NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 H 4.9758 8.3027 116.4717 54.9891 31.4133 171.4402 3 V 4.6460 7.5935 119.9852 60.9041 32.9840 173.1205 4 W 4.7020 10.4455 130.0966 54.0624 31.7687 173.4921 5 P 4.7137 0.0000 0.0000 62.8056 31.8764 177.4303 6 V 3.5264 8.6039 123.1852 66.6107 31.3613 178.8099 7 Q 4.0568 8.0460 116.3934 59.2423 28.4199 178.1148 8 D 4.4090 8.0983 120.2825 57.2006 41.0279 178.2945 9 A 3.4197 8.3236 121.5786 54.6000 17.9490 179.7441 10 K 3.8481 7.8693 117.1849 59.7773 32.4969 178.8491 11 A 4.2339 8.0744 119.5264 53.9514 18.6541 177.9046 12 R 4.7341 8.1978 117.0550 55.4558 31.3699 178.0556 13 F 4.2810 8.4312 122.8767 61.0793 39.4180 175.8776 14 S 4.0831 8.1878 114.1949 61.4488 62.6474 176.1799 15 E 3.9419 8.0974 121.7183 59.0514 29.5348 178.2533 16 F 3.2727 8.0552 121.1303 60.9587 39.2673 176.9584 17 L 3.4038 7.5553 119.9663 58.0614 41.7756 178.6173 18 D 4.2926 8.1258 118.7045 57.2127 40.6942 178.6611 19 A 3.9869 8.4384 121.8284 55.0653 18.5057 179.0119 20 C 4.5900 7.7310 118.5634 62.3293 31.3261 176.0735 21 I 3.8073 7.3940 119.8226 63.9077 36.8219 177.7821 22 T 4.2600 8.0787 109.5584 62.7759 69.2599 175.3839 23 E 4.3766 8.6193 119.9901 56.1997 31.9288 174.5088 24 G 3.7611 7.9136 103.0396 42.3974 0.0000 170.6982 25 P 4.6780 0.0000 0.0000 63.4854 31.9962 176.1893 26 Q 4.9458 8.7179 122.2483 54.2529 31.6764 174.9123 27 I 4.7428 9.1958 125.5661 60.6219 39.3118 174.8293 28 V 5.0161 9.0626 126.2723 61.2739 33.6944 174.6571 29 S 5.3169 9.2356 122.2703 56.4958 66.6511 172.8136 30 R 4.6397 8.6948 121.6323 54.9170 32.6768 175.6805 31 R 3.8912 9.8279 126.2933 57.3926 27.7304 177.3545 32 G 3.8576 8.5473 103.5152 45.3358 0.0000 173.4975 33 A 4.6659 7.7477 123.7140 49.7610 20.5608 176.6065 34 E 4.3506 8.7876 122.9935 56.9810 30.2485 176.2184 35 E 4.6273 9.1966 122.0229 57.4982 32.4611 174.9743 36 A 4.8421 7.7326 118.6820 51.0487 23.2391 175.1939 37 V 4.8785 8.0217 117.5390 60.2892 34.7295 174.3524 38 L 4.3381 9.0815 126.9150 53.7580 43.2643 175.0879 39 V 4.7236 7.9321 125.9277 60.0929 34.1634 173.5233 40 P 4.3265 0.0000 0.0000 62.5266 32.2124 177.2408 41 I 3.8742 8.5419 121.7448 64.1498 37.8170 178.6403 42 G 3.6028 8.0492 106.1566 47.7847 0.0000 175.0547 43 E 3.9519 8.2203 121.7199 58.5819 29.6852 178.4011 44 W 4.4020 8.4444 128.3588 60.7973 30.8230 178.1148 45 R 3.7232 8.1611 117.8163 59.3599 29.4095 179.3768 46 R 3.9073 8.2920 118.1372 59.0985 29.9986 179.1331 47 L 3.9086 8.1928 119.2765 57.8070 41.3632 179.5064 48 Q 3.6555 7.4916 116.8219 58.7137 28.6003 178.4850 49 A 4.0302 7.5969 120.6855 55.0791 18.5288 179.3744 50 A 4.0089 8.0680 118.1539 54.6132 18.4686 177.9462 51 A 4.2208 7.8706 123.4489 52.4933 18.8053 177.0492 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 H 8.30 4.98 0.00 3.36 3.68 0.00 5.39 0.00 0.00 0.00 0.00 6.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3 V 7.59 4.65 2.01 0.00 0.00 0.00 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 0.80 0.00 0.00 4 W 10.45 4.70 0.00 3.19 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 5 P 0.00 4.71 0.00 2.09 1.99 0.00 3.77 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 2.09 2.09 0.00 6 V 8.60 3.53 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 1.03 0.00 0.00 0.99 0.00 0.00 7 Q 8.05 4.06 0.00 2.29 2.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.70 0.00 0.00 0.00 0.00 0.00 2.43 2.40 0.00 8 D 8.10 4.41 0.00 3.02 3.01 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.32 3.42 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 K 7.87 3.85 0.00 1.74 1.98 0.00 1.77 0.00 0.00 1.69 0.00 0.00 3.00 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.44 1.39 7.81 11 A 8.07 4.23 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.20 4.73 0.00 2.36 2.24 0.00 3.73 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 1.65 1.65 0.00 13 F 8.43 4.28 0.00 3.33 3.07 0.00 0.00 0.00 0.00 0.00 0.00 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 S 8.19 4.08 0.00 3.95 3.92 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 15 E 8.10 3.94 0.00 2.14 2.29 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 2.73 2.52 0.00 16 F 8.06 3.27 0.00 1.59 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 17 L 7.56 3.40 0.00 1.16 1.47 0.72 1.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 18 D 8.13 4.29 0.00 2.70 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 19 A 8.44 3.99 1.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 C 7.73 4.59 0.00 2.53 2.82 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 0.00 0.00 0.00 21 I 7.39 3.81 1.81 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.55 0.88 0.00 0.00 22 T 8.08 4.26 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 1.25 0.00 0.00 23 E 8.62 4.38 0.00 2.04 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 0.00 2.25 2.23 0.00 24 G 7.91 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.68 0.00 1.96 2.04 0.00 3.62 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.17 0.00 26 Q 8.72 4.95 0.00 1.35 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.90 0.00 0.00 0.00 0.00 0.00 2.23 2.34 0.00 27 I 9.20 4.74 2.00 0.00 0.00 1.00 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 0.95 1.05 0.00 0.00 28 V 9.06 5.02 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 1.09 0.00 0.00 1.02 0.00 0.00 29 S 9.24 5.32 0.00 3.97 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 30 R 8.69 4.64 0.00 1.86 1.79 0.00 3.24 0.00 0.00 3.17 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.57 0.00 31 R 9.83 3.89 0.00 1.97 1.97 0.00 3.30 0.00 0.00 3.23 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.60 0.00 32 G 8.55 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 33 A 7.75 4.67 1.31 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 0.00 0.00 34 E 8.79 4.35 0.00 2.00 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 2.36 2.34 0.00 35 E 9.20 4.63 0.00 1.92 1.92 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 2.21 2.24 0.00 36 A 7.73 4.84 1.24 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 37 V 8.02 4.88 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 0.71 0.00 0.00 0.99 0.00 0.00 38 L 9.08 4.34 0.00 1.35 0.89 0.81 -0.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 0.00 0.00 0.00 0.00 39 V 7.93 4.72 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.00 0.00 0.91 0.00 0.00 40 P 0.00 4.33 0.00 2.22 1.93 0.00 3.66 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.25 0.00 41 I 8.54 3.87 1.89 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.31 0.93 0.00 0.00 42 G 8.05 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.22 3.95 0.00 2.08 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 0.00 2.46 2.41 0.00 44 W 8.44 4.40 0.00 3.38 3.30 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 45 R 8.16 3.72 0.00 2.00 1.92 0.00 3.36 0.00 0.00 3.29 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 1.86 0.00 46 R 8.29 3.91 0.00 1.95 1.95 0.00 3.11 0.00 0.00 3.16 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.85 0.00 47 L 8.19 3.91 0.00 1.76 1.53 0.92 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 48 Q 7.49 3.66 0.00 1.78 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.97 0.00 0.00 0.00 0.00 0.00 1.64 1.16 0.00 49 A 7.60 4.03 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 50 A 8.07 4.01 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 51 A 7.87 4.22 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