NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 V 4.4373 8.0393 113.9947 61.3396 33.5301 174.4995 2 K 4.2166 8.6367 121.0983 54.9693 35.3125 174.3829 3 D 4.6118 8.6807 122.8938 52.4263 43.3145 177.8917 4 G 3.0254 5.8737 107.6029 45.7725 0.0000 170.5310 5 Y 4.6789 7.3692 118.3996 56.0411 38.7971 175.5831 6 I 3.9495 7.7243 118.7377 61.3209 38.1074 175.2417 7 A 4.8083 8.4681 126.5736 50.3247 22.8172 173.9605 8 D 4.6891 8.0766 118.4617 51.7212 41.6131 176.7302 9 D 4.3616 8.4827 117.3081 56.9927 41.3785 176.9564 10 R 4.3265 8.4368 117.7776 55.4437 29.9796 175.8615 11 N 4.2761 7.8664 114.9015 54.9949 38.0150 173.0482 12 C 5.0017 7.7703 111.2376 53.5741 43.8300 172.7561 13 P 4.5461 0.0000 0.0000 62.6836 32.3094 176.0069 14 Y 4.4952 7.6421 113.5572 55.2357 37.9872 172.7723 15 F 4.7371 8.1284 119.3975 57.4706 39.4558 173.6507 16 C 5.0083 8.3391 119.5896 56.1605 43.8666 173.4326 17 G 4.5799 8.1006 105.1989 44.6368 0.0000 174.0799 18 R 4.6251 7.8495 119.3863 53.2678 33.2107 174.7240 19 N 4.3231 9.0629 122.6179 56.8358 38.8532 176.2614 20 A 4.0058 8.0585 121.2839 55.4076 18.6038 178.4086 21 Y 4.1901 8.2097 117.3266 61.5297 38.8080 179.1253 22 C 4.2439 8.5150 117.0564 60.1634 41.3836 175.2957 23 D 4.3905 8.4815 120.1276 57.3170 40.8063 178.3417 24 G 3.6457 8.4236 105.9490 47.7726 0.0000 174.7834 25 E 3.6804 7.9694 121.4588 59.2978 29.5514 178.1597 26 C 4.1741 8.1459 118.2751 59.4851 44.6985 175.6775 27 K 3.8860 8.1453 120.0860 59.5610 31.4996 179.5886 28 K 3.9933 8.2147 117.4457 58.9497 31.9442 178.1602 29 N 4.6015 7.6207 114.3585 52.3308 38.7839 174.9484 30 R 3.7058 7.9052 118.1574 57.4313 27.9691 175.7161 31 A 5.0975 7.7238 118.6898 49.6756 21.3173 177.6615 32 E 4.1178 8.9974 120.2359 58.3124 29.3937 176.4294 33 S 4.7004 7.8313 111.9743 57.5403 66.1222 172.5473 34 G 4.5117 8.4526 110.3004 45.5734 0.0000 171.0686 35 Y 5.0841 8.1982 116.4702 56.0354 41.7050 172.8845 36 C 5.3872 8.9956 118.9606 56.5036 42.5033 173.0770 37 Q 4.4371 9.5179 122.4704 54.3031 31.9759 174.8879 38 W 5.0149 8.6436 119.8170 58.5746 30.8389 175.9945 39 A 4.2795 8.3118 131.3896 53.4323 17.3353 176.2028 40 S 4.5968 8.0885 115.3942 58.8440 65.6220 176.9974 41 K 3.4871 9.0543 121.3991 58.6861 31.7070 175.8634 42 Y 4.4041 7.4034 115.0922 55.3421 38.9755 175.0685 43 G 3.6299 8.8521 114.6192 46.4958 0.0000 168.8752 44 N 4.5700 9.3390 130.0486 53.3077 37.0441 173.4293 45 A 5.2292 8.8223 123.2158 52.1096 23.5494 173.9204 46 C 5.2772 8.8815 119.3319 54.9203 46.5685 172.2344 47 W 4.2862 9.1261 135.0000 56.6895 31.7123 174.2909 48 C 5.1332 7.8554 123.8986 55.0919 44.5640 172.0415 49 Y 4.6220 8.8180 124.0673 56.8296 40.9941 173.7274 50 K 3.8057 8.4918 126.4044 56.5858 29.6374 173.9928 51 L 4.8625 8.2671 122.5441 51.4726 44.7313 174.9748 52 P 4.7289 0.0000 0.0000 62.2154 32.0792 176.9283 53 D 4.2585 8.4421 118.1050 57.0776 41.1848 176.7587 54 D 4.3930 8.0415 116.6730 55.4891 41.5699 175.9867 55 A 4.4910 7.4891 122.4655 50.4687 18.1023 175.9108 56 R 4.1971 7.8482 121.5355 55.3466 31.5341 175.3662 57 I 4.4165 7.6046 114.7531 58.9071 39.9925 174.8217 58 M 4.2968 8.4238 122.9904 55.9017 32.5716 175.2498 59 K 4.9298 8.8704 122.1675 53.9783 36.2530 174.1296 60 P 4.3434 0.0000 0.0000 61.9058 32.1331 176.2473 61 G 3.9808 9.7866 125.1983 46.5971 0.0000 172.0578 62 R 3.6195 7.2832 117.4641 56.7559 30.0134 176.3425 63 C 5.2225 8.3222 113.0097 55.7466 43.2867 174.3069 64 N 4.6462 8.9788 120.5633 53.2579 39.4214 174.7325 65 G 3.8557 8.4612 108.1845 45.0411 0.0000 174.3593 66 G 4.1273 8.5995 107.7337 45.6537 0.0000 173.4570 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 V 8.04 4.44 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 0.83 0.00 0.00 0.83 0.00 0.00 2 K 8.64 4.22 0.00 1.75 1.75 0.00 1.22 0.00 0.00 1.58 0.00 0.00 3.02 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.40 1.34 7.81 3 D 8.68 4.61 0.00 2.55 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 0.00 0.00 0.00 0.00 4 G 5.87 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 0.00 0.00 0.00 5 Y 7.37 4.68 0.00 2.70 2.44 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 6 I 7.72 3.95 1.91 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.71 0.78 0.00 0.00 7 A 8.47 4.81 1.12 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 0.00 0.00 0.00 0.00 0.00 0.00 8 D 8.08 4.69 0.00 2.75 2.36 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 9 D 8.48 4.36 0.00 2.63 2.73 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 10 R 8.44 4.33 0.00 2.06 1.84 0.00 3.35 0.00 0.00 3.08 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.60 0.00 11 N 7.87 4.28 0.00 2.79 2.83 0.00 0.00 7.12 7.33 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 12 C 7.77 5.00 0.00 3.04 2.77 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.55 0.00 1.60 1.67 0.00 3.52 0.00 0.00 3.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 1.77 0.00 14 Y 7.64 4.50 0.00 2.97 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 15 F 8.13 4.74 0.00 3.14 3.08 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 0.00 0.00 0.00 16 C 8.34 5.01 0.00 3.28 3.31 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 0.00 0.00 0.00 0.00 17 G 8.10 4.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 7.85 4.63 0.00 1.91 1.93 0.00 3.40 0.00 0.00 3.33 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.58 0.00 19 N 9.06 4.32 0.00 2.80 2.88 0.00 0.00 7.06 8.13 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 20 A 8.06 4.01 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Y 8.21 4.19 0.00 3.04 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 22 C 8.51 4.24 0.00 3.26 3.18 0.00 0.00 0.00 0.00 0.00 0.00 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 D 8.48 4.39 0.00 2.94 2.80 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.42 3.65 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 0.00 0.00 0.00 25 E 7.97 3.68 0.00 1.93 1.84 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 1.99 2.09 0.00 26 C 8.15 4.17 0.00 3.18 3.02 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 0.00 0.00 0.00 27 K 8.15 3.89 0.00 2.05 1.81 0.00 1.83 0.00 0.00 1.63 0.00 0.00 2.94 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.45 1.59 7.81 28 K 8.21 3.99 0.00 1.74 1.82 0.00 1.67 0.00 0.00 1.67 0.00 0.00 2.99 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.52 1.55 7.81 29 N 7.62 4.60 0.00 2.90 2.77 0.00 0.00 7.07 7.30 0.00 0.00 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 7.91 3.71 0.00 1.92 1.99 0.00 3.11 0.00 0.00 3.20 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.53 0.00 31 A 7.72 5.10 1.23 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 0.00 0.00 0.00 32 E 9.00 4.12 0.00 2.13 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 0.00 2.38 2.34 0.00 33 S 7.83 4.70 0.00 3.96 3.71 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.45 4.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 Y 8.20 5.08 0.00 3.05 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 36 C 9.00 5.39 0.00 3.06 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 37 Q 9.52 4.44 0.00 2.29 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.56 6.53 0.00 0.00 0.00 0.00 0.00 2.18 2.37 0.00 38 W 8.64 5.01 0.00 3.42 3.10 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.31 4.28 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 S 8.09 4.60 0.00 4.02 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 41 K 9.05 3.49 0.00 1.64 1.74 0.00 1.68 0.00 0.00 1.62 0.00 0.00 2.75 0.00 0.00 2.69 0.00 0.00 0.00 0.00 0.30 0.97 7.81 42 Y 7.40 4.40 0.00 2.53 2.61 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.85 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 N 9.34 4.57 0.00 3.32 3.30 0.00 0.00 6.61 8.80 0.00 0.00 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 A 8.82 5.23 0.65 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 0.00 0.00 46 C 8.88 5.28 0.00 3.14 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 47 W 9.13 4.29 0.00 2.38 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 48 C 7.86 5.13 0.00 2.55 2.63 0.00 0.00 0.00 0.00 0.00 0.00 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 Y 8.82 4.62 0.00 3.12 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 50 K 8.49 3.81 0.00 1.91 1.68 0.00 1.93 0.00 0.00 1.68 0.00 0.00 2.84 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.07 1.12 7.81 51 L 8.27 4.86 0.00 1.59 1.49 0.73 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.00 0.00 0.00 0.00 0.00 0.00 52 P 0.00 4.73 0.00 2.17 2.14 0.00 3.62 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.06 0.00 53 D 8.44 4.26 0.00 2.60 2.71 0.00 0.00 0.00 0.00 0.00 0.00 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 D 8.04 4.39 0.00 2.65 2.64 0.00 0.00 0.00 0.00 0.00 0.00 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 A 7.49 4.49 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 56 R 7.85 4.20 0.00 1.74 1.79 0.00 3.19 0.00 0.00 3.25 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.56 0.00 57 I 7.60 4.42 1.85 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.73 0.71 0.00 0.00 58 M 8.42 4.30 0.00 1.91 1.82 0.00 0.00 0.00 0.00 0.00 2.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.77 0.00 59 K 8.87 4.93 0.00 1.76 1.72 0.00 1.66 0.00 0.00 1.75 0.00 0.00 2.96 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.38 1.42 7.81 60 P 0.00 4.34 0.00 2.23 2.16 0.00 3.89 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.00 0.00 61 G 9.79 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 62 R 7.28 3.62 0.00 1.94 1.97 0.00 3.32 0.00 0.00 3.24 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.58 0.00 63 C 8.32 5.22 0.00 2.82 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 64 N 8.98 4.65 0.00 2.60 2.75 0.00 0.00 7.10 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 65 G 8.46 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 66 G 8.60 4.13 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 0.00 0.00 0.00 0.00 0.00 0.00