NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 K 4.4989 8.1576 120.1313 57.0793 34.7298 173.5460 2 E 4.5995 8.3729 116.4943 54.1140 32.9503 173.4614 3 G 2.5765 7.0517 106.8566 46.1417 0.0000 172.0539 4 Y 4.9890 7.2471 116.9656 57.3622 39.3260 175.7159 5 L 4.4155 8.5666 124.0285 54.7078 42.9612 176.4277 6 V 4.8488 8.1110 121.4769 59.8065 34.5334 174.5316 7 N 4.8181 9.5797 123.9146 53.2081 39.1433 176.0458 8 K 4.3142 9.1304 126.3632 58.9954 32.5232 178.0422 9 S 4.5055 8.2698 114.3978 59.6743 63.4969 175.0997 10 T 4.2697 8.1687 108.1836 60.8580 70.0416 175.6023 11 G 4.0274 8.7349 108.8692 46.5093 0.0000 172.3655 12 C 4.9164 7.7909 116.7615 55.3070 42.5284 173.6744 13 K 4.9637 8.2093 120.4031 56.0727 33.2294 175.8884 14 Y 4.4791 8.6282 119.1251 56.6450 39.1458 176.2431 15 G 4.2623 8.7536 112.1356 46.6714 0.0000 171.3780 16 C 4.9529 8.4895 112.6263 54.8759 44.3048 174.2104 17 L 4.2460 8.9008 125.1994 57.2084 42.3893 176.6613 18 K 4.1029 7.9449 119.7844 56.1794 32.2622 176.4584 19 L 4.2877 8.4226 126.5267 54.9607 43.3722 178.8663 20 G 3.7026 8.3280 107.3345 45.8299 0.0000 174.2273 21 E 4.0065 8.9025 125.1256 56.9401 29.9111 176.9362 22 N 4.7859 8.5853 123.9041 51.3165 41.3651 174.2973 23 E 4.1867 8.9409 128.8357 58.5766 29.6881 179.5329 24 G 3.5868 8.3452 106.5702 48.0667 0.0000 175.3742 25 C 4.3464 8.2690 119.0059 59.4280 37.2134 175.3240 26 D 4.1847 8.1597 119.7755 57.1629 40.6002 178.4451 27 K 3.8871 7.8875 119.3918 59.7206 32.1035 178.6969 28 E 3.9752 7.7540 116.9272 59.6010 29.5780 178.3393 29 C 4.2808 8.8622 118.9059 59.1161 43.4848 175.0633 30 K 4.1810 7.9719 119.0368 55.3264 32.5168 177.1252 31 A 4.0204 7.2611 123.2401 52.1621 18.7678 178.4704 32 K 3.5298 8.7845 123.2317 59.3078 32.3128 177.6607 33 N 4.5379 8.1128 114.5953 54.6826 37.9549 175.7990 34 Q 4.1828 8.0872 116.9774 57.2920 29.8134 177.0437 35 G 3.7396 8.6748 104.7001 46.6014 0.0000 173.7075 36 G 4.0742 8.0516 106.7430 45.0564 0.0000 175.3703 37 S 4.7241 8.7709 113.8256 59.5721 65.1802 173.5269 38 Y 4.9895 7.6926 119.0732 56.7281 41.7963 173.3331 39 G 4.4120 8.2305 111.8422 45.0553 0.0000 171.1676 40 Y 4.9505 7.8636 118.0803 55.5601 42.1090 172.8063 41 C 4.9976 8.7427 121.6157 56.5432 43.5920 172.0989 42 Y 4.8554 8.9361 126.4855 56.9357 40.9805 174.5811 43 A 3.6867 8.5367 130.4916 53.2997 15.9956 176.4060 44 F 4.2776 7.8697 112.3634 58.4265 36.6881 175.6114 45 A 4.8593 7.4518 118.9985 50.8665 23.4130 176.3373 46 C 4.7158 9.4058 120.7434 56.9060 39.0265 172.4961 47 W 5.0121 9.0400 134.5462 55.6321 32.8452 173.6860 48 C 5.3097 8.3306 126.8632 54.5667 47.3687 172.5031 49 E 4.7891 9.2088 123.9711 55.0610 32.6080 176.2081 50 G 4.1678 8.5900 106.2062 46.6506 0.0000 173.7079 51 L 4.1799 7.9271 119.9764 53.1038 42.4609 175.6242 52 P 4.5226 0.0000 0.0000 62.1393 32.2737 177.0051 53 E 3.9636 8.7833 119.3658 59.6460 29.4666 179.1434 54 S 4.1687 7.9754 111.9190 60.7208 63.3106 174.2166 55 T 4.2607 7.4705 118.9741 61.4233 68.6618 173.0499 56 P 4.4294 0.0000 0.0000 62.9101 32.0366 175.1458 57 T 4.8183 7.8287 108.7587 59.4730 72.2104 172.6820 58 Y 4.2973 8.9446 124.5622 57.4473 39.2240 173.7106 59 P 4.1401 0.0000 0.0000 60.7364 34.3385 174.5408 60 L 4.3009 7.9978 120.3404 53.0856 42.2997 176.5148 61 P 4.3216 0.0000 0.0000 65.2966 31.0836 176.6600 62 N 4.9157 7.9090 113.1305 52.0361 38.0029 174.3230 63 K 4.3016 8.0029 120.3959 55.2250 33.2307 175.4017 64 S 4.5186 8.3114 120.0030 58.0163 63.3810 174.6667 65 C 4.9213 8.3850 122.8127 55.2022 43.6938 173.7362 66 S 4.1918 8.0659 118.5114 58.3818 62.2168 173.3918 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 K 8.16 4.50 0.00 1.80 2.02 0.00 1.37 0.00 0.00 1.77 0.00 0.00 3.08 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.52 1.35 7.81 2 E 8.37 4.60 0.00 1.85 1.86 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 2.25 2.59 0.00 3 G 7.05 2.58 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 4 Y 7.25 4.99 0.00 3.04 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 5 L 8.57 4.42 0.00 1.19 0.73 0.46 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 6 V 8.11 4.85 2.38 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 0.82 0.00 0.00 1.17 0.00 0.00 7 N 9.58 4.82 0.00 2.61 2.75 0.00 0.00 6.97 6.62 0.00 0.00 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 K 9.13 4.31 0.00 1.82 1.89 0.00 1.81 0.00 0.00 1.72 0.00 0.00 2.98 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.48 1.53 7.81 9 S 8.27 4.51 0.00 4.02 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 10 T 8.17 4.27 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 1.19 0.00 0.00 11 G 8.73 4.03 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 12 C 7.79 4.92 0.00 2.91 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 13 K 8.21 4.96 0.00 1.36 1.56 0.00 0.61 0.00 0.00 0.61 0.00 0.00 2.13 0.00 0.00 2.34 0.00 0.00 0.00 0.00 1.08 0.42 7.81 14 Y 8.63 4.48 0.00 2.84 2.90 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 15 G 8.75 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 0.00 0.00 0.00 0.00 16 C 8.49 4.95 0.00 3.05 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 17 L 8.90 4.25 0.00 1.67 1.79 0.95 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 18 K 7.94 4.10 0.00 1.81 1.77 0.00 1.86 0.00 0.00 1.74 0.00 0.00 3.05 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.46 1.50 7.81 19 L 8.42 4.29 0.00 1.62 1.47 0.63 0.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 20 G 8.33 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.90 4.01 0.00 1.99 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.39 2.47 0.00 22 N 8.59 4.79 0.00 2.95 2.69 0.00 0.00 7.20 7.65 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 23 E 8.94 4.19 0.00 2.12 2.02 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 2.44 2.49 0.00 24 G 8.35 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 C 8.27 4.35 0.00 2.95 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 26 D 8.16 4.18 0.00 2.87 2.65 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 27 K 7.89 3.89 0.00 2.06 1.93 0.00 1.71 0.00 0.00 1.67 0.00 0.00 2.97 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.45 1.49 7.81 28 E 7.75 3.98 0.00 1.94 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.62 0.00 29 C 8.86 4.28 0.00 2.83 3.22 0.00 0.00 0.00 0.00 0.00 0.00 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 K 7.97 4.18 0.00 1.96 1.85 0.00 1.85 0.00 0.00 1.60 0.00 0.00 3.24 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.60 1.44 7.81 31 A 7.26 4.02 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.78 3.53 0.00 1.73 1.87 0.00 1.78 0.00 0.00 1.76 0.00 0.00 3.05 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.43 1.45 7.81 33 N 8.11 4.54 0.00 2.88 2.94 0.00 0.00 5.97 7.39 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 34 Q 8.09 4.18 0.00 2.22 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.71 0.00 0.00 0.00 0.00 0.00 2.24 2.38 0.00 35 G 8.67 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.05 4.07 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 0.00 0.00 0.00 37 S 8.77 4.72 0.00 3.96 4.15 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 38 Y 7.69 4.99 0.00 3.10 3.05 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 0.00 0.00 0.00 39 G 8.23 4.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Y 7.86 4.95 0.00 3.24 2.92 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 41 C 8.74 5.00 0.00 3.11 3.19 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 0.00 0.00 0.00 42 Y 8.94 4.86 0.00 3.18 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 43 A 8.54 3.69 0.78 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 0.00 0.00 44 F 7.87 4.28 0.00 3.20 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 45 A 7.45 4.86 0.94 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 46 C 9.41 4.72 0.00 2.89 2.99 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 47 W 9.04 5.01 0.00 3.18 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 0.00 0.00 0.00 0.00 48 C 8.33 5.31 0.00 2.68 2.53 0.00 0.00 0.00 0.00 0.00 0.00 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 E 9.21 4.79 0.00 2.16 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.41 0.00 50 G 8.59 4.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 7.93 4.18 0.00 1.68 1.52 0.72 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 52 P 0.00 4.52 0.00 2.19 2.15 0.00 3.76 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 1.96 0.00 53 E 8.78 3.96 0.00 1.96 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 2.30 2.25 0.00 54 S 7.98 4.17 0.00 3.96 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 55 T 7.47 4.26 4.18 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 1.18 0.00 0.00 56 P 0.00 4.43 0.00 2.17 2.04 0.00 3.68 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.95 0.00 57 T 7.83 4.82 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 1.03 0.00 0.00 58 Y 8.94 4.30 0.00 3.07 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 59 P 0.00 4.14 0.00 1.64 0.72 0.00 3.66 0.00 0.00 3.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.69 0.00 60 L 8.00 4.30 0.00 1.92 1.61 1.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 61 P 0.00 4.32 0.00 2.15 2.17 0.00 3.68 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 1.97 1.95 0.00 62 N 7.91 4.92 0.00 2.77 2.84 0.00 0.00 5.72 7.13 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 63 K 8.00 4.30 0.00 1.82 1.68 0.00 1.52 0.00 0.00 1.58 0.00 0.00 2.96 0.00 0.00 3.19 0.00 0.00 0.00 0.00 1.34 1.58 7.81 64 S 8.31 4.52 0.00 3.87 3.75 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 65 C 8.39 4.92 0.00 3.00 3.22 0.00 0.00 0.00 0.00 0.00 0.00 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 S 8.07 4.19 0.00 3.93 3.75 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