NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 P 4.5710 0.0000 0.0000 62.7690 33.7665 174.7654 2 M 5.3260 8.4929 119.6204 53.5986 35.8760 173.3212 3 I 4.8747 9.4432 124.6807 59.4821 41.1086 174.4803 4 S 5.1798 8.8186 119.8667 56.6521 66.4974 173.0157 5 C 4.7197 8.8565 121.2075 58.0225 34.4425 172.2196 6 D 5.5484 8.8283 126.9316 53.3754 41.8981 175.7782 7 M 4.3979 8.9357 119.5910 53.5231 35.2759 173.8309 8 A 4.2656 7.6640 121.2000 51.8235 19.0019 177.1783 9 Y 4.5745 7.3201 118.8952 58.2285 38.2397 175.6187 10 G 3.4958 9.0482 114.2661 45.9471 0.0000 174.9427 11 R 4.2850 7.5705 119.2654 55.8527 30.9180 176.9343 12 T 4.2627 8.5482 112.2608 61.2600 71.0194 175.5306 13 D 4.3932 8.5733 120.6920 57.6010 40.7422 179.0771 14 E 3.9565 8.0694 118.5166 59.5383 29.6068 179.1683 15 Q 4.0266 8.2779 118.1939 58.9494 28.6622 179.1328 16 K 4.0769 8.2624 119.5340 59.5532 32.0331 179.7222 17 R 3.9205 8.3299 118.3288 59.0160 29.8569 178.9778 18 A 3.9360 8.0884 120.8398 54.7909 18.2578 179.4782 19 L 3.7866 7.9063 118.9230 58.2601 42.2571 179.1108 20 S 2.8347 8.1743 113.0892 61.0138 62.3234 175.9581 21 A 3.9893 8.0529 123.6575 54.9428 18.0958 179.9301 22 G 3.3877 8.1802 104.3721 47.9994 0.0000 176.0051 23 L 3.9392 7.8928 122.4352 57.2216 41.5029 179.6538 24 L 3.9016 7.7063 118.8903 57.5993 41.5528 179.3978 25 R 3.8163 7.7945 118.5820 59.5370 30.0347 178.7398 26 V 3.5752 7.7837 117.7962 66.0507 31.5456 178.1024 27 I 3.7103 7.8488 119.5204 64.4321 36.9615 178.3940 28 S 4.4679 8.1102 117.4870 61.2114 62.4664 176.8546 29 E 3.9751 8.0800 119.5759 59.3062 29.2891 178.9643 30 A 4.1341 7.9152 119.9700 54.6750 18.5435 178.8662 31 T 4.3983 7.8709 111.9404 62.6005 69.7787 176.0892 32 G 3.8989 7.9488 108.0051 45.4448 0.0000 173.2900 33 E 4.1831 7.7212 121.1939 54.5808 30.6465 174.4429 34 P 4.5232 0.0000 0.0000 62.3988 32.5154 177.1419 35 R 3.8859 8.8344 119.1013 59.6417 30.0352 178.7692 36 E 4.0279 8.2936 113.5968 59.3122 29.1657 177.4594 37 N 4.6920 7.9572 114.1369 53.3103 39.0665 174.4167 38 I 4.7540 7.9223 120.7214 59.4676 39.2149 174.9209 39 F 4.7818 9.1044 129.9796 57.0774 41.1106 174.1812 40 F 5.3743 7.6027 126.8583 56.2965 42.3239 174.0305 41 V 3.9216 7.6883 124.3144 59.7744 34.8307 174.0981 42 I 4.4929 7.8363 124.4943 59.9040 38.7425 175.0162 43 R 4.5992 9.0320 126.5897 54.4269 32.5733 174.9192 44 E 5.5201 8.0894 122.7488 54.0563 32.9769 175.0906 45 G 4.3365 7.8135 107.9136 44.8375 0.0000 172.4765 46 S 5.0809 8.9878 115.0660 57.3221 64.5501 175.3279 47 G 4.0963 8.6441 109.3826 48.1391 0.0000 175.8643 48 I 3.8322 7.9100 118.5097 63.6148 38.0039 176.0495 49 N 4.5745 8.4646 115.9043 53.7440 38.9607 174.7493 50 F 4.5240 8.2711 117.9996 55.2714 41.6626 174.2433 51 V 4.5962 8.3912 124.6874 61.1421 32.7511 174.3409 52 E 4.7054 8.7469 127.0510 56.0384 32.1615 176.1004 53 H 3.7953 10.1861 118.6115 56.8521 26.3613 175.8493 54 G 4.0216 8.8356 105.8152 45.2410 0.0000 173.7637 55 E 4.7728 7.9797 119.2207 54.1729 32.6237 175.3026 56 H 4.8038 8.9112 120.3511 55.8982 29.5646 175.2421 57 L 4.3308 8.6070 123.9373 53.6349 42.3435 176.1959 58 P 4.2605 0.0000 0.0000 64.2580 31.4677 176.0376 59 D 4.2333 7.7725 122.6114 54.3950 41.7570 176.1302 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 P 0.00 4.57 0.00 2.14 2.09 0.00 3.67 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 2.04 2.15 0.00 2 M 8.49 5.33 0.00 2.06 1.99 0.00 0.00 0.00 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.67 0.00 3 I 9.44 4.87 2.28 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 1.14 1.13 0.00 0.00 4 S 8.82 5.18 0.00 3.81 3.85 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 0.00 5 C 8.86 4.72 0.00 3.10 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 6 D 8.83 5.55 0.00 2.72 2.81 0.00 0.00 0.00 0.00 0.00 0.00 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 M 8.94 4.40 0.00 1.97 1.95 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.37 2.44 0.00 8 A 7.66 4.27 0.99 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 9 Y 7.32 4.57 0.00 2.89 2.85 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 0.00 10 G 9.05 3.50 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 0.00 11 R 7.57 4.28 0.00 1.83 2.02 0.00 3.36 0.00 0.00 3.27 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.56 0.00 12 T 8.55 4.26 4.39 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 1.22 0.00 0.00 13 D 8.57 4.39 0.00 2.79 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 14 E 8.07 3.96 0.00 2.05 1.99 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 2.40 2.46 0.00 15 Q 8.28 4.03 0.00 2.32 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.81 0.00 0.00 0.00 0.00 0.00 2.38 2.40 0.00 16 K 8.26 4.08 0.00 1.98 1.93 0.00 1.70 0.00 0.00 1.68 0.00 0.00 2.97 0.00 0.00 3.23 0.00 0.00 0.00 0.00 1.50 1.67 7.81 17 R 8.33 3.92 0.00 2.03 1.96 0.00 3.12 0.00 0.00 3.17 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.84 0.00 18 A 8.09 3.94 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 19 L 7.91 3.79 0.00 1.90 1.91 1.21 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 20 S 8.17 2.83 0.00 3.95 3.85 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 0.00 21 A 8.05 3.99 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 22 G 8.18 3.39 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 0.00 23 L 7.89 3.94 0.00 1.32 1.59 0.98 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 24 L 7.71 3.90 0.00 1.77 1.63 0.79 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 25 R 7.79 3.82 0.00 2.01 2.04 0.00 3.07 0.00 0.00 3.06 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.62 0.00 26 V 7.78 3.58 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 0.96 0.00 0.00 0.92 0.00 0.00 27 I 7.85 3.71 1.87 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.47 0.93 0.00 0.00 28 S 8.11 4.47 0.00 4.11 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 29 E 8.08 3.98 0.00 2.08 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 2.34 2.31 0.00 30 A 7.92 4.13 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 T 7.87 4.40 4.34 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 1.22 0.00 0.00 32 G 7.95 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 0.00 0.00 0.00 33 E 7.72 4.18 0.00 2.07 1.83 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 2.39 2.37 0.00 34 P 0.00 4.52 0.00 2.26 2.17 0.00 3.79 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 2.08 1.99 0.00 35 R 8.83 3.89 0.00 1.89 2.05 0.00 3.14 0.00 0.00 3.37 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.65 0.00 36 E 8.29 4.03 0.00 2.09 2.14 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 2.30 2.38 0.00 37 N 7.96 4.69 0.00 2.92 2.92 0.00 0.00 6.86 7.61 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 38 I 7.92 4.75 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 1.15 0.75 0.97 0.00 0.00 39 F 9.10 4.78 0.00 3.22 2.94 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 40 F 7.60 5.37 0.00 2.83 2.68 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 0.00 0.00 0.00 0.00 41 V 7.69 3.92 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 0.00 0.00 0.86 0.00 0.00 42 I 7.84 4.49 1.75 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.24 0.86 0.00 0.00 43 R 9.03 4.60 0.00 1.83 1.78 0.00 3.23 0.00 0.00 3.15 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.52 0.00 44 E 8.09 5.52 0.00 1.53 1.12 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 2.12 2.01 0.00 45 G 7.81 4.34 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 0.00 46 S 8.99 5.08 0.00 4.18 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 47 G 8.64 4.10 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 0.00 0.00 0.00 48 I 7.91 3.83 1.94 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.82 0.98 0.00 0.00 49 N 8.46 4.57 0.00 2.88 2.59 0.00 0.00 6.78 7.02 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 50 F 8.27 4.52 0.00 3.15 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 51 V 8.39 4.60 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 0.85 0.00 0.00 0.59 0.00 0.00 52 E 8.75 4.71 0.00 2.05 1.83 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 2.31 2.34 0.00 53 H 10.19 3.80 0.00 3.27 3.39 0.00 5.73 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 G 8.84 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 55 E 7.98 4.77 0.00 2.02 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 2.41 0.00 56 H 8.91 4.80 0.00 3.16 3.32 0.00 5.71 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 L 8.61 4.33 0.00 2.01 1.59 0.83 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 58 P 0.00 4.26 0.00 2.19 2.20 0.00 3.83 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.00 0.00 59 D 7.77 4.23 0.00 2.66 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