NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.9137 8.3393 109.7332 44.8476 0.0000 175.6127 2 P 4.1925 0.0000 0.0000 62.8205 32.9852 173.8243 3 E 4.0137 9.1701 116.9044 57.1486 27.8077 175.2565 4 T 4.4295 7.5587 110.4816 62.0859 72.1834 175.8951 5 L 3.6528 9.1001 129.0651 54.9805 39.9435 176.9314 6 C 6.2992 8.4601 135.0000 58.3364 43.5834 172.8416 7 G 4.1742 7.5064 105.8083 44.6462 0.0000 171.9899 8 A 4.4033 7.8289 122.6916 53.2237 21.0216 178.3357 9 E 4.4681 8.0488 113.3462 56.2742 30.1537 175.9790 10 L 4.4797 7.6133 116.3423 56.4260 43.5001 178.6996 11 V 3.4576 7.5103 117.3924 66.0757 31.5157 177.3166 12 D 4.3969 7.7766 116.5247 56.3479 40.9965 178.0508 13 A 4.0779 7.7539 121.2775 55.4764 18.5454 179.4833 14 L 3.9956 7.7461 117.0975 57.8011 41.4787 179.2813 15 Q 3.8257 7.6647 115.6324 57.0968 28.7360 176.2729 16 F 5.0887 7.8114 119.5280 57.4793 40.8245 174.8476 17 V 3.8042 7.9118 118.1997 63.9175 32.5832 175.5327 18 C 4.4503 8.5181 118.4986 56.8223 45.5815 172.2534 19 G 4.0176 7.7361 104.5273 44.6353 0.0000 175.2928 20 D 5.1038 8.0999 118.9779 52.4680 42.5697 175.8233 21 R 5.4782 6.1907 131.9519 54.8866 31.1125 173.3986 22 G 3.8073 6.5358 119.5067 46.4065 0.0000 169.9116 23 F 3.6448 5.7510 118.0684 56.3414 36.6909 174.7734 24 Y 4.5039 7.7071 125.9606 56.1799 36.4114 172.2140 25 F 4.3973 8.8022 126.0195 59.0238 38.7239 173.4662 26 N 4.1255 8.8135 124.4922 53.5865 37.8326 176.2160 27 K 3.8651 8.1240 118.3618 58.3818 32.2474 175.9676 28 P 4.2853 0.0000 0.0000 62.6493 29.8569 171.1993 29 T 3.1836 8.2875 121.3232 61.2858 70.6841 172.3412 30 G 4.6936 7.6893 114.3827 45.4531 0.0000 174.0686 31 Y 4.6634 8.4170 108.2938 55.8358 40.3291 173.9978 32 G 4.0183 8.6919 107.6649 44.2041 0.0000 171.6461 33 S 3.4963 8.7117 111.7389 59.1520 61.3951 168.6949 34 S 3.6067 8.6631 119.7316 59.4928 63.7888 172.1144 35 S 4.3143 8.6111 117.2950 59.6548 61.2292 166.7220 36 R 3.5925 8.5906 124.2832 56.7722 26.0318 175.9367 37 R 3.6616 8.2431 124.4222 56.0573 30.7806 175.3932 38 A 4.5713 7.7378 117.0231 50.7997 19.9872 177.4059 39 P 4.5029 0.0000 0.0000 60.5966 29.4911 174.5175 40 Q 5.2583 8.3237 128.8485 58.6388 29.2837 175.2338 41 T 3.2504 8.3978 121.0784 62.9201 67.1618 172.5702 42 G 3.9716 7.5037 109.3058 46.2113 0.0000 175.2204 43 I 3.7099 7.8165 120.1306 62.5139 38.3649 175.8490 44 V 4.4086 7.6871 116.4041 62.8839 32.8347 174.8034 45 D 4.4962 7.8447 118.3282 54.5615 41.8079 176.4271 46 E 3.9123 7.2043 118.7334 57.9480 29.7790 178.1853 47 C 4.3886 7.9200 123.2763 58.5369 44.8578 175.9527 48 C 3.7381 7.5638 117.9873 58.5009 42.6818 173.1467 49 F 4.9525 6.1889 114.5019 56.9295 40.5569 176.8349 50 R 4.6784 7.0570 117.2718 56.4060 32.5485 175.5725 51 S 4.5179 8.1311 115.5688 57.2227 63.6151 172.8167 52 C 4.6175 8.4335 120.1853 56.4110 40.1880 173.7277 53 D 4.7131 7.7511 120.4182 53.4053 41.1761 175.8497 54 L 4.5375 8.2508 118.4046 54.6986 41.8565 178.4093 55 R 3.5567 9.1943 123.5736 56.9989 28.6966 173.6277 56 R 4.4191 7.0170 126.3306 56.9627 33.5589 175.1178 57 L 3.6523 7.0434 116.4766 56.6527 40.9745 177.6701 58 E 4.2133 7.9486 118.5461 57.9624 29.6359 177.3105 59 M 4.7372 7.4152 115.9907 55.2524 33.1157 176.4639 60 Y 4.5392 7.8960 117.4205 60.7604 38.5295 174.3008 61 C 4.8797 7.6872 116.5102 56.7751 46.0430 169.2982 62 A 3.7985 8.5679 126.9426 50.9685 17.9885 176.2918 63 P 4.4186 0.0000 0.0000 64.9252 31.9924 176.2939 64 L 4.2779 7.4188 117.1387 54.0236 43.9941 172.7601 65 K 3.9633 8.8792 123.3003 58.7788 32.3190 175.4432 66 P 4.4105 0.0000 0.0000 61.5904 32.3581 175.5725 67 A 3.9615 8.2086 122.2202 52.9211 18.7419 173.7566 68 K 3.9472 8.5169 126.3138 55.5740 32.5372 175.1157 69 S 3.9542 8.1395 120.6430 60.3598 63.3792 174.3034 70 A 4.1658 8.0335 129.8494 53.0410 17.9469 177.5009 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 8.34 3.91 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 0.00 0.00 0.00 2 P 0.00 4.19 0.00 2.30 2.29 0.00 3.82 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 2.06 2.25 0.00 3 E 9.17 4.01 0.00 2.14 2.09 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 2.22 2.28 0.00 4 T 7.56 4.43 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 1.27 0.00 0.00 5 L 9.10 3.65 0.00 1.84 1.44 0.92 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 6 C 8.46 6.30 0.00 3.08 3.14 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 7 G 7.51 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 0.00 0.00 0.00 8 A 7.83 4.40 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 9 E 8.05 4.47 0.00 1.91 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 2.23 2.32 0.00 10 L 7.61 4.48 0.00 1.64 1.66 0.97 0.74 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 11 V 7.51 3.46 2.09 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 1.09 0.00 0.00 1.08 0.00 0.00 12 D 7.78 4.40 0.00 3.00 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 13 A 7.75 4.08 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 14 L 7.75 4.00 0.00 1.60 1.72 0.79 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 15 Q 7.66 3.83 0.00 2.06 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.06 6.77 0.00 0.00 0.00 0.00 0.00 2.05 1.54 0.00 16 F 7.81 5.09 0.00 2.76 3.22 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 17 V 7.91 3.80 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 0.86 0.00 0.00 0.75 0.00 0.00 18 C 8.52 4.45 0.00 3.11 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 19 G 7.74 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 20 D 8.10 5.10 0.00 2.65 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 21 R 6.19 5.48 0.00 1.79 1.84 0.00 3.35 0.00 0.00 3.24 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.40 0.00 22 G 6.54 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 0.00 0.00 0.00 23 F 5.75 3.64 0.00 2.94 3.25 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 0.00 24 Y 7.71 4.50 0.00 3.09 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 25 F 8.80 4.40 0.00 3.05 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 26 N 8.81 4.13 0.00 2.93 2.93 0.00 0.00 6.72 6.26 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 27 K 8.12 3.87 0.00 1.87 1.91 0.00 2.08 0.00 0.00 1.88 0.00 0.00 3.15 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.51 1.48 7.81 28 P 0.00 4.29 0.00 2.14 1.94 0.00 3.91 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 1.96 1.82 0.00 29 T 8.29 3.18 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 1.12 0.00 0.00 30 G 7.69 4.69 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 0.00 0.00 0.00 31 Y 8.42 4.66 0.00 2.92 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 32 G 8.69 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 33 S 8.71 3.50 0.00 4.09 3.94 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 34 S 8.66 3.61 0.00 3.99 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 35 S 8.61 4.31 0.00 4.08 4.06 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.59 3.59 0.00 2.01 2.05 0.00 3.38 0.00 0.00 3.18 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.63 0.00 37 R 8.24 3.66 0.00 1.94 1.91 0.00 3.29 0.00 0.00 3.25 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.63 0.00 38 A 7.74 4.57 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 39 P 0.00 4.50 0.00 2.17 2.11 0.00 3.87 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.95 0.00 40 Q 8.32 5.26 0.00 2.29 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.15 5.62 0.00 0.00 0.00 0.00 0.00 2.10 2.04 0.00 41 T 8.40 3.25 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 0.29 0.00 0.00 42 G 7.50 3.97 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 0.00 0.00 0.00 43 I 7.82 3.71 1.88 0.00 0.00 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 1.00 1.08 0.00 0.00 44 V 7.69 4.41 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 1.06 0.00 0.00 45 D 7.84 4.50 0.00 2.72 2.82 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 0.00 0.00 0.00 46 E 7.20 3.91 0.00 1.90 1.84 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 2.20 2.27 0.00 47 C 7.92 4.39 0.00 2.87 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 48 C 7.56 3.74 0.00 2.56 2.51 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 49 F 6.19 4.95 0.00 3.05 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 50 R 7.06 4.68 0.00 1.82 1.91 0.00 3.17 0.00 0.00 3.25 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.54 0.00 51 S 8.13 4.52 0.00 3.99 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 52 C 8.43 4.62 0.00 2.93 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 53 D 7.75 4.71 0.00 2.74 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 54 L 8.25 4.54 0.00 1.52 1.00 1.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 55 R 9.19 3.56 0.00 1.80 1.87 0.00 3.44 0.00 0.00 3.13 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.52 0.00 56 R 7.02 4.42 0.00 1.84 1.66 0.00 3.23 0.00 0.00 3.36 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 1.32 0.00 57 L 7.04 3.65 0.00 1.61 1.47 0.82 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 58 E 7.95 4.21 0.00 1.96 1.98 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 2.30 2.20 0.00 59 M 7.42 4.74 0.00 2.08 2.15 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 2.53 2.62 0.00 60 Y 7.90 4.54 0.00 3.14 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 61 C 7.69 4.88 0.00 3.05 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 62 A 8.57 3.80 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 63 P 0.00 4.42 0.00 2.20 2.22 0.00 3.78 0.00 0.00 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.95 0.00 64 L 7.42 4.28 0.00 1.63 1.66 0.92 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 65 K 8.88 3.96 0.00 1.71 1.75 0.00 1.59 0.00 0.00 0.61 0.00 0.00 2.86 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.39 1.36 7.81 66 P 0.00 4.41 0.00 2.20 2.02 0.00 3.82 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.94 0.00 67 A 8.21 3.96 1.26 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 0.00 0.00 68 K 8.52 3.95 0.00 1.89 1.81 0.00 1.79 0.00 0.00 1.70 0.00 0.00 2.99 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.30 1.44 7.81 69 S 8.14 3.95 0.00 3.90 3.76 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 0.00 0.00 0.00 70 A 8.03 4.17 1.24 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 0.00 0.00