NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.9612 8.3544 109.7377 45.8253 0.0000 174.5169 2 S 4.5875 7.4288 112.0804 55.2592 63.9762 172.2981 3 P 4.7670 0.0000 0.0000 62.3430 32.8294 178.7332 4 L 4.1182 9.1200 114.1309 57.8488 41.8718 180.5461 5 G 3.9580 7.6828 108.7883 48.0111 0.0000 176.1874 6 Q 3.9933 8.2788 121.1426 58.7690 29.3189 176.7508 7 D 4.3960 8.1709 118.5419 57.7886 40.9973 178.5080 8 V 3.2526 7.8999 112.6023 64.4162 31.5839 177.9795 9 F 3.9003 7.5679 119.3252 61.7069 39.0993 177.4419 10 L 4.2429 8.3480 118.1575 57.5721 41.2753 179.0311 11 D 4.3120 8.4445 118.4735 57.6280 40.5790 177.7650 12 Y 4.3647 8.0731 118.2537 61.6974 37.6315 178.1552 13 C 4.0229 8.1787 117.2083 63.2447 28.3157 175.7745 14 Q 4.1918 8.7956 121.0000 59.7005 28.2587 179.4972 15 K 4.3945 8.4352 120.8495 58.8928 32.3013 178.8176 16 L 4.1249 9.3840 120.9265 58.5633 41.9267 178.9480 17 L 4.2977 9.8326 120.3148 57.9610 41.8817 178.8090 18 E 4.0644 8.3760 117.6903 59.0536 29.6770 178.5704 19 K 3.6795 8.9369 121.0838 58.8406 32.1610 177.1151 20 F 4.1935 8.3797 113.5288 56.2907 39.2767 175.6420 21 R 3.8545 7.9212 119.1363 57.1012 28.1717 176.2907 22 Y 4.4099 8.2134 113.6668 57.0527 38.9535 174.4268 23 P 4.5772 0.0000 0.0000 62.5038 31.8951 176.9085 24 W 4.6271 8.7282 127.8207 59.3107 30.7578 176.4572 25 E 4.0790 8.1575 114.3845 58.0254 29.8006 177.3006 26 L 4.4128 7.3598 119.2580 55.1484 41.7607 178.1588 27 M 3.8969 7.5205 122.0267 58.0661 31.8367 176.6421 28 P 3.8840 0.0000 0.0000 65.3514 31.3771 178.7494 29 L 3.9254 7.5565 117.2872 58.1614 41.8719 178.9764 30 M 3.9518 8.1723 118.9342 58.5534 31.8652 178.1336 31 Y 4.1557 8.8890 120.6123 60.8054 39.0898 178.3626 32 V 3.6773 8.2093 118.8379 66.2079 31.6903 177.6442 33 I 3.7290 7.8345 119.6479 64.7919 36.9180 178.2557 34 L 3.8197 7.7415 119.1088 57.5826 41.1499 179.3438 35 K 3.8152 7.8845 118.5563 59.4764 32.1509 178.0705 36 D 4.5807 7.9691 118.5708 56.5253 41.1722 178.2238 37 A 4.4673 8.1468 121.0018 52.5898 19.0342 177.3090 38 D 4.2401 8.9551 117.4093 56.3055 40.5620 173.8310 39 A 3.3394 8.6468 117.4451 52.5294 16.8420 179.1126 40 N 4.3015 8.6131 117.0608 52.5273 38.5395 175.6912 41 I 3.8866 7.9193 127.0079 64.7175 37.1596 177.6530 42 E 3.9588 8.1714 118.3368 59.8982 29.0961 179.2091 43 E 3.9697 7.9371 116.7408 58.7257 30.1258 177.9780 44 A 4.1722 8.8110 122.5941 54.5798 18.5810 179.7029 45 S 4.2761 9.7240 112.9377 61.9854 63.1939 176.7884 46 R 4.1580 7.8050 122.1324 59.0829 29.6173 179.0999 47 R 3.9190 7.8166 117.2894 59.0522 29.9112 178.4920 48 I 3.7207 7.7362 118.8630 64.9811 37.0716 177.5051 49 E 4.1290 8.8886 118.9136 60.0653 29.1604 179.0481 50 E 4.0927 8.4336 118.6105 59.7219 29.5975 178.9971 51 G 3.7561 8.8406 106.1613 47.9730 0.0000 175.1260 52 Q 4.2496 9.3872 121.7055 58.7357 28.7197 179.2428 53 Y 3.9800 8.5806 120.4047 60.8595 38.8947 177.4610 54 V 3.6530 9.9518 118.7828 66.4528 31.2962 177.8597 55 V 3.5320 8.5736 118.3217 66.1654 31.7941 177.3156 56 N 4.3853 8.4292 116.3573 56.4954 38.4175 176.5706 57 E 3.5629 9.0931 120.2714 59.7359 29.2193 178.2915 58 Y 3.7674 8.3346 119.3859 60.7654 38.5890 178.2598 59 S 4.3560 8.4766 116.1752 60.7647 62.8486 176.8335 60 R 3.9609 7.5740 119.8089 59.2040 30.1273 177.8576 61 Q 4.0532 7.8602 118.2968 59.9266 29.2557 178.2851 62 H 4.3830 7.7541 114.9293 56.1370 28.6946 175.9953 63 N 4.2536 8.8023 114.6224 52.9126 37.0546 173.7965 64 L 3.7098 7.9689 115.8929 54.7881 40.1361 174.3405 65 N 4.4402 8.3984 120.1177 53.5148 36.8907 174.3559 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 7.43 4.59 0.00 3.88 3.74 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 0.00 0.00 0.00 3 P 0.00 4.77 0.00 2.28 2.07 0.00 3.77 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.00 0.00 4 L 9.12 4.12 0.00 1.70 1.75 0.93 0.83 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 5 G 7.68 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 6 Q 8.28 3.99 0.00 2.14 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.72 0.00 0.00 0.00 0.00 0.00 2.47 2.46 0.00 7 D 8.17 4.40 0.00 2.76 2.72 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 8 V 7.90 3.25 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.67 0.00 0.00 0.96 0.00 0.00 9 F 7.57 3.90 0.00 3.34 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 10 L 8.35 4.24 0.00 1.93 1.83 1.00 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 11 D 8.44 4.31 0.00 2.64 2.46 0.00 0.00 0.00 0.00 0.00 0.00 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 Y 8.07 4.36 0.00 2.86 2.76 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 13 C 8.18 4.02 0.00 3.23 3.03 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 14 Q 8.80 4.19 0.00 2.35 2.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.58 7.09 0.00 0.00 0.00 0.00 0.00 2.73 2.78 0.00 15 K 8.44 4.39 0.00 2.09 1.92 0.00 1.84 0.00 0.00 1.74 0.00 0.00 3.07 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.60 1.64 7.81 16 L 9.38 4.12 0.00 1.93 1.88 1.11 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 17 L 9.83 4.30 0.00 2.04 1.97 1.07 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 18 E 8.38 4.06 0.00 2.31 2.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.33 0.00 19 K 8.94 3.68 0.00 1.60 2.06 0.00 1.79 0.00 0.00 1.68 0.00 0.00 2.91 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.06 1.31 7.81 20 F 8.38 4.19 0.00 2.98 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 0.00 0.00 0.00 21 R 7.92 3.85 0.00 1.80 1.96 0.00 3.16 0.00 0.00 3.23 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.72 0.00 22 Y 8.21 4.41 0.00 3.05 2.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 P 0.00 4.58 0.00 2.21 2.13 0.00 4.17 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 2.22 2.08 0.00 24 W 8.73 4.63 0.00 3.35 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 25 E 8.16 4.08 0.00 2.09 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 2.33 2.35 0.00 26 L 7.36 4.41 0.00 1.71 1.41 0.77 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 27 M 7.52 3.90 0.00 1.71 1.54 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 2.19 0.00 28 P 0.00 3.88 0.00 2.07 1.98 0.00 3.46 0.00 0.00 3.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.03 0.00 29 L 7.56 3.93 0.00 1.59 1.53 0.75 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 30 M 8.17 3.95 0.00 2.11 2.23 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.68 2.72 0.00 31 Y 8.89 4.16 0.00 3.10 3.13 0.00 0.00 0.00 0.00 0.00 0.00 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 V 8.21 3.68 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.00 0.00 1.15 0.00 0.00 33 I 7.83 3.73 1.97 0.00 0.00 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.42 0.84 0.00 0.00 34 L 7.74 3.82 0.00 1.72 0.92 0.76 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 35 K 7.88 3.82 0.00 1.70 1.99 0.00 1.85 0.00 0.00 1.77 0.00 0.00 3.03 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.48 1.46 7.81 36 D 7.97 4.58 0.00 2.87 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 37 A 8.15 4.47 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 38 D 8.96 4.24 0.00 2.73 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 39 A 8.65 3.34 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 40 N 8.61 4.30 0.00 2.70 2.68 0.00 0.00 6.91 7.14 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 41 I 7.92 3.89 1.76 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.57 0.94 0.00 0.00 42 E 8.17 3.96 0.00 1.95 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 2.38 2.34 0.00 43 E 7.94 3.97 0.00 1.89 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 2.26 2.40 0.00 44 A 8.81 4.17 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 45 S 9.72 4.28 0.00 4.32 4.37 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 0.00 0.00 0.00 0.00 46 R 7.81 4.16 0.00 1.98 2.06 0.00 3.11 0.00 0.00 3.16 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.93 0.00 47 R 7.82 3.92 0.00 1.95 1.95 0.00 3.13 0.00 0.00 3.15 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.94 0.00 48 I 7.74 3.72 1.68 0.00 0.00 0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.96 0.14 0.00 0.00 49 E 8.89 4.13 0.00 2.31 2.10 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 2.53 2.80 0.00 50 E 8.43 4.09 0.00 2.27 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 2.39 2.33 0.00 51 G 8.84 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 0.00 0.00 0.00 52 Q 9.39 4.25 0.00 2.17 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.72 6.99 0.00 0.00 0.00 0.00 0.00 2.72 2.85 0.00 53 Y 8.58 3.98 0.00 3.06 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 54 V 9.95 3.65 2.26 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 1.04 0.00 0.00 1.09 0.00 0.00 55 V 8.57 3.53 2.10 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 0.98 0.00 0.00 0.99 0.00 0.00 56 N 8.43 4.39 0.00 2.83 2.83 0.00 0.00 6.79 7.26 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 57 E 9.09 3.56 0.00 1.16 1.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.07 0.00 58 Y 8.33 3.77 0.00 3.11 3.05 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 59 S 8.48 4.36 0.00 4.11 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 60 R 7.57 3.96 0.00 1.79 1.93 0.00 3.20 0.00 0.00 3.10 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.68 0.00 61 Q 7.86 4.05 0.00 1.88 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.89 0.00 0.00 0.00 0.00 0.00 2.35 2.38 0.00 62 H 7.75 4.38 0.00 3.20 3.21 0.00 5.84 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 N 8.80 4.25 0.00 2.77 2.87 0.00 0.00 7.24 8.44 0.00 0.00 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 L 7.97 3.71 0.00 1.73 1.71 0.98 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 65 N 8.40 4.44 0.00 2.79 2.82 0.00 0.00 6.30 7.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00