NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- -3 T 4.1928 8.2745 112.9180 60.6977 70.9829 174.5992 -2 R 3.8211 7.9691 126.8682 56.1053 29.0892 177.0005 -1 K 4.8310 8.9831 125.7666 51.6793 38.0040 176.9801 0 L 3.5407 8.0901 118.3721 56.8318 41.1851 180.1844 1 C 4.3435 8.8478 128.4760 60.5510 39.8572 175.0125 2 S 4.0669 8.0893 114.1583 58.9869 62.8967 173.9853 3 L 4.2799 8.1484 124.2062 53.7846 41.3908 175.5060 4 D 4.3262 9.2585 129.1499 55.5488 39.8267 173.2983 5 N 4.0125 8.4287 109.6249 53.2280 37.6951 174.3237 6 G 3.9656 8.7627 101.5546 45.7034 0.0000 174.5882 7 D 4.5184 8.1638 115.9343 54.4591 40.3598 173.3790 8 C 4.6325 7.9159 114.5256 56.5352 41.0337 173.7691 9 D 4.4812 8.6323 123.0186 56.9868 42.0323 177.2004 10 Q 4.5128 7.3397 112.8201 55.5934 30.7161 179.3916 11 F 4.6755 7.1294 128.1551 58.6475 40.0267 172.3631 12 C 5.4596 8.9090 122.5396 55.0891 44.5144 172.4130 13 H 4.9648 9.4456 125.5613 54.4300 33.2059 171.7024 14 E 4.8988 8.7501 125.0921 55.5027 30.3846 175.5594 15 E 4.5807 9.0076 124.9232 55.6307 32.1208 176.5056 16 Q 3.6012 9.5836 123.4442 57.2026 26.3799 173.1137 17 N 4.2541 8.4049 108.7249 54.4032 37.8116 172.9906 18 S 4.6625 7.7141 108.4921 55.5403 65.7988 172.8590 19 V 4.0377 8.3012 125.8427 62.8927 32.2491 175.2338 20 V 4.4422 9.0323 127.6748 61.4344 34.0897 173.6818 21 C 5.4895 8.8906 125.2570 56.1559 36.5573 172.6774 22 S 4.7180 8.8112 115.2100 57.8692 66.6706 171.8439 23 C 4.9301 8.5086 115.6752 54.5462 38.3465 174.3800 24 A 4.5220 8.8318 124.1054 51.7483 18.7075 177.6230 25 R 4.1186 8.4834 118.7115 58.2903 30.6136 177.7022 26 G 3.9741 9.4260 109.7287 45.1564 0.0000 172.0003 27 Y 5.2266 7.6475 115.7925 56.1037 41.6426 175.0551 28 T 4.7332 8.8509 112.0207 59.4916 72.0299 173.0490 29 L 4.5503 8.5632 126.4074 54.9238 42.8219 176.4182 30 A 4.2928 9.3019 128.8493 51.8101 19.3521 178.0641 31 D 4.3083 8.7327 118.6357 57.2593 40.9254 177.9315 32 N 4.4146 8.1637 114.6007 53.2147 37.5954 175.5081 33 G 3.9864 8.2377 107.1028 46.4673 0.0000 174.1411 34 K 4.4931 8.1463 117.4661 57.5873 35.7371 176.6809 35 A 4.5830 8.5614 121.5934 51.9716 19.8240 175.5314 36 C 5.2022 9.0804 118.4848 55.3013 38.9241 173.4843 37 I 4.6603 8.9779 125.2402 58.6631 39.3087 173.5150 38 P 4.3040 0.0000 0.0000 62.7571 31.1664 176.8666 39 T 4.0209 8.6456 115.0312 63.8508 69.5852 174.1955 40 G 3.9419 7.2046 108.9223 44.3753 0.0000 170.6786 41 P 4.2297 0.0000 0.0000 62.5879 32.5142 175.1019 42 Y 3.6225 7.6315 114.0834 58.3314 35.2637 169.7860 43 P 4.3089 0.0000 0.0000 62.3136 32.5022 176.1491 44 C 4.3937 8.3931 114.8039 59.7172 30.0063 174.3045 45 G 3.9873 8.9298 108.8816 45.5768 0.0000 173.2241 46 K 4.6145 7.2899 118.8346 54.0689 33.9546 176.4699 47 Q 4.1798 8.6230 122.8172 56.2459 29.3356 176.0764 48 T 4.4704 8.3004 111.2967 60.9715 70.1249 174.5639 49 L 4.6815 8.3886 122.2603 54.9947 43.9715 176.3915 50 E 4.2768 7.9470 122.1897 56.6749 30.5111 174.7493 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 -3 T 8.27 4.19 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 -2 R 7.97 3.82 0.00 1.90 1.81 0.00 3.17 0.00 0.00 3.25 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.26 0.00 -1 K 8.98 4.83 0.00 1.62 1.65 0.00 1.90 0.00 0.00 1.82 0.00 0.00 2.83 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.32 0.98 7.81 0 L 8.09 3.54 0.00 1.97 0.73 0.95 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 1 C 8.85 4.34 0.00 3.15 3.14 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 2 S 8.09 4.07 0.00 3.97 3.90 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 3 L 8.15 4.28 0.00 1.83 1.74 0.92 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 4 D 9.26 4.33 0.00 2.89 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 5 N 8.43 4.01 0.00 2.98 2.79 0.00 0.00 7.59 7.90 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 6 G 8.76 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 7 D 8.16 4.52 0.00 2.83 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 8 C 7.92 4.63 0.00 3.05 2.97 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 9 D 8.63 4.48 0.00 2.64 2.57 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 7.34 4.51 0.00 1.48 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.81 6.93 0.00 0.00 0.00 0.00 0.00 1.86 1.97 0.00 11 F 7.13 4.68 0.00 3.05 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 12 C 8.91 5.46 0.00 3.13 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 13 H 9.45 4.96 0.00 3.18 3.08 0.00 5.63 0.00 0.00 0.00 0.00 6.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 E 8.75 4.90 0.00 1.86 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 2.27 2.31 0.00 15 E 9.01 4.58 0.00 2.00 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 2.26 2.30 0.00 16 Q 9.58 3.60 0.00 2.16 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.84 0.00 0.00 0.00 0.00 0.00 2.28 2.33 0.00 17 N 8.40 4.25 0.00 2.82 2.88 0.00 0.00 6.92 7.63 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 18 S 7.71 4.66 0.00 3.81 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 19 V 8.30 4.04 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 0.81 0.00 0.00 0.94 0.00 0.00 20 V 9.03 4.44 2.24 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 1.02 0.00 0.00 1.01 0.00 0.00 21 C 8.89 5.49 0.00 3.03 2.98 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 22 S 8.81 4.72 0.00 3.97 4.01 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 23 C 8.51 4.93 0.00 2.80 2.79 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 24 A 8.83 4.52 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.48 4.12 0.00 1.90 1.96 0.00 3.25 0.00 0.00 3.27 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.74 0.00 26 G 9.43 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 27 Y 7.65 5.23 0.00 2.87 2.78 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 0.00 0.00 0.00 0.00 28 T 8.85 4.73 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 29 L 8.56 4.55 0.00 1.67 1.64 1.00 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 30 A 9.30 4.29 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 31 D 8.73 4.31 0.00 2.68 2.75 0.00 0.00 0.00 0.00 0.00 0.00 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 N 8.16 4.41 0.00 2.81 2.94 0.00 0.00 6.03 7.00 0.00 0.00 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 G 8.24 3.99 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 0.00 0.00 0.00 34 K 8.15 4.49 0.00 1.77 1.93 0.00 1.66 0.00 0.00 1.94 0.00 0.00 2.87 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.41 1.56 7.81 35 A 8.56 4.58 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 36 C 9.08 5.20 0.00 2.61 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 37 I 8.98 4.66 1.90 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.67 0.91 0.00 0.00 38 P 0.00 4.30 0.00 1.73 1.52 0.00 3.68 0.00 0.00 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.94 0.00 39 T 8.65 4.02 4.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 40 G 7.20 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.23 0.00 2.12 1.93 0.00 3.91 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 1.99 0.00 42 Y 7.63 3.62 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 43 P 0.00 4.31 0.00 1.77 1.65 0.00 3.56 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.77 0.00 44 C 8.39 4.39 0.00 3.20 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 45 G 8.93 3.99 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 0.00 0.00 0.00 46 K 7.29 4.61 0.00 1.88 1.76 0.00 1.78 0.00 0.00 1.77 0.00 0.00 2.95 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.69 1.60 7.81 47 Q 8.62 4.18 0.00 2.06 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.86 0.00 0.00 0.00 0.00 0.00 2.39 2.38 0.00 48 T 8.30 4.47 4.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 49 L 8.39 4.68 0.00 1.61 1.72 0.91 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 50 E 7.95 4.28 0.00 1.88 1.80 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 2.21 2.23 0.00