NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 A 4.2712 8.2649 123.5819 51.2106 20.6740 176.2795 3 K 4.3140 7.5687 113.7544 54.9699 35.9195 177.0766 4 H 4.3441 8.7958 113.1565 54.6139 31.9467 175.1585 5 P 4.0821 0.0000 0.0000 62.6858 30.9929 175.3106 6 V 4.5307 8.0194 122.2446 58.9632 34.3328 172.9184 7 P 4.3386 0.0000 0.0000 62.9081 31.6647 176.3789 8 K 4.1696 8.5895 122.4352 58.4446 32.6659 177.1564 9 K 4.4266 7.7443 116.9157 54.3497 35.9175 174.7096 10 K 3.7035 8.9196 125.0643 56.6173 31.9997 176.1504 11 T 3.9017 8.4747 117.4069 61.5187 69.2161 174.4253 12 S 4.3328 8.5031 120.4025 57.8638 63.6786 174.9902 13 K 4.1110 8.5898 117.6250 57.6411 31.8053 177.8080 14 A 4.4865 7.8646 121.4447 54.0957 20.0479 179.3634 15 R 4.0150 7.4384 113.9450 58.6700 30.4297 178.0146 16 R 4.1204 7.8429 118.5554 59.3029 30.1955 177.2742 17 D 4.4288 7.9267 118.5811 56.1414 41.2313 177.3296 18 A 4.2993 7.6489 121.4038 53.5946 19.2530 178.5211 19 R 4.2050 7.8016 110.6985 57.5885 30.2702 177.3096 20 R 4.2169 7.5962 117.8095 55.9744 30.1609 178.0891 21 S 4.1516 7.9748 114.4441 60.9695 62.8770 174.6054 22 H 4.9168 8.0354 116.8045 56.1688 28.7763 174.4389 23 H 4.5328 8.1899 114.6629 55.5221 28.5799 175.3318 24 A 4.2511 7.7679 123.5715 51.1017 17.8007 178.0610 25 L 4.2114 8.3016 122.3361 55.6542 42.4542 177.2171 26 T 4.4067 8.0405 111.1665 59.2627 70.3379 172.8127 27 P 4.0948 0.0000 0.0000 62.1970 31.1659 173.4869 28 P 4.0680 0.0000 0.0000 62.6686 30.6660 175.8297 29 T 3.7980 8.5079 118.3857 62.5049 67.3927 172.7999 30 L 5.1016 8.2552 127.1712 53.1422 45.8704 175.5684 31 V 4.2936 10.1371 111.7697 60.5797 36.7064 175.7580 32 P 3.9434 0.0000 0.0000 64.9532 31.8954 175.1576 33 C 3.8749 9.9221 128.5969 58.3529 32.8488 170.3639 34 P 4.0712 0.0000 0.0000 65.2949 31.1516 176.4032 35 E 4.2730 7.8507 120.2282 56.6126 29.9250 174.9255 36 C 3.8449 8.8546 120.4440 58.1013 29.9200 172.9805 37 K 3.8094 9.3909 123.2565 60.9614 31.9528 177.0403 38 A 3.6167 6.9355 119.3791 46.8028 18.7184 176.4556 39 M 4.7265 8.6407 122.7362 54.6921 32.9255 175.8020 40 K 4.7161 9.5685 121.3991 54.8207 36.7865 173.0734 41 P 4.7209 0.0000 0.0000 61.6152 32.1856 174.4474 42 P 4.1108 0.0000 0.0000 63.4762 31.3726 175.3438 43 H 4.1556 8.4637 111.6716 56.7437 26.7536 174.7235 44 T 4.5960 7.5306 108.4121 59.4947 70.8544 174.3793 45 V 3.6225 8.2224 122.3246 61.8601 30.4233 175.2720 46 C 3.7000 8.3940 127.4837 59.2128 31.6072 172.7373 47 P 4.4053 0.0000 0.0000 65.4625 30.7749 176.3822 48 E 4.0996 6.9974 115.6426 57.0082 30.2413 178.1871 49 C 3.6288 8.5176 116.3229 59.0979 29.3685 174.3080 50 G 3.6304 9.9817 112.9289 45.9910 0.0000 173.8260 51 Y 3.5774 7.8939 123.4187 54.4787 38.6434 173.7919 52 Y 4.3236 8.1692 120.1463 57.9258 37.4338 175.9858 53 A 3.8899 8.7947 128.7001 52.8972 17.0051 177.3850 54 G 4.1448 9.3172 113.7199 46.9536 0.0000 174.1069 55 R 4.6575 8.1884 121.4889 54.9950 32.5318 176.4874 56 K 4.7363 7.7274 118.7329 57.4611 36.1740 174.7026 57 V 4.3988 8.1273 120.2373 61.8367 30.0664 177.4168 58 L 4.6828 8.4972 129.3726 54.0161 42.8588 175.3832 59 E 4.6532 8.5981 122.1292 54.5269 32.9539 175.8724 60 V 3.9555 8.4312 121.7478 62.9652 31.6860 175.1147 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 4.27 1.30 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 0.00 0.00 0.00 0.00 0.00 0.00 3 K 7.57 4.31 0.00 1.78 1.72 0.00 1.62 0.00 0.00 1.68 0.00 0.00 2.98 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.30 1.49 7.81 4 H 8.80 4.34 0.00 3.21 2.89 0.00 5.75 0.00 0.00 0.00 0.00 7.40 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 4.08 0.00 2.06 1.98 0.00 3.70 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.13 0.00 6 V 8.02 4.53 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.75 0.00 0.00 0.94 0.00 0.00 7 P 0.00 4.34 0.00 2.20 2.10 0.00 3.76 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.96 0.00 8 K 8.59 4.17 0.00 1.72 1.87 0.00 1.67 0.00 0.00 1.71 0.00 0.00 3.06 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.41 1.52 7.81 9 K 7.74 4.43 0.00 1.73 1.65 0.00 1.85 0.00 0.00 1.63 0.00 0.00 2.94 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.35 1.37 7.81 10 K 8.92 3.70 0.00 1.71 1.79 0.00 1.78 0.00 0.00 1.75 0.00 0.00 2.83 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.43 1.46 7.81 11 T 8.47 3.90 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 8.50 4.33 0.00 4.02 4.04 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 0.00 0.00 0.00 13 K 8.59 4.11 0.00 1.74 1.88 0.00 1.72 0.00 0.00 1.70 0.00 0.00 3.02 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.44 1.50 7.81 14 A 7.86 4.49 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 15 R 7.44 4.01 0.00 1.90 1.96 0.00 3.26 0.00 0.00 3.15 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.63 0.00 16 R 7.84 4.12 0.00 1.90 1.89 0.00 3.22 0.00 0.00 3.33 7.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.69 0.00 17 D 7.93 4.43 0.00 2.69 2.69 0.00 0.00 0.00 0.00 0.00 0.00 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 A 7.65 4.30 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 19 R 7.80 4.20 0.00 1.96 2.24 0.00 3.07 0.00 0.00 3.24 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.59 0.00 20 R 7.60 4.22 0.00 1.91 1.73 0.00 3.06 0.00 0.00 3.26 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 1.68 0.00 21 S 7.97 4.15 0.00 3.84 4.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.04 4.92 0.00 3.21 3.34 0.00 5.69 0.00 0.00 0.00 0.00 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 H 8.19 4.53 0.00 3.25 3.34 0.00 5.84 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 7.77 4.25 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 25 L 8.30 4.21 0.00 1.63 1.62 0.93 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 26 T 8.04 4.41 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 1.22 0.00 0.00 27 P 0.00 4.09 0.00 2.19 2.14 0.00 3.80 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.96 0.00 28 P 0.00 4.07 0.00 2.19 2.18 0.00 3.77 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.98 0.00 29 T 8.51 3.80 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 1.22 0.00 0.00 30 L 8.26 5.10 0.00 1.50 1.59 0.90 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 31 V 10.14 4.29 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 0.77 0.00 0.00 0.96 0.00 0.00 32 P 0.00 3.94 0.00 2.01 1.81 0.00 3.54 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 2.09 2.09 0.00 33 C 9.92 3.87 0.00 2.93 3.29 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 34 P 0.00 4.07 0.00 1.88 1.99 0.00 3.49 0.00 0.00 3.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 2.05 0.00 35 E 7.85 4.27 0.00 1.88 1.87 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 2.19 2.20 0.00 36 C 8.85 3.84 0.00 3.16 3.24 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 37 K 9.39 3.81 0.00 1.86 1.99 0.00 1.58 0.00 0.00 1.69 0.00 0.00 2.79 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.39 1.44 7.81 38 A 6.94 3.62 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 39 M 8.64 4.73 0.00 1.89 1.98 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.30 0.00 40 K 9.57 4.72 0.00 1.62 1.77 0.00 1.10 0.00 0.00 1.55 0.00 0.00 2.79 0.00 0.00 2.62 0.00 0.00 0.00 0.00 1.18 1.47 7.81 41 P 0.00 4.72 0.00 2.10 2.09 0.00 3.75 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.95 0.00 42 P 0.00 4.11 0.00 2.22 2.24 0.00 3.93 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.04 0.00 43 H 8.46 4.16 0.00 3.35 3.49 0.00 5.67 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 T 7.53 4.60 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 1.35 0.00 0.00 45 V 8.22 3.62 2.18 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 0.93 0.00 0.00 1.26 0.00 0.00 46 C 8.39 3.70 0.00 2.78 2.69 0.00 0.00 0.00 0.00 0.00 0.00 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 4.41 0.00 2.20 2.16 0.00 3.74 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.97 0.00 48 E 7.00 4.10 0.00 1.90 1.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.26 0.00 49 C 8.52 3.63 0.00 3.04 2.81 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 50 G 9.98 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 51 Y 7.89 3.58 0.00 3.14 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 52 Y 8.17 4.32 0.00 3.00 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 53 A 8.79 3.89 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 9.32 4.14 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 0.00 0.00 0.00 55 R 8.19 4.66 0.00 1.93 1.83 0.00 3.29 0.00 0.00 3.41 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.68 0.00 56 K 7.73 4.74 0.00 1.93 1.80 0.00 1.76 0.00 0.00 1.73 0.00 0.00 3.06 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.25 1.33 7.81 57 V 8.13 4.40 2.08 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 0.73 0.00 0.00 0.99 0.00 0.00 58 L 8.50 4.68 0.00 1.62 1.59 0.92 0.77 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 59 E 8.60 4.65 0.00 1.90 1.81 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 2.21 2.21 0.00 60 V 8.43 3.96 2.08 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 0.79 0.00 0.00 0.93 0.00 0.00