NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.9583 8.3549 109.7364 45.7359 0.0000 175.2186 2 S 4.6236 9.0578 115.8751 56.0462 63.4821 171.6941 3 S 4.6383 8.3559 112.7827 56.5727 67.1765 171.1279 4 G 3.6522 8.4534 105.7518 43.9062 0.0000 174.0170 5 S 4.2563 8.6423 120.7453 60.7481 63.7602 174.5128 6 S 4.6667 8.3604 116.4364 56.7812 64.9790 172.8068 7 G 3.4518 7.9930 110.6169 46.3666 0.0000 172.3650 8 R 4.6696 7.2769 116.6124 53.2833 34.3546 176.2469 9 V 3.5245 8.2865 118.2851 63.4836 31.6382 174.9857 10 K 4.4775 8.3541 126.9856 54.1799 33.9424 175.5921 11 Q 4.1421 8.7533 125.6109 56.6238 29.1022 176.5614 12 L 4.6985 8.1542 119.8436 55.7109 41.2945 177.9660 13 T 3.9768 8.3239 117.3932 67.7784 68.4512 174.3296 14 D 4.5185 7.9947 118.3048 54.9743 41.7478 175.2451 15 E 4.5131 8.7699 121.2717 57.4679 32.0866 175.8333 16 E 4.8188 7.6305 115.7437 54.7901 33.7580 173.9494 17 E 4.5480 8.4409 115.2065 55.2013 31.9087 174.7479 18 C 4.1345 8.2142 120.4106 59.4167 32.3199 174.0996 19 C 4.2413 7.7224 120.1549 61.2523 28.4286 175.4571 20 I 3.8409 7.0155 120.0967 63.7026 37.3606 176.7823 21 C 4.1586 7.9792 116.2752 59.6285 30.8699 173.6978 22 M 3.3923 7.9122 116.2395 55.6547 29.4683 176.2396 23 D 4.4473 8.0250 120.2116 56.0270 42.3272 175.1906 24 G 4.2096 7.5152 107.5076 45.8152 0.0000 173.1437 25 R 4.9484 8.1438 115.4351 52.7216 33.9666 174.1264 26 A 4.7728 8.1704 121.4602 50.3187 21.3032 176.3847 27 D 4.4820 8.8418 122.4678 56.8304 41.5576 175.4566 28 L 4.7850 7.5704 116.5798 54.7922 44.4828 174.6991 29 I 4.7894 8.1175 118.4938 59.7561 41.2476 175.1129 30 L 4.8409 8.8436 125.9043 52.4091 44.0482 175.7802 31 P 4.5230 0.0000 0.0000 64.1702 31.2527 176.4060 32 C 4.5115 7.8342 112.4064 57.7452 29.9488 173.2249 33 A 3.5697 7.8033 119.7088 54.0531 15.6955 178.7629 34 H 4.9408 7.9506 117.3199 55.1238 32.9889 173.9648 35 S 5.3077 8.2357 117.5380 56.7943 66.7833 173.0811 36 F 5.1010 8.5242 118.7923 56.3922 43.6188 174.5622 37 C 4.6941 8.8670 118.3720 57.2686 31.2062 174.2697 38 Q 3.9816 8.8260 120.4957 59.7253 28.2272 177.9558 39 K 3.8229 8.2352 117.0405 60.6710 32.2596 178.2721 40 C 4.3678 8.2549 115.7077 62.9056 27.6403 176.0837 41 I 3.6930 8.2406 121.0731 64.8299 36.6583 177.8197 42 D 4.5466 8.5069 117.5442 57.0274 41.1279 177.6095 43 K 4.2553 8.0738 119.4147 58.5570 32.5545 177.1820 44 W 4.1090 7.7090 122.7186 56.7228 27.7995 176.3882 45 S 4.2348 8.6508 119.4247 62.0254 62.4396 176.8938 46 D 4.7248 7.9106 123.3658 53.9652 38.6999 175.7580 47 R 4.4213 7.9720 119.8353 55.9383 30.5775 177.1711 48 H 4.1165 8.2172 117.7900 57.0499 30.2690 175.9999 49 R 3.8109 8.2814 123.8795 59.2558 30.1506 177.0874 50 N 4.2564 7.5967 113.8483 53.7730 39.2596 173.7262 51 C 4.2723 8.3682 121.9841 57.6500 33.2433 172.4402 52 P 3.9527 0.0000 0.0000 66.1871 30.8369 178.3363 53 I 3.5929 7.6912 118.3101 64.1490 37.2615 177.4552 54 C 4.2252 8.0947 116.3849 63.1271 27.8960 175.9223 55 R 3.8586 7.5736 118.5832 59.7830 29.5977 177.6374 56 L 4.0526 7.5597 116.8212 56.5695 42.1289 178.0925 57 Q 3.3593 8.2865 115.2781 56.9330 26.6345 174.4556 58 M 4.1423 8.1309 117.5063 55.9900 31.9364 175.3080 59 T 3.5798 8.4325 125.1173 64.4490 67.9950 173.7617 60 G 3.6276 8.6266 112.4455 46.3314 0.0000 176.4432 61 A 4.5979 8.7756 118.8375 49.6730 22.8689 176.6413 62 N 4.2872 8.6386 117.7272 54.1131 38.3817 174.8225 63 E 4.4338 8.3550 125.5024 54.9503 32.3184 175.3875 64 S 4.5661 8.6343 121.0965 57.5119 63.7472 172.7278 65 S 4.4207 8.8134 117.7102 60.5997 64.2130 173.2116 66 G 4.1385 8.1802 105.8934 42.8552 0.0000 171.7192 67 P 4.4807 0.0000 0.0000 62.0064 32.3164 175.6602 68 S 4.5377 8.1820 112.2256 56.3265 64.0524 174.1290 69 S 4.0477 8.8026 120.5719 60.6231 63.2882 174.5774 70 G 4.2122 7.9751 114.4133 45.1194 0.0000 173.1071 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 3.96 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 0.00 0.00 0.00 2 S 9.06 4.62 0.00 3.94 3.88 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 0.00 0.00 0.00 3 S 8.36 4.64 0.00 3.90 3.78 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 4 G 8.45 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 5 S 8.64 4.26 0.00 3.99 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 6 S 8.36 4.67 0.00 3.87 3.81 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 G 7.99 3.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 7.28 4.67 0.00 1.76 1.82 0.00 3.40 0.00 0.00 3.15 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.51 0.00 9 V 8.29 3.52 2.08 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 0.71 0.00 0.00 0.93 0.00 0.00 10 K 8.35 4.48 0.00 1.68 1.65 0.00 1.74 0.00 0.00 1.70 0.00 0.00 3.08 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.29 1.47 7.81 11 Q 8.75 4.14 0.00 2.08 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 7.31 0.00 0.00 0.00 0.00 0.00 2.37 2.31 0.00 12 L 8.15 4.70 0.00 1.71 1.73 0.92 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 13 T 8.32 3.98 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 14 D 7.99 4.52 0.00 2.61 2.59 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 15 E 8.77 4.51 0.00 1.93 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 2.19 2.46 0.00 16 E 7.63 4.82 0.00 1.92 1.76 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 2.27 2.20 0.00 17 E 8.44 4.55 0.00 2.00 2.01 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 2.11 2.21 0.00 18 C 8.21 4.13 0.00 2.96 2.93 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 19 C 7.72 4.24 0.00 2.60 2.73 0.00 0.00 0.00 0.00 0.00 0.00 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 I 7.02 3.84 1.95 0.00 0.00 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 1.55 0.41 1.07 0.00 0.00 21 C 7.98 4.16 0.00 3.10 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 22 M 7.91 3.39 0.00 2.15 2.12 0.00 0.00 0.00 0.00 0.00 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.63 0.00 23 D 8.03 4.45 0.00 2.69 2.66 0.00 0.00 0.00 0.00 0.00 0.00 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 G 7.52 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 0.00 0.00 0.00 0.00 25 R 8.14 4.95 0.00 1.76 1.81 0.00 3.21 0.00 0.00 2.25 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.54 0.00 26 A 8.17 4.77 1.20 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 0.00 0.00 27 D 8.84 4.48 0.00 2.72 2.93 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 28 L 7.57 4.78 0.00 1.90 1.75 1.06 0.80 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 29 I 8.12 4.79 1.89 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 1.34 0.68 0.92 0.00 0.00 30 L 8.84 4.84 0.00 1.85 1.63 1.01 0.82 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 31 P 0.00 4.52 0.00 2.17 2.16 0.00 3.74 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.95 0.00 32 C 7.83 4.51 0.00 3.00 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 7.80 3.57 1.31 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 0.00 0.00 34 H 7.95 4.94 0.00 3.21 3.21 0.00 5.60 0.00 0.00 0.00 0.00 6.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 S 8.24 5.31 0.00 4.06 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 36 F 8.52 5.10 0.00 2.93 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 37 C 8.87 4.69 0.00 3.14 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 38 Q 8.83 3.98 0.00 2.21 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.11 6.86 0.00 0.00 0.00 0.00 0.00 2.45 2.55 0.00 39 K 8.24 3.82 0.00 1.81 1.90 0.00 1.86 0.00 0.00 1.73 0.00 0.00 3.06 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.49 1.54 7.81 40 C 8.25 4.37 0.00 3.16 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 41 I 8.24 3.69 2.09 0.00 0.00 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 1.39 1.12 0.91 0.00 0.00 42 D 8.51 4.55 0.00 2.71 2.93 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 43 K 8.07 4.26 0.00 2.02 1.99 0.00 1.51 0.00 0.00 1.54 0.00 0.00 2.86 0.00 0.00 2.69 0.00 0.00 0.00 0.00 1.42 1.60 7.81 44 W 7.71 4.11 0.00 3.46 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 45 S 8.65 4.23 0.00 3.88 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 46 D 7.91 4.72 0.00 2.77 2.69 0.00 0.00 0.00 0.00 0.00 0.00 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 R 7.97 4.42 0.00 1.89 2.17 0.00 3.23 0.00 0.00 3.26 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.55 0.00 48 H 8.22 4.12 0.00 3.15 3.20 0.00 5.71 0.00 0.00 0.00 0.00 6.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 R 8.28 3.81 0.00 1.71 1.96 0.00 3.22 0.00 0.00 3.12 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.57 0.00 50 N 7.60 4.26 0.00 2.71 2.74 0.00 0.00 6.89 8.09 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 51 C 8.37 4.27 0.00 2.93 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 52 P 0.00 3.95 0.00 1.74 1.42 0.00 3.39 0.00 0.00 3.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.31 0.00 53 I 7.69 3.59 1.60 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.48 0.77 0.00 0.00 54 C 8.09 4.23 0.00 2.98 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 55 R 7.57 3.86 0.00 1.89 2.21 0.00 3.26 0.00 0.00 3.22 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.71 0.00 56 L 7.56 4.05 0.00 1.84 1.75 0.97 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 57 Q 8.29 3.36 0.00 2.16 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 7.02 0.00 0.00 0.00 0.00 0.00 2.53 2.42 0.00 58 M 8.13 4.14 0.00 1.99 2.02 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.51 0.00 59 T 8.43 3.58 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 60 G 8.63 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.78 4.60 1.19 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 0.00 0.00 62 N 8.64 4.29 0.00 2.68 2.79 0.00 0.00 6.78 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 63 E 8.36 4.43 0.00 1.93 1.82 0.00 0.00 0.00 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 2.26 0.00 64 S 8.63 4.57 0.00 3.85 3.81 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 65 S 8.81 4.42 0.00 3.78 3.81 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 66 G 8.18 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 0.00 0.00 0.00 67 P 0.00 4.48 0.00 2.19 2.11 0.00 3.71 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.95 0.00 68 S 8.18 4.54 0.00 3.94 3.88 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 0.00 0.00 0.00 69 S 8.80 4.05 0.00 4.00 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 70 G 7.98 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 0.00 0.00 0.00 0.00