NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.9605 8.3549 109.7330 44.8646 0.0000 174.9933 2 S 4.4344 8.7406 111.0403 55.2676 67.7325 171.9673 3 S 4.3784 8.3082 116.3581 57.3543 65.6322 173.5758 4 G 3.6640 8.5095 112.9375 45.5063 0.0000 172.8011 5 S 4.4858 8.9417 115.6907 59.6862 63.8424 175.2208 6 S 4.5065 8.3715 119.7499 56.6744 64.2818 173.0853 7 G 4.2912 8.1968 113.6221 43.0031 0.0000 171.3689 8 C 4.5148 7.9619 120.7986 59.0142 32.2061 174.0867 9 H 4.0176 7.5076 124.9753 57.9793 29.3647 175.5034 10 Q 3.9678 7.3076 118.3113 59.6467 29.3554 177.2060 11 C 4.2643 7.9321 113.9097 61.3733 30.9303 173.9420 12 G 4.5034 8.7591 109.6714 45.0212 0.0000 174.0287 13 E 4.1294 8.3414 118.5769 56.4692 30.8250 176.7483 14 F 4.6306 8.7684 124.3357 58.2836 40.3929 174.6201 15 I 4.1508 6.6879 126.7266 60.5528 37.9482 175.5735 16 I 4.2512 8.4512 127.1159 62.2601 38.6952 174.2213 17 G 4.2029 8.3946 120.0989 43.7768 0.0000 172.0818 18 R 4.5305 7.6626 119.8722 53.4838 32.5076 174.9274 19 V 4.2085 8.3717 126.4280 61.1666 33.6491 175.1110 20 I 4.1367 8.6393 130.6902 60.2564 37.8042 175.3997 21 K 4.8331 8.5286 127.5606 55.8058 32.6719 176.6524 22 A 4.2854 9.6357 127.0363 51.5700 22.0254 175.0778 23 M 3.4725 9.5297 115.6436 56.2807 29.8993 176.8287 24 N 4.2842 8.5345 110.8118 53.9282 36.1066 173.6926 25 N 4.6407 8.5794 112.8133 52.4812 43.6003 174.1687 26 S 5.0591 7.9094 114.7498 57.8438 65.2680 173.0340 27 W 5.2664 8.8455 120.7652 55.9337 34.2613 173.5149 28 H 5.1619 8.8562 117.6541 54.2754 29.9345 175.0522 29 P 4.6464 0.0000 0.0000 64.0546 31.3406 176.5645 30 E 4.6425 7.9533 115.1792 56.8847 31.5923 177.2281 31 C 4.2890 8.2773 116.6503 62.7922 28.6173 174.6104 32 F 4.4394 8.1057 126.8579 58.4421 36.7640 173.9598 33 R 4.8076 7.4460 123.5121 53.0361 33.7197 174.9936 34 C 4.0505 7.9320 119.5770 60.0319 31.8590 173.3972 35 D 4.8125 7.9986 120.5782 53.9729 41.2053 176.5955 36 L 4.6650 7.7916 116.3613 55.7573 44.1813 176.6676 37 C 4.6547 7.7471 108.9531 56.6157 31.2353 173.2471 38 Q 4.0025 7.7268 117.6691 56.0426 25.9418 173.0024 39 E 4.4838 7.5372 117.8535 54.1617 32.1574 175.1187 40 V 3.7094 8.4975 126.4749 63.3505 31.9442 176.3538 41 L 4.7199 8.4149 132.1301 54.5930 40.1846 177.6361 42 A 4.4860 8.1958 122.9699 54.3845 19.4243 178.6647 43 D 4.6925 8.0485 114.7871 56.4170 41.8196 179.2196 44 I 3.7835 7.6789 110.8149 62.1007 37.6738 176.7066 45 G 4.1079 8.1589 106.1505 44.8492 0.0000 171.4234 46 F 5.1663 8.0622 112.6838 54.9310 41.7749 174.4208 47 V 4.0504 9.0465 118.1125 60.6729 34.1892 174.6224 48 K 4.3743 8.5383 128.4659 56.5739 32.6979 176.5121 49 N 4.7315 9.2349 123.1164 53.5472 42.1577 173.8877 50 A 3.9041 9.7777 127.2506 53.0652 16.3460 176.7083 51 G 4.0057 8.4524 103.5077 48.1447 0.0000 174.6491 52 R 4.5867 8.3424 117.7051 53.9887 33.9653 174.2753 53 H 4.8336 8.6323 117.4417 55.0180 29.8890 174.0766 54 L 4.8818 8.5184 122.9619 52.7185 46.1923 175.1941 55 C 4.8025 8.2947 114.4287 57.2175 31.8905 175.0886 56 R 3.8905 8.6616 120.8693 59.5390 29.5391 176.5664 57 P 4.1865 0.0000 0.0000 66.8684 31.5712 177.9477 58 C 4.1444 8.1078 114.4925 62.7568 28.2109 175.5299 59 H 3.9981 8.5718 119.3777 59.7624 29.6707 176.9360 60 N 4.1862 8.5126 118.4266 56.3959 38.1157 177.6752 61 R 3.9424 8.2404 118.7927 59.3663 30.1770 178.6362 62 E 4.1020 8.0238 117.5448 58.9653 29.8108 178.7496 63 K 4.1306 8.5448 119.3204 58.7805 32.4960 175.9674 64 A 3.8329 7.4803 122.2258 51.8251 17.9364 177.2902 65 S 4.2175 8.7586 119.2409 58.8887 63.5262 174.6071 66 G 4.0760 8.4918 113.9676 44.1220 0.0000 171.8943 67 P 4.2333 0.0000 0.0000 64.8665 31.6220 176.6758 68 S 4.4013 7.8059 114.8457 56.9588 61.7581 172.7477 69 S 4.5115 8.2179 119.1821 55.7037 64.0760 174.1368 70 G 3.7786 8.7560 115.8656 45.9356 0.0000 172.4075 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 8.74 4.43 0.00 3.87 3.69 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 3 S 8.31 4.38 0.00 3.81 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 4 G 8.51 3.66 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 0.00 0.00 0.00 5 S 8.94 4.49 0.00 4.04 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 6 S 8.37 4.51 0.00 3.71 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 7 G 8.20 4.29 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 0.00 8 C 7.96 4.51 0.00 2.60 2.84 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 9 H 7.51 4.02 0.00 1.94 1.37 0.00 6.01 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 10 Q 7.31 3.97 0.00 2.52 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.51 6.88 0.00 0.00 0.00 0.00 0.00 2.52 2.56 0.00 11 C 7.93 4.26 0.00 3.15 3.08 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 0.00 0.00 0.00 0.00 12 G 8.76 4.50 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 13 E 8.34 4.13 0.00 2.02 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 2.45 2.32 0.00 14 F 8.77 4.63 0.00 2.96 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 15 I 6.69 4.15 1.49 0.00 0.00 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.69 0.35 0.82 0.00 0.00 16 I 8.45 4.25 1.91 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 1.57 0.87 0.96 0.00 0.00 17 G 8.39 4.20 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 0.00 18 R 7.66 4.53 0.00 1.80 1.82 0.00 3.20 0.00 0.00 3.17 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.59 0.00 19 V 8.37 4.21 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 0.90 0.00 0.00 0.76 0.00 0.00 20 I 8.64 4.14 1.91 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 1.22 0.81 0.00 0.00 21 K 8.53 4.83 0.00 1.64 1.76 0.00 1.78 0.00 0.00 1.72 0.00 0.00 3.10 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.42 1.39 7.81 22 A 9.64 4.29 -0.71 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 0.00 0.00 23 M 9.53 3.47 0.00 2.23 2.27 0.00 0.00 0.00 0.00 0.00 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 2.61 0.00 24 N 8.53 4.28 0.00 2.92 2.95 0.00 0.00 7.01 8.04 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 25 N 8.58 4.64 0.00 2.89 2.24 0.00 0.00 6.90 7.37 0.00 0.00 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 S 7.91 5.06 0.00 3.74 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 27 W 8.85 5.27 0.00 3.05 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 28 H 8.86 5.16 0.00 3.20 3.24 0.00 5.64 0.00 0.00 0.00 0.00 6.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 P 0.00 4.65 0.00 2.21 2.21 0.00 3.81 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 1.99 0.00 30 E 7.95 4.64 0.00 2.07 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 0.00 2.18 2.32 0.00 31 C 8.28 4.29 0.00 3.23 3.29 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 32 F 8.11 4.44 0.00 2.87 2.88 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 33 R 7.45 4.81 0.00 1.69 1.75 0.00 3.44 0.00 0.00 3.13 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.75 0.00 34 C 7.93 4.05 0.00 2.86 2.87 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 35 D 8.00 4.81 0.00 2.79 2.64 0.00 0.00 0.00 0.00 0.00 0.00 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 L 7.79 4.66 0.00 1.60 1.62 0.95 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 37 C 7.75 4.65 0.00 3.00 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 38 Q 7.73 4.00 0.00 2.16 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.76 0.00 0.00 0.00 0.00 0.00 2.24 2.21 0.00 39 E 7.54 4.48 0.00 2.00 1.74 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 2.26 2.25 0.00 40 V 8.50 3.71 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 0.92 0.00 0.00 0.93 0.00 0.00 41 L 8.41 4.72 0.00 1.30 1.78 0.12 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 42 A 8.20 4.49 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 D 8.05 4.69 0.00 2.81 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 44 I 7.68 3.78 1.88 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.55 0.92 0.00 0.00 45 G 8.16 4.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 F 8.06 5.17 0.00 2.91 2.89 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 47 V 9.05 4.05 1.94 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 0.50 0.00 0.00 0.87 0.00 0.00 48 K 8.54 4.37 0.00 1.67 1.79 0.00 1.95 0.00 0.00 1.81 0.00 0.00 2.80 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.77 1.53 7.81 49 N 9.23 4.73 0.00 2.73 2.61 0.00 0.00 6.86 8.03 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 50 A 9.78 3.90 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.45 4.01 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 0.00 0.00 0.00 52 R 8.34 4.59 0.00 1.90 1.79 0.00 3.13 0.00 0.00 3.41 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.74 0.00 53 H 8.63 4.83 0.00 2.64 3.25 0.00 5.59 0.00 0.00 0.00 0.00 6.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 L 8.52 4.88 0.00 1.53 1.55 0.95 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 55 C 8.29 4.80 0.00 2.96 2.98 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 R 8.66 3.89 0.00 1.84 2.03 0.00 3.34 0.00 0.00 3.34 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.71 0.00 57 P 0.00 4.19 0.00 2.00 2.08 0.00 3.63 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.19 0.00 58 C 8.11 4.14 0.00 2.95 2.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 H 8.57 4.00 0.00 3.22 3.49 0.00 5.79 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 60 N 8.51 4.19 0.00 3.00 2.80 0.00 0.00 7.08 7.20 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 61 R 8.24 3.94 0.00 1.86 1.97 0.00 3.15 0.00 0.00 3.21 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.87 0.00 62 E 8.02 4.10 0.00 2.03 1.97 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 2.51 2.31 0.00 63 K 8.54 4.13 0.00 1.84 1.95 0.00 1.61 0.00 0.00 1.43 0.00 0.00 3.12 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.40 1.37 7.81 64 A 7.48 3.83 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.76 4.22 0.00 3.86 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 8.49 4.08 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 67 P 0.00 4.23 0.00 2.18 2.19 0.00 3.75 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.98 0.00 68 S 7.81 4.40 0.00 3.87 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 8.22 4.51 0.00 3.76 3.72 0.00 0.00 0.00 0.00 0.00 0.00 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 8.76 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 0.00 0.00 0.00