NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 P 4.4221 0.0000 0.0000 61.9752 32.6590 176.2135 2 K 4.0636 8.4913 120.6576 55.8775 32.6595 175.5973 3 I 3.9182 9.1901 124.7573 61.3197 38.6206 175.5384 4 K 4.3372 8.5127 124.5776 55.5344 32.7642 176.7083 5 T 4.1573 8.4353 114.9656 60.9956 69.6809 175.6389 6 V 3.8368 8.4144 126.6500 62.5241 29.2957 176.2184 7 R 3.9146 8.3984 123.1368 59.1815 29.7038 178.0330 8 G 4.0249 8.0210 104.1729 48.0190 0.0000 175.2946 9 A 4.2242 8.1286 123.3641 54.6411 18.3034 179.1823 10 A 4.3129 7.8493 115.6012 53.5290 18.3432 177.8990 11 K 4.5719 7.4965 115.3288 56.3222 32.6958 176.9889 12 R 4.4679 8.4860 115.4173 55.7338 32.0898 174.2131 13 F 4.9101 7.5714 115.3911 56.6384 43.3321 174.5201 14 K 4.4666 9.2063 114.7204 55.2553 34.8184 172.6848 15 K 3.5471 8.9951 125.9742 56.9243 32.5292 176.0825 16 T 4.4078 9.0089 119.4456 60.4541 71.1724 173.9653 17 G 4.0305 8.7869 108.9805 48.6726 0.0000 173.1298 18 K 4.3575 7.3824 119.9541 55.3938 33.9237 176.0218 19 G 3.8892 9.1419 105.4651 49.0263 0.0000 173.6022 20 G 4.1477 7.6927 109.6081 44.9825 0.0000 173.5778 21 F 4.6961 8.7195 116.3140 54.7666 41.7105 171.9706 22 K 4.1890 8.5622 128.1095 55.8636 33.5464 174.0485 23 H 4.8646 9.2476 123.2717 54.5227 29.4814 172.0769 24 K 4.6152 8.4659 118.7388 54.5975 35.0433 176.3629 25 H 4.4029 8.7247 122.4468 56.0142 29.2050 175.0469 26 A 4.5555 8.2892 124.4248 52.1652 21.2043 177.5240 27 N 4.2581 8.8311 113.8970 54.2239 36.5959 174.7729 28 L 4.8415 6.9246 117.9369 53.6169 42.0762 176.1343 29 R 4.5928 7.1652 106.5303 55.7160 30.6410 173.8374 30 H 4.3024 8.8396 114.6861 58.2760 32.3778 173.8297 31 I 3.2722 8.3807 119.8122 62.2625 35.6453 172.5711 32 L 4.5240 7.5751 123.5754 55.2922 43.9018 178.6240 33 T 3.8410 8.1346 112.6149 64.6210 67.2456 174.2382 34 K 4.6176 7.7265 119.2125 56.3615 33.1113 176.3658 35 K 4.4569 7.8535 117.0573 54.4080 36.1700 176.8815 36 A 3.9433 8.7193 124.7010 52.8928 19.0050 178.2914 37 T 3.8248 8.7262 115.9407 65.4788 68.2342 176.2242 38 K 3.8407 7.8614 120.8362 59.1723 32.5392 177.9809 39 R 3.9695 7.9063 118.5557 59.7708 29.6352 178.4105 40 K 4.0076 8.0922 117.8818 59.2993 31.8828 179.2160 41 R 3.6351 8.1510 118.1041 58.7606 30.0125 177.0195 42 H 4.7991 7.7022 113.2701 56.1624 29.4992 175.4454 43 L 4.4799 8.6806 121.4692 55.7533 42.5940 178.3206 44 R 4.1281 8.0916 117.5513 57.7825 30.2651 175.3090 45 P 4.4896 0.0000 0.0000 62.6573 32.1045 175.0306 46 K 4.6646 8.2512 117.6603 54.8978 33.8689 175.9599 47 A 4.8054 7.6960 124.0808 50.0818 22.6308 175.7128 48 M 4.7229 8.5750 119.3588 54.8709 33.5108 176.8940 49 V 3.9816 8.4785 113.5262 61.3567 32.4328 177.7725 50 S 4.2092 8.7699 115.4099 58.7953 62.5877 176.2651 51 K 3.8879 7.9449 119.8772 57.5140 32.3909 176.1515 52 G 3.8734 8.3585 106.2154 47.3025 0.0000 174.4307 53 D 4.7371 7.5645 117.1674 53.7846 42.5234 177.9282 54 L 3.9065 8.2538 121.6948 58.3157 41.5965 178.6376 55 G 3.9297 8.0729 103.4578 48.0415 0.0000 174.7669 56 L 4.0392 7.7956 121.7368 57.3807 41.6275 179.5107 57 V 3.0552 7.5459 117.3612 65.8768 31.5230 178.4679 58 I 4.1025 7.2036 118.1373 60.2688 35.9079 176.2363 59 A 4.6119 7.4840 119.6314 52.9169 25.1463 177.7011 60 C 4.3936 8.1297 113.1888 60.4047 29.6292 173.4423 61 L 5.2220 7.1985 118.4767 52.2410 41.5082 175.3083 62 P 4.1428 0.0000 0.0000 65.4223 31.9373 177.4740 63 Y 4.4460 7.9363 113.0164 57.5746 38.0950 175.3412 64 A 4.3179 8.2311 129.6968 52.5593 18.5856 178.1171 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 4.42 0.00 2.21 2.13 0.00 3.75 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 1.90 2.01 0.00 2 K 8.49 4.06 0.00 1.88 1.95 0.00 1.76 0.00 0.00 1.73 0.00 0.00 2.92 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.50 1.54 7.81 3 I 9.19 3.92 2.00 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.51 0.95 0.00 0.00 4 K 8.51 4.34 0.00 1.77 1.77 0.00 1.75 0.00 0.00 1.76 0.00 0.00 3.02 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.44 1.44 7.81 5 T 8.44 4.16 4.30 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 1.40 0.00 0.00 6 V 8.41 3.84 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 0.96 0.00 0.00 0.97 0.00 0.00 7 R 8.40 3.91 0.00 1.95 1.98 0.00 3.37 0.00 0.00 3.39 7.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.82 0.00 8 G 8.02 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 9 A 8.13 4.22 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 10 A 7.85 4.31 1.40 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 0.00 0.00 11 K 7.50 4.57 0.00 1.90 1.80 0.00 1.67 0.00 0.00 1.71 0.00 0.00 2.99 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.39 1.60 7.81 12 R 8.49 4.47 0.00 1.03 1.42 0.00 3.19 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 1.45 1.62 0.00 13 F 7.57 4.91 0.00 2.91 2.96 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 0.00 0.00 0.00 14 K 9.21 4.47 0.00 1.89 1.73 0.00 1.73 0.00 0.00 1.60 0.00 0.00 2.81 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.30 1.48 7.81 15 K 9.00 3.55 0.00 1.59 1.60 0.00 1.67 0.00 0.00 1.60 0.00 0.00 2.69 0.00 0.00 2.67 0.00 0.00 0.00 0.00 1.15 0.41 7.81 16 T 9.01 4.41 4.21 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 0.00 0.00 0.00 1.22 0.00 0.00 17 G 8.79 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 18 K 7.38 4.36 0.00 1.72 1.65 0.00 1.56 0.00 0.00 1.67 0.00 0.00 3.10 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.29 1.36 7.81 19 G 9.14 3.89 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 0.00 0.00 0.00 0.00 0.00 0.00 20 G 7.69 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 0.00 0.00 0.00 21 F 8.72 4.70 0.00 3.26 3.36 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 22 K 8.56 4.19 0.00 1.92 1.84 0.00 1.70 0.00 0.00 1.75 0.00 0.00 3.01 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.32 1.53 7.81 23 H 9.25 4.86 0.00 3.07 3.12 0.00 5.45 0.00 0.00 0.00 0.00 6.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 K 8.47 4.62 0.00 1.61 1.62 0.00 1.79 0.00 0.00 1.70 0.00 0.00 2.87 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.27 1.34 7.81 25 H 8.72 4.40 0.00 3.38 3.21 0.00 5.74 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 26 A 8.29 4.56 1.27 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 0.00 0.00 27 N 8.83 4.26 0.00 2.86 2.90 0.00 0.00 6.51 7.85 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 28 L 6.92 4.84 0.00 1.70 1.59 0.93 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 0.00 0.00 0.00 0.00 29 R 7.17 4.59 0.00 1.89 1.92 0.00 3.15 0.00 0.00 3.15 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 1.49 0.00 30 H 8.84 4.30 0.00 3.06 3.13 0.00 5.86 0.00 0.00 0.00 0.00 6.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31 I 8.38 3.27 1.86 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.84 0.84 0.00 0.00 32 L 7.58 4.52 0.00 1.73 1.67 0.93 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 33 T 8.13 3.84 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 34 K 7.73 4.62 0.00 1.89 1.86 0.00 1.56 0.00 0.00 1.70 0.00 0.00 3.01 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.33 1.44 7.81 35 K 7.85 4.46 0.00 1.89 1.68 0.00 1.81 0.00 0.00 1.70 0.00 0.00 3.03 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.35 1.35 7.81 36 A 8.72 3.94 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 37 T 8.73 3.82 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 38 K 7.86 3.84 0.00 1.73 1.82 0.00 1.76 0.00 0.00 1.57 0.00 0.00 2.95 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.23 1.30 7.81 39 R 7.91 3.97 0.00 1.87 2.10 0.00 3.21 0.00 0.00 3.32 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.72 0.00 40 K 8.09 4.01 0.00 1.86 1.84 0.00 1.73 0.00 0.00 1.57 0.00 0.00 2.92 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.45 1.67 7.81 41 R 8.15 3.64 0.00 1.97 2.21 0.00 3.26 0.00 0.00 3.24 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.71 0.00 42 H 7.70 4.80 0.00 3.24 3.28 0.00 5.70 0.00 0.00 0.00 0.00 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 L 8.68 4.48 0.00 1.56 1.73 0.91 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 44 R 8.09 4.13 0.00 1.79 2.02 0.00 3.22 0.00 0.00 3.28 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.72 0.00 45 P 0.00 4.49 0.00 2.18 2.07 0.00 3.66 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 1.99 0.00 46 K 8.25 4.66 0.00 1.62 1.93 0.00 1.85 0.00 0.00 1.68 0.00 0.00 2.89 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.34 1.35 7.81 47 A 7.70 4.81 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 48 M 8.57 4.72 0.00 1.98 2.07 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 2.53 0.00 49 V 8.48 3.98 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 1.16 0.00 0.00 1.14 0.00 0.00 50 S 8.77 4.21 0.00 4.03 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 51 K 7.94 3.89 0.00 1.95 1.96 0.00 1.72 0.00 0.00 1.74 0.00 0.00 3.10 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.37 1.44 7.81 52 G 8.36 3.87 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 0.00 53 D 7.56 4.74 0.00 2.84 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 54 L 8.25 3.91 0.00 1.79 1.72 1.09 1.12 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 55 G 8.07 3.93 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 L 7.80 4.04 0.00 1.90 1.63 0.88 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 57 V 7.55 3.06 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.66 0.00 0.00 0.55 0.00 0.00 58 I 7.20 4.10 1.85 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.81 1.02 0.00 0.00 59 A 7.48 4.61 1.22 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 0.00 0.00 60 C 8.13 4.39 0.00 2.83 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 61 L 7.20 5.22 0.00 1.67 1.60 0.75 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 62 P 0.00 4.14 0.00 1.96 2.01 0.00 3.72 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.19 0.00 63 Y 7.94 4.45 0.00 3.00 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 64 A 8.23 4.32 1.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00