NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 4 A 4.3602 8.1233 123.5830 51.8428 20.4480 179.2884 5 L 3.7741 8.1166 122.6965 58.7886 41.7052 177.1746 6 L 4.0007 8.0839 118.6820 57.7370 42.1429 179.1732 7 R 3.9180 7.8926 118.0186 59.6030 30.2171 178.4114 8 Q 3.9720 8.7935 118.0480 58.8863 28.6228 178.6118 9 A 3.6749 8.7910 122.9656 55.0519 18.2662 178.8950 10 Y 4.0577 8.0760 118.0107 61.0386 38.6878 178.6323 11 S 3.8902 7.7809 113.8174 61.6112 63.0895 176.3526 12 A 4.0930 7.7312 121.8196 54.1249 18.4496 177.9202 13 L 4.4086 7.8050 116.0775 56.6065 43.1017 178.9980 14 F 5.0072 7.5795 114.6414 59.7904 38.9472 176.6904 15 R 3.6310 7.4966 121.5587 58.9079 30.4588 176.9082 16 R 4.0977 7.6133 115.4887 56.0733 31.4914 177.5820 17 T 3.9237 8.7495 121.1628 66.7680 68.5836 176.5335 18 S 4.1366 8.0654 115.7451 61.9003 63.1305 176.7069 19 T 3.9596 7.9325 113.5016 63.9717 68.5735 176.0428 20 F 4.2785 8.6767 124.9076 60.5401 39.3974 177.0172 21 A 4.1524 8.2002 120.6011 55.2150 18.1847 179.6668 22 L 4.0106 7.9337 117.1690 58.1813 41.5741 179.8910 23 T 3.8591 8.0137 115.8693 66.3961 68.2209 177.0013 24 V 3.4563 7.4285 119.9330 65.6095 31.5516 178.3154 25 V 3.5528 7.7662 118.0079 66.1547 31.4062 178.1165 26 L 4.1374 8.1707 118.9425 57.5957 41.4367 179.6694 27 G 3.6471 8.3766 105.7535 47.6690 0.0000 175.5762 28 A 3.9955 8.2254 123.3496 54.9203 18.3383 179.5949 29 V 3.5644 7.8352 116.7426 66.3793 31.5094 178.2856 30 L 4.0316 8.3496 118.7579 57.6965 41.4255 179.0577 31 F 4.0493 8.7557 120.9952 61.3258 39.2846 176.4996 32 E 4.1463 8.9024 119.0253 59.4203 29.4549 178.4707 33 R 3.8407 7.7098 118.2816 59.5943 30.0256 178.3058 34 A 3.8973 7.8990 120.1496 55.0825 18.3562 179.2882 35 F 3.7520 8.5251 120.2504 61.3327 39.3332 176.9993 36 D 4.1740 8.4525 118.7452 57.4623 40.6360 178.6015 37 Q 4.0234 7.8053 118.0415 59.1237 28.6882 179.5211 38 G 3.4625 8.2548 106.5932 47.5202 0.0000 175.5415 39 A 3.7348 7.8315 123.4321 55.0853 18.3286 179.3908 40 D 4.3205 8.5245 117.3924 57.3878 40.7572 179.1105 41 A 3.9726 8.1640 121.2236 55.3704 18.6001 179.5824 42 I 3.6384 7.9639 118.6047 64.5122 36.9191 178.5117 43 F 4.1181 8.2370 120.4156 61.5367 39.6762 176.8640 44 E 4.0062 8.5810 118.4309 59.5077 28.8077 178.9260 45 H 4.1269 8.5771 118.8348 59.1284 29.7959 176.9076 46 L 4.2098 7.6097 117.9450 56.0265 41.6763 177.1066 47 N 4.9067 7.5706 116.6093 52.3645 39.7929 173.7547 48 E 3.8409 7.4865 117.3418 58.4712 29.7581 178.1812 49 G 3.9687 8.3393 111.3577 45.4015 0.0000 173.8532 50 K 4.3458 7.9672 117.6888 57.2777 33.4744 177.1853 51 L 4.4204 7.5821 118.1342 53.5072 42.6165 177.5178 52 W 4.3345 8.8010 129.6322 60.4090 30.2724 178.0261 53 K 3.7676 8.0857 118.7377 59.9570 31.6913 177.9606 54 H 4.4468 7.7597 115.2079 58.4095 28.8400 177.4399 55 I 3.7946 7.7242 121.0162 64.2711 37.3127 178.9580 56 K 3.2704 7.4706 121.7491 58.9732 32.6046 177.2568 57 H 3.9825 7.8627 112.9020 58.5354 28.2866 176.4535 58 K 3.7942 7.5433 119.0251 58.6705 31.6950 177.2876 59 Y 4.5727 7.0133 112.8567 58.0043 39.9648 176.2175 60 E 4.2335 8.0732 121.9271 56.2717 27.2072 175.2234 61 A 3.6632 7.9431 124.6054 52.4066 15.3915 177.3250 62 S 4.5645 8.0903 113.2087 57.4438 66.3829 173.9140 63 E 4.6251 8.0100 117.6250 54.2055 32.3836 175.6592 64 E 4.1394 8.7312 118.0722 57.2181 29.7908 175.0682 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 4 A 8.12 4.36 1.32 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 0.00 0.00 5 L 8.12 3.77 0.00 1.79 1.73 0.93 0.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 6 L 8.08 4.00 0.00 1.71 1.77 0.95 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 7 R 7.89 3.92 0.00 1.89 2.13 0.00 3.19 0.00 0.00 3.35 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.75 0.00 8 Q 8.79 3.97 0.00 2.19 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.57 0.00 0.00 0.00 0.00 0.00 2.37 2.62 0.00 9 A 8.79 3.67 1.02 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 0.00 0.00 10 Y 8.08 4.06 0.00 3.25 3.23 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 11 S 7.78 3.89 0.00 3.91 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 12 A 7.73 4.09 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 13 L 7.81 4.41 0.00 1.12 1.59 0.67 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 14 F 7.58 5.01 0.00 3.18 3.20 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 0.00 15 R 7.50 3.63 0.00 1.24 1.66 0.00 3.01 0.00 0.00 3.11 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.45 0.00 16 R 7.61 4.10 0.00 1.89 1.86 0.00 3.18 0.00 0.00 3.33 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.69 0.00 17 T 8.75 3.92 4.23 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 1.18 0.00 0.00 18 S 8.07 4.14 0.00 4.06 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 19 T 7.93 3.96 4.32 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 1.21 0.00 0.00 20 F 8.68 4.28 0.00 3.21 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 21 A 8.20 4.15 1.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 7.93 4.01 0.00 1.88 1.73 0.93 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 23 T 8.01 3.86 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 1.23 0.00 0.00 24 V 7.43 3.46 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 1.03 0.00 0.00 0.68 0.00 0.00 25 V 7.77 3.55 2.21 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 0.98 0.00 0.00 1.00 0.00 0.00 26 L 8.17 4.14 0.00 1.88 1.70 0.97 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 27 G 8.38 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 28 A 8.23 4.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 V 7.84 3.56 2.27 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 1.05 0.00 0.00 1.00 0.00 0.00 30 L 8.35 4.03 0.00 1.91 1.75 0.95 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 31 F 8.76 4.05 0.00 3.20 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 32 E 8.90 4.15 0.00 2.24 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 0.00 2.54 2.43 0.00 33 R 7.71 3.84 0.00 1.89 2.07 0.00 3.15 0.00 0.00 3.17 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.67 0.00 34 A 7.90 3.90 1.32 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 0.00 0.00 35 F 8.53 3.75 0.00 1.90 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 36 D 8.45 4.17 0.00 2.73 2.67 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 37 Q 7.81 4.02 0.00 2.24 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.80 0.00 0.00 0.00 0.00 0.00 2.36 2.45 0.00 38 G 8.25 3.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.83 3.73 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 40 D 8.52 4.32 0.00 2.75 2.76 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 41 A 8.16 3.97 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 I 7.96 3.64 2.02 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 1.39 1.33 0.94 0.00 0.00 43 F 8.24 4.12 0.00 3.05 3.27 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 44 E 8.58 4.01 0.00 2.09 2.05 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 2.47 2.79 0.00 45 H 8.58 4.13 0.00 3.22 3.45 0.00 5.58 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 L 7.61 4.21 0.00 1.64 1.60 0.97 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 47 N 7.57 4.91 0.00 2.36 2.57 0.00 0.00 6.85 7.68 0.00 0.00 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 E 7.49 3.84 0.00 1.82 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 2.35 2.32 0.00 49 G 8.34 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 50 K 7.97 4.35 0.00 1.86 1.89 0.00 1.67 0.00 0.00 1.76 0.00 0.00 2.78 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.40 1.38 7.81 51 L 7.58 4.42 0.00 1.47 1.59 0.92 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 52 W 8.80 4.33 0.00 3.41 3.12 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 53 K 8.09 3.77 0.00 1.79 1.72 0.00 1.85 0.00 0.00 1.79 0.00 0.00 3.05 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.43 1.57 7.81 54 H 7.76 4.45 0.00 3.30 3.27 0.00 5.72 0.00 0.00 0.00 0.00 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 I 7.72 3.79 1.78 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 1.79 1.05 1.12 0.00 0.00 56 K 7.47 3.27 0.00 0.79 1.26 0.00 1.77 0.00 0.00 1.70 0.00 0.00 2.76 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.22 1.43 7.81 57 H 7.86 3.98 0.00 3.15 3.36 0.00 5.78 0.00 0.00 0.00 0.00 7.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 K 7.54 3.79 0.00 0.79 1.01 0.00 1.35 0.00 0.00 1.43 0.00 0.00 2.92 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.21 0.99 7.81 59 Y 7.01 4.57 0.00 3.05 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 60 E 8.07 4.23 0.00 2.03 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 2.33 2.35 0.00 61 A 7.94 3.66 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 S 8.09 4.56 0.00 3.90 3.80 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 63 E 8.01 4.63 0.00 1.96 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 2.21 2.30 0.00 64 E 8.73 4.14 0.00 2.07 1.90 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 2.24 2.36 0.00