7.8262 120.3129 59.3703 34.1619 172.3202 7 P 4.3915 0.0000 0.0000 63.0225 31.6959 176.4226 8 K 4.3050 8.4473 119.1481 55.9474 32.3537 176.4995 9 K 4.2287 7.0639 118.3643 55.8598 35.0765 174.0855 10 K 4.1789 8.4765 122.0386 56.4039 32.8105 176.2285 11 T 4.4001 8.1574 115.0934 60.1316 70.3397 174.7531 12 S 4.2213 8.6081 120.4433 59.0104 62.8755 175.9198 13 K 4.1061 8.5507 121.5323 59.4615 31.7129 179.1772 14 S 3.9592 8.0248 113.9995 60.9237 62.4046 175.5601 15 K 3.8771 7.8950 121.4283 59.6170 31.9684 178.7333 16 R 3.9785 8.2045 117.7726 58.8091 29.7435 177.2267 17 D 4.6123 7.3636 118.3795 56.6318 41.4894 178.2498 18 M 3.8218 8.0970 118.6826 59.4415 32.2060 178.0476 19 R 3.8795 8.3895 118.8334 57.6668 30.0521 178.0528 20 R 3.5009 7.6262 118.8229 57.8424 30.7301 178.3973 21 S 4.5423 8.3723 112.9887 58.9642 62.8982 174.2801 22 H 4.9327 8.4957 115.2964 56.7250 31.1643 173.5279 23 H 4.6798 8.1691 115.2700 55.3576 28.8925 174.7916 24 A 4.0338 7.8343 123.5793 51.8710 18.1511 177.8533 25 L 4.1097 8.4931 123.1930 55.6686 42.3128 176.9176 26 T 4.4547 8.1152 109.7407 59.4661 70.2252 173.9523 27 A 4.0788 8.5946 130.1530 50.9820 18.9745 175.0417 28 P 4.2931 0.0000 0.0000 62.9533 32.2473 176.2743 29 N 4.7608 8.1478 119.2352 51.8025 37.5653 173.8231 30 L 4.4129 7.8265 120.9704 54.7035 42.3471 176.3670 31 T 4.7391 9.1638 118.5302 61.5938 72.9100 172.5896 32 E 4.4825 8.6722 125.2545 55.3350 30.4398 175.6973 33 C 4.1451 9.5796 129.0299 59.5552 32.2305 173.0744 34 P 4.2871 0.0000 0.0000 64.6043 32.1478 177.0704 35 Q 3.8441 7.7969 116.1961 56.0581 28.8206 176.1871 36 C 3.5998 8.6678 127.9968 61.4105 32.5577 173.6390 37 H 4.8631 7.6826 112.8716 55.9069 27.1431 174.8427 38 G 3.9741 7.7493 106.8943 45.4923 0.0000 173.6498 39 K 4.9785 8.5807 121.8574 56.0241 33.0665 176.3745 40 K 4.6643 10.1332 123.5634 54.9660 36.8824 174.3532 41 L 4.7346 8.1740 121.6215 53.3745 43.2011 175.3072 42 S 4.0941 8.5035 120.1532 60.4035 62.5577 174.0801 43 H 4.5207 9.3828 124.2919 55.8087 26.6578 173.9810 44 H 4.7586 7.9606 115.5281 53.4600 31.2126 173.7094 45 I 4.0458 7.7715 120.7323 61.0052 37.7816 175.7862 46 C 4.3002 8.6252 124.9172 58.4733 31.3430 172.6765 47 P 4.3407 0.0000 0.0000 65.5751 31.0141 177.4860 48 N 4.5463 8.1126 116.1985 55.9670 38.9710 176.0485 49 C 4.2272 8.0350 111.6540 59.0176 30.5561 174.6891 50 G 3.9576 8.7662 107.8734 45.5021 0.0000 172.5898 51 Y 4.8952 7.7087 117.3469 57.2702 40.0169 174.3058 52 Y 5.1284 8.7596 116.4641 57.4792 41.1333 172.2014 53 D 5.0559 9.6429 120.7311 54.2368 40.0740 175.1061 54 G 3.8599 7.3376 104.8232 44.3102 0.0000 169.9312 55 R 4.0514 7.7556 119.6104 54.5077 30.4262 175.6877 56 Q 4.1795 8.0446 126.1068 57.6969 29.8168 176.1388 57 V 3.7322 7.3341 118.9755 62.2992 32.5217 176.2883 58 L 3.8775 9.0807 126.2746 55.9896 42.1155 177.1223 59 A 4.2292 7.6473 123.7209 51.3649 18.4876 176.9199 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 2 A 8.26 4.34 0.95 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 0.00 0.00 3 K 9.38 4.22 0.00 1.82 1.84 0.00 1.64 0.00 0.00 1.67 0.00 0.00 2.99 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.40 1.55 7.81 4 H 8.66 3.64 0.00 3.19 2.91 0.00 5.74 0.00 0.00 0.00 0.00 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5 P 0.00 4.41 0.00 2.08 1.98 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 2.00 2.05 0.00 6 V 7.83 4.54 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 0.71 0.00 0.00 0.94 0.00 0.00 7 P 0.00 4.39 0.00 2.20 2.10 0.00 3.76 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.99 0.00 8 K 8.45 4.31 0.00 1.77 1.88 0.00 1.85 0.00 0.00 1.71 0.00 0.00 2.97 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.41 1.40 7.81 9 K 7.06 4.23 0.00 1.74 1.70 0.00 1.76 0.00 0.00 1.63 0.00 0.00 2.96 0.00 0.00 2.76 0.00 0.00 0.00 0.00 1.19 1.15 7.81 10 K 8.48 4.18 0.00 1.71 1.70 0.00 1.76 0.00 0.00 1.76 0.00 0.00 2.92 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.42 1.42 7.81 11 T 8.16 4.40 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 12 S 8.61 4.22 0.00 4.04 3.86 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 13 K 8.55 4.11 0.00 1.79 1.86 0.00 1.66 0.00 0.00 1.74 0.00 0.00 2.93 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.53 1.49 7.81 14 S 8.02 3.96 0.00 3.88 3.79 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 15 K 7.90 3.88 0.00 1.90 1.79 0.00 1.67 0.00 0.00 1.74 0.00 0.00 2.98 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.51 1.56 7.81 16 R 8.20 3.98 0.00 1.86 2.01 0.00 3.46 0.00 0.00 3.22 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.83 0.00 17 D 7.36 4.61 0.00 3.13 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 18 M 8.10 3.82 0.00 1.92 2.30 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.64 2.89 0.00 19 R 8.39 3.88 0.00 1.89 1.92 0.00 3.17 0.00 0.00 3.19 8.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.68 0.00 20 R 7.63 3.50 0.00 1.64 1.83 0.00 3.16 0.00 0.00 3.21 7.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.84 0.00 21 S 8.37 4.54 0.00 3.88 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 22 H 8.50 4.93 0.00 3.10 3.28 0.00 5.64 0.00 0.00 0.00 0.00 7.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 H 8.17 4.68 0.00 3.12 3.30 0.00 5.72 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 A 7.83 4.03 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.49 4.11 0.00 1.63 1.65 0.93 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 26 T 8.12 4.45 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 1.22 0.00 0.00 27 A 8.59 4.08 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 P 0.00 4.29 0.00 2.04 2.04 0.00 3.66 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.11 0.00 29 N 8.15 4.76 0.00 2.67 2.74 0.00 0.00 7.04 7.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 L 7.83 4.41 0.00 1.57 1.59 0.92 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 31 T 9.16 4.74 4.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 32 E 8.67 4.48 0.00 1.97 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 2.45 0.00 33 C 9.58 4.15 0.00 3.08 2.96 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 34 P 0.00 4.29 0.00 2.05 2.07 0.00 3.71 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.10 0.00 35 Q 7.80 3.84 0.00 1.72 1.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.87 6.81 0.00 0.00 0.00 0.00 0.00 2.22 1.76 0.00 36 C 8.67 3.60 0.00 2.87 2.90 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 37 H 7.68 4.86 0.00 3.29 3.29 0.00 5.66 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 G 7.75 3.97 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 0.00 0.00 0.00 39 K 8.58 4.98 0.00 1.66 1.77 0.00 1.69 0.00 0.00 1.76 0.00 0.00 2.97 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.45 1.44 7.81 40 K 10.13 4.66 0.00 1.82 1.94 0.00 1.37 0.00 0.00 1.66 0.00 0.00 2.81 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.43 1.36 7.81 41 L 8.17 4.73 0.00 1.69 1.36 0.88 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 42 S 8.50 4.09 0.00 3.90 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 43 H 9.38 4.52 0.00 3.46 3.72 0.00 5.72 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 44 H 7.96 4.76 0.00 3.00 3.16 0.00 5.67 0.00 0.00 0.00 0.00 6.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 I 7.77 4.05 1.82 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 1.19 0.17 1.00 0.00 0.00 46 C 8.63 4.30 0.00 3.03 2.93 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 47 P 0.00 4.34 0.00 2.23 2.19 0.00 3.83 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.00 0.00 48 N 8.11 4.55 0.00 2.75 2.91 0.00 0.00 6.94 7.66 0.00 0.00 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 C 8.04 4.23 0.00 3.10 3.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 G 8.77 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 51 Y 7.71 4.90 0.00 3.07 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 52 Y 8.76 5.13 0.00 2.77 3.05 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 53 D 9.64 5.06 0.00 2.70 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 54 G 7.34 3.86 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 0.00 0.00 0.00 55 R 7.76 4.05 0.00 0.67 1.38 0.00 3.65 0.00 0.00 3.47 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.68 0.00 56 Q 8.04 4.18 0.00 2.04 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.60 0.00 0.00 0.00 0.00 0.00 2.35 2.31 0.00 57 V 7.33 3.73 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 0.79 0.00 0.00 0.98 0.00 0.00 58 L 9.08 3.88 0.00 1.65 1.62 0.91 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 59 A 7.65 4.23 1.29 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