NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.2766 8.2644 123.5819 52.3539 19.9623 175.3129 2 T 4.3553 8.1161 113.8349 58.5715 68.8231 169.1437 3 V 4.3477 8.2092 127.8556 60.5779 34.4848 173.5533 4 V 4.3981 8.0786 123.7031 60.9011 34.5546 174.3506 5 S 4.6471 8.6411 122.8243 57.4344 64.3779 174.3249 6 G 4.3139 8.2402 122.5197 45.1137 0.0000 174.9195 7 Q 4.6891 8.5742 122.9539 53.9028 30.8476 174.3410 8 K 4.7002 8.1742 118.1943 55.0472 35.5288 174.5135 9 Q 4.3297 8.6836 119.1130 56.9712 30.8965 176.1049 10 D 4.6840 7.7002 122.9171 51.5201 41.4233 175.1647 11 R 3.9313 8.2143 125.7379 56.4011 30.7169 175.2473 12 Q 4.5902 9.5134 119.8771 53.6431 31.6947 175.2953 13 G 4.3841 8.1869 119.6201 45.9872 0.0000 173.7065 14 G 3.5376 7.4199 107.9630 45.6613 0.0000 172.1137 15 E 4.4198 8.0193 121.7910 56.5687 30.4216 174.4129 16 R 4.3281 8.5148 120.8058 56.2192 31.3950 168.4001 17 R 3.9336 8.6399 129.7282 55.1661 31.7631 176.2250 18 R 4.5326 7.6431 121.7391 55.7717 29.1899 174.7900 19 S 3.9670 8.0055 112.7288 59.0304 62.2554 170.8220 20 Q 4.3640 7.7263 119.0160 54.9367 30.0986 173.1553 21 L 3.7542 8.0084 120.2348 54.6570 41.8862 176.4530 22 D 4.6429 8.3181 125.8768 53.6553 41.6397 178.0892 23 R 4.1626 8.5248 120.1991 58.2514 30.4008 176.7921 24 D 5.3547 7.9570 118.0344 53.4122 40.7175 175.2032 25 Q 5.0351 7.9286 118.2387 55.1786 32.2607 174.1207 26 C 4.7367 8.8102 119.5438 57.3114 34.2992 174.4248 27 A 5.0186 8.4243 129.2983 52.5549 19.5393 176.6739 28 Y 4.5912 8.2099 119.6426 60.3659 40.8486 175.5795 29 C 4.4943 8.4632 110.8903 57.4843 31.4407 174.0969 30 K 4.3913 8.3214 118.9883 57.7029 30.0103 175.4406 31 E 4.1875 7.9944 116.7902 54.8183 30.4308 175.0584 32 K 4.5890 10.7767 125.5331 55.7923 33.5282 174.2248 33 G 3.7231 7.9190 121.7804 45.7330 0.0000 172.7309 34 H 4.9716 7.5066 115.5544 53.3561 30.9096 173.8748 35 W 4.9614 8.4159 119.1326 54.7980 31.2676 177.4736 36 A 4.0840 8.5369 122.8073 55.5129 17.8493 179.9466 37 K 4.1536 8.1723 112.6665 58.2274 32.2681 176.9206 38 D 4.8424 8.3113 117.6106 53.5606 42.2395 174.7282 39 C 4.0513 7.9920 119.4910 58.3999 31.8011 172.3292 40 P 4.4883 0.0000 0.0000 63.7640 31.1834 176.3433 41 K 4.5018 7.7976 118.9058 56.1931 32.3972 176.0262 42 K 4.3685 7.6946 116.8657 55.7394 32.9526 175.8045 43 P 4.7259 0.0000 0.0000 62.4086 30.2102 176.5605 44 R 4.4634 7.0669 113.1019 55.8375 32.7374 176.6726 45 G 3.9609 8.6876 111.4266 44.0135 0.0000 171.6561 46 P 4.3761 0.0000 0.0000 65.0747 31.6035 177.2655 47 R 4.3990 8.0710 117.4502 55.8409 33.2567 173.7475 48 G 3.6775 8.8022 112.2283 45.0047 0.0000 170.5462 49 P 4.3914 0.0000 0.0000 62.2597 29.9918 176.0393 50 R 4.2381 7.6424 121.5404 55.6393 30.8877 172.5799 51 P 4.4414 0.0000 0.0000 62.6954 32.9748 175.9246 52 Q 3.1266 8.6221 113.4773 57.3214 26.2863 173.5513 53 T 4.1354 7.9900 118.0624 63.4662 69.5339 174.2714 54 S 4.5255 8.5810 118.9777 60.0952 64.4265 174.6567 55 L 4.4036 7.5488 120.3535 53.9333 42.9960 176.2021 56 L 4.2218 8.3441 123.1724 55.1078 41.7014 176.7967 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 A 8.26 4.28 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 2 T 8.12 4.36 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 3 V 8.21 4.35 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 0.72 0.00 0.00 0.93 0.00 0.00 4 V 8.08 4.40 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 0.82 0.00 0.00 0.93 0.00 0.00 5 S 8.64 4.65 0.00 3.90 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6 G 8.24 4.31 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 0.00 7 Q 8.57 4.69 0.00 2.15 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.10 6.74 0.00 0.00 0.00 0.00 0.00 2.23 2.25 0.00 8 K 8.17 4.70 0.00 1.67 1.65 0.00 1.72 0.00 0.00 1.71 0.00 0.00 3.01 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.31 1.43 7.81 9 Q 8.68 4.33 0.00 2.03 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.79 0.00 0.00 0.00 0.00 0.00 2.24 2.30 0.00 10 D 7.70 4.68 0.00 2.59 2.56 0.00 0.00 0.00 0.00 0.00 0.00 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 8.21 3.93 0.00 1.81 1.86 0.00 3.26 0.00 0.00 3.23 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.70 0.00 12 Q 9.51 4.59 0.00 2.07 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 7.65 0.00 0.00 0.00 0.00 0.00 2.28 2.33 0.00 13 G 8.19 4.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 G 7.42 3.54 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 0.00 15 E 8.02 4.42 0.00 1.87 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 2.12 2.21 0.00 16 R 8.51 4.33 0.00 1.74 1.76 0.00 3.42 0.00 0.00 3.14 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 1.48 0.00 17 R 8.64 3.93 0.00 1.96 1.89 0.00 3.38 0.00 0.00 3.33 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.53 0.00 18 R 7.64 4.53 0.00 1.92 2.00 0.00 3.09 0.00 0.00 3.22 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.64 0.00 19 S 8.01 3.97 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 20 Q 7.73 4.36 0.00 1.95 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.60 6.72 0.00 0.00 0.00 0.00 0.00 2.16 2.31 0.00 21 L 8.01 3.75 0.00 1.73 1.57 0.79 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 22 D 8.32 4.64 0.00 2.72 2.71 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 23 R 8.52 4.16 0.00 1.87 2.15 0.00 3.49 0.00 0.00 3.30 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.64 0.00 24 D 7.96 5.35 0.00 2.78 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 25 Q 7.93 5.04 0.00 2.11 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.64 6.66 0.00 0.00 0.00 0.00 0.00 2.25 2.63 0.00 26 C 8.81 4.74 0.00 3.06 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 27 A 8.42 5.02 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 28 Y 8.21 4.59 0.00 2.80 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 29 C 8.46 4.49 0.00 3.14 3.11 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 30 K 8.32 4.39 0.00 1.81 2.16 0.00 1.46 0.00 0.00 1.51 0.00 0.00 3.19 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.25 1.38 7.81 31 E 7.99 4.19 0.00 2.12 1.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.38 2.24 0.00 32 K 10.78 4.59 0.00 1.53 1.67 0.00 1.87 0.00 0.00 1.72 0.00 0.00 3.00 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.55 1.34 7.81 33 G 7.92 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 0.00 0.00 0.00 34 H 7.51 4.97 0.00 3.33 3.39 0.00 5.51 0.00 0.00 0.00 0.00 6.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 W 8.42 4.96 0.00 3.34 3.17 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 36 A 8.54 4.08 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.17 4.15 0.00 1.88 1.91 0.00 1.75 0.00 0.00 1.96 0.00 0.00 3.10 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.49 1.51 7.81 38 D 8.31 4.84 0.00 2.62 2.71 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 39 C 7.99 4.05 0.00 3.09 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 40 P 0.00 4.49 0.00 2.21 2.11 0.00 3.66 0.00 0.00 3.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.87 0.00 41 K 7.80 4.50 0.00 1.81 2.02 0.00 1.78 0.00 0.00 1.70 0.00 0.00 2.85 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.41 1.47 7.81 42 K 7.69 4.37 0.00 1.97 1.64 0.00 1.61 0.00 0.00 1.59 0.00 0.00 2.83 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.71 0.99 7.81 43 P 0.00 4.73 0.00 2.21 2.17 0.00 3.71 0.00 0.00 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.07 0.00 44 R 7.07 4.46 0.00 1.85 1.87 0.00 3.23 0.00 0.00 3.22 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.79 0.00 45 G 8.69 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 46 P 0.00 4.38 0.00 2.19 2.19 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 1.99 1.99 0.00 47 R 8.07 4.40 0.00 1.76 1.84 0.00 3.35 0.00 0.00 3.23 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.56 0.00 48 G 8.80 3.68 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 0.00 0.00 0.00 49 P 0.00 4.39 0.00 2.19 2.11 0.00 3.81 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.95 0.00 50 R 7.64 4.24 0.00 1.74 1.85 0.00 3.40 0.00 0.00 3.28 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.51 0.00 51 P 0.00 4.44 0.00 2.24 2.11 0.00 3.98 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.96 0.00 52 Q 8.62 3.13 0.00 2.12 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.96 7.05 0.00 0.00 0.00 0.00 0.00 2.27 2.43 0.00 53 T 7.99 4.14 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 1.26 0.00 0.00 54 S 8.58 4.53 0.00 3.84 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 55 L 7.55 4.40 0.00 1.60 1.55 0.92 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 56 L 8.34 4.22 0.00 1.65 1.56 0.92 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00