NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- -1 G 4.0194 8.3549 109.7365 44.7509 0.0000 173.8863 0 S 4.5582 7.9680 114.6829 57.2818 69.8990 174.1055 1 M 4.7592 8.3186 116.2679 54.8291 32.7302 175.8238 2 A 4.2425 8.1190 121.3214 53.5744 19.4965 178.3094 3 D 4.7980 7.9646 114.0238 54.3877 41.4536 176.8446 4 T 4.4059 7.7796 116.1778 63.4344 70.6322 174.0957 5 R 4.1409 7.4069 114.0545 57.3087 33.7665 170.7114 6 R 3.8113 9.2700 122.9345 57.2116 30.5892 176.2247 7 R 4.0373 8.7290 117.3430 57.0130 27.1919 176.8687 8 Q 4.2115 8.0767 121.2504 59.1911 29.8375 176.0175 9 N 4.4632 8.4411 111.5599 52.1453 38.4949 173.1451 10 H 3.9121 8.5194 109.8590 57.3448 27.5718 174.6128 11 S 4.7594 8.1305 119.8546 57.1841 64.6817 173.1825 12 C 4.7707 8.5933 118.7727 59.2854 29.8282 174.2284 13 D 4.7756 8.8195 120.3908 57.6591 40.6135 177.3087 14 P 4.3380 0.0000 0.0000 65.6890 31.3177 178.0630 15 C 4.3380 8.0800 116.6607 62.8089 28.0101 175.9079 16 R 4.0068 8.3101 119.2875 58.4756 29.7308 178.3875 17 K 4.3975 7.8073 117.2435 57.7998 33.2894 178.0682 18 G 3.8596 8.0091 105.1266 43.2581 0.0000 172.8598 19 K 3.9050 8.3395 118.3896 56.7928 28.6360 175.9610 20 R 4.7242 8.4412 116.4363 54.5314 34.7668 176.3619 21 R 4.2741 8.7819 118.3847 55.5507 30.5955 174.7095 22 C 4.7297 7.7169 110.9092 58.4706 31.9456 173.1785 23 D 4.2063 9.2087 118.6050 57.7833 40.5531 176.0445 24 A 3.4423 7.6632 128.0626 51.3245 17.9728 174.6779 25 P 5.6302 0.0000 0.0000 61.8771 33.6386 176.3164 26 E 4.4794 8.9572 118.8262 58.0538 29.7374 177.5237 27 N 5.0373 7.7564 114.6704 52.8775 38.1358 176.2228 28 R 3.4281 7.8937 122.0421 60.0262 29.7892 178.0785 29 N 4.3323 8.0078 115.8215 56.3642 38.5958 176.8007 30 E 4.0353 8.1164 117.8617 58.2846 29.9533 178.2982 31 A 4.0456 8.1492 121.4975 55.6806 18.5888 179.1205 32 N 4.4722 8.4026 115.1306 56.6304 38.3339 177.2269 33 E 4.0222 8.1565 120.1686 58.6514 29.7734 177.6811 34 N 5.0803 7.9507 114.3650 51.4018 38.1018 171.7370 35 G 3.8626 7.9850 116.6920 45.7317 0.0000 174.1621 36 W 5.4098 8.8507 135.0000 55.5893 28.9104 178.5429 37 V 4.4395 6.3019 120.7641 60.5524 28.1330 170.3096 38 S 3.8444 5.8100 111.3870 56.4604 67.3813 176.1453 39 C 4.8984 8.5370 121.0617 58.3511 29.6934 174.2789 40 S 4.1266 8.7334 113.3425 62.3489 62.2125 174.7661 41 N 4.1665 8.3020 120.8613 54.2944 38.1761 176.2128 42 C 3.9763 8.2310 120.2573 63.6415 28.6591 176.1475 43 K 3.9042 7.8739 120.2112 59.2603 31.4197 179.4103 44 R 3.7151 7.7290 119.1273 58.2858 30.1544 177.9523 45 W 4.9004 7.6012 116.2508 56.8099 29.8824 175.9382 46 N 4.2732 7.9436 114.3101 53.9963 37.1864 175.4850 47 K 4.8214 7.6020 133.2776 56.9332 31.6888 180.7520 48 D 4.6386 8.5712 120.9766 53.4168 40.8739 172.4437 49 C 3.9883 7.7893 121.2834 58.9702 31.4874 171.9752 50 T 5.0570 8.6056 114.4899 59.9002 71.2209 174.7978 51 F 4.9129 9.2695 122.5141 57.4231 39.9772 175.3408 52 N 4.6587 7.8801 118.2572 53.8376 39.8035 176.9225 53 W 4.3992 8.6571 117.0476 59.9370 28.0786 178.5460 54 L 2.5201 5.6899 119.7032 58.3115 39.8106 179.0077 55 S 4.0953 7.5745 112.9909 59.5056 62.1620 174.9022 56 S 4.6912 7.4771 116.3387 57.4709 64.0029 175.3866 57 Q 3.8575 7.6675 122.6984 58.9851 29.2065 177.5285 58 R 4.0892 7.4785 117.4168 58.5098 30.1815 178.7901 59 S 4.2486 7.8691 114.2391 60.8392 63.1849 174.5173 60 K 4.1939 7.3492 120.6251 56.3051 34.0847 175.0966 61 N 4.0114 8.4489 120.0146 53.2225 38.5043 172.9041 62 S 4.2730 7.8752 116.4262 59.3023 63.3279 174.6543 63 S 4.1141 7.8012 122.1911 59.0572 62.0762 174.0894 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 G 8.35 4.02 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 0.00 0 S 7.97 4.56 0.00 3.90 3.84 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 0.00 0.00 0.00 1 M 8.32 4.76 0.00 2.13 2.19 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 2.53 2.50 0.00 2 A 8.12 4.24 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 3 D 7.96 4.80 0.00 2.67 2.70 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 4 T 7.78 4.41 4.25 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 0.00 0.00 1.22 0.00 0.00 5 R 7.41 4.14 0.00 2.04 1.97 0.00 3.37 0.00 0.00 3.16 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 1.49 0.00 6 R 9.27 3.81 0.00 1.97 1.96 0.00 3.45 0.00 0.00 3.28 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.55 0.00 7 R 8.73 4.04 0.00 2.14 2.20 0.00 3.08 0.00 0.00 3.15 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.60 0.00 8 Q 8.08 4.21 0.00 2.05 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 7.41 0.00 0.00 0.00 0.00 0.00 2.31 2.35 0.00 9 N 8.44 4.46 0.00 2.91 2.95 0.00 0.00 6.33 8.02 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 10 H 8.52 3.91 0.00 3.24 3.34 0.00 5.71 0.00 0.00 0.00 0.00 6.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 S 8.13 4.76 0.00 3.98 3.98 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 12 C 8.59 4.77 0.00 3.24 3.28 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 13 D 8.82 4.78 0.00 2.51 2.40 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.34 0.00 2.44 2.33 0.00 3.89 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 2.22 2.14 0.00 15 C 8.08 4.34 0.00 3.35 3.44 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.31 4.01 0.00 1.99 2.07 0.00 3.44 0.00 0.00 3.43 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 2.07 0.00 17 K 7.81 4.40 0.00 1.82 1.93 0.00 1.42 0.00 0.00 1.66 0.00 0.00 3.07 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.37 1.69 7.81 18 G 8.01 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 19 K 8.34 3.91 0.00 1.97 1.96 0.00 1.75 0.00 0.00 1.73 0.00 0.00 3.04 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.37 1.47 7.81 20 R 8.44 4.72 0.00 2.00 1.95 0.00 3.40 0.00 0.00 3.37 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.87 0.00 21 R 8.78 4.27 0.00 1.94 1.99 0.00 2.75 0.00 0.00 2.40 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.68 0.00 22 C 7.72 4.73 0.00 3.15 3.02 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 23 D 9.21 4.21 0.00 2.61 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 24 A 7.66 3.44 1.05 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 0.00 0.00 25 P 0.00 5.63 0.00 2.20 2.21 0.00 3.54 0.00 0.00 3.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 1.67 0.00 26 E 8.96 4.48 0.00 2.01 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 2.30 2.24 0.00 27 N 7.76 5.04 0.00 2.87 2.91 0.00 0.00 5.81 7.58 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 28 R 7.89 3.43 0.00 1.12 1.42 0.00 2.94 0.00 0.00 2.25 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.14 0.00 29 N 8.01 4.33 0.00 2.80 2.88 0.00 0.00 6.86 7.80 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 30 E 8.12 4.04 0.00 1.94 2.07 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 2.26 2.36 0.00 31 A 8.15 4.05 1.09 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 0.00 0.00 0.00 0.00 0.00 0.00 32 N 8.40 4.47 0.00 2.97 2.96 0.00 0.00 6.81 7.41 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 33 E 8.16 4.02 0.00 1.98 2.12 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 2.33 2.33 0.00 34 N 7.95 5.08 0.00 2.90 3.02 0.00 0.00 7.20 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 35 G 7.98 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 36 W 8.85 5.41 0.00 3.10 2.31 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 37 V 6.30 4.44 1.79 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 -0.36 0.00 0.00 0.53 0.00 0.00 38 S 5.81 3.84 0.00 3.48 3.51 0.00 0.00 0.00 0.00 0.00 0.00 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 C 8.54 4.90 0.00 3.42 3.49 0.00 0.00 0.00 0.00 0.00 0.00 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 S 8.73 4.13 0.00 4.04 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 41 N 8.30 4.17 0.00 2.83 2.88 0.00 0.00 7.13 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 42 C 8.23 3.98 0.00 2.91 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 43 K 7.87 3.90 0.00 1.79 1.63 0.00 1.56 0.00 0.00 1.49 0.00 0.00 2.71 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.19 1.50 7.81 44 R 7.73 3.72 0.00 0.67 1.30 0.00 2.79 0.00 0.00 2.38 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 1.40 0.00 45 W 7.60 4.90 0.00 3.54 3.04 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 46 N 7.94 4.27 0.00 2.89 3.14 0.00 0.00 6.96 6.55 0.00 0.00 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 K 7.60 4.82 0.00 1.86 1.07 0.00 1.80 0.00 0.00 1.73 0.00 0.00 2.97 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.85 1.83 7.81 48 D 8.57 4.64 0.00 2.53 2.48 0.00 0.00 0.00 0.00 0.00 0.00 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 C 7.79 3.99 0.00 2.88 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 50 T 8.61 5.06 4.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 51 F 9.27 4.91 0.00 2.96 3.09 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 0.00 0.00 0.00 0.00 52 N 7.88 4.66 0.00 3.01 2.85 0.00 0.00 7.10 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 53 W 8.66 4.40 0.00 3.84 3.48 0.00 0.00 0.00 0.00 0.00 0.00 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 L 5.69 2.52 0.00 0.54 0.53 0.53 -0.03 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 55 S 7.57 4.10 0.00 3.94 3.98 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 56 S 7.48 4.69 0.00 3.87 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 Q 7.67 3.86 0.00 2.18 1.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.67 7.07 0.00 0.00 0.00 0.00 0.00 2.34 2.50 0.00 58 R 7.48 4.09 0.00 1.68 1.87 0.00 3.09 0.00 0.00 3.03 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.50 0.00 59 S 7.87 4.25 0.00 3.99 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 60 K 7.35 4.19 0.00 1.71 1.96 0.00 1.77 0.00 0.00 1.65 0.00 0.00 2.95 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.65 1.39 7.81 61 N 8.45 4.01 0.00 2.84 2.81 0.00 0.00 6.90 7.76 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 62 S 7.88 4.27 0.00 3.90 3.71 0.00 0.00 0.00 0.00 0.00 0.00 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 S 7.80 4.11 0.00 3.76 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