NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 24 D 4.3845 8.3644 120.1870 54.9004 42.1782 175.1531 25 H 3.8883 8.7034 129.4543 55.5972 28.1809 174.1177 26 H 4.1585 8.5893 119.6314 59.0350 29.6063 176.1390 27 Y 3.2523 7.0638 118.4836 60.3280 37.3094 178.1180 28 A 4.1086 7.1733 120.3427 54.7041 18.4926 178.4951 29 M 4.3844 7.9692 115.0956 56.0204 32.7851 177.6795 30 W 4.2807 8.6621 120.3385 58.0330 29.3007 177.7800 31 D 4.5095 8.2656 119.4967 56.7039 38.5753 178.6044 32 A 3.9694 8.0197 121.6725 54.6669 18.4699 179.2683 33 A 3.9099 7.9287 118.8006 55.2533 18.2660 179.1573 34 Y 3.9991 8.0522 118.0970 61.0457 38.7895 178.3974 35 V 3.4482 7.7590 117.4375 65.2008 31.7205 177.1658 36 L 4.3214 7.8902 117.0961 54.7498 41.7721 177.4404 37 G 3.7155 7.5401 106.7321 45.9365 0.0000 174.1040 38 A 4.3617 7.8254 121.4408 51.8677 19.5180 178.7628 39 L 4.0173 7.5845 116.8465 53.9695 42.3710 177.7559 40 S 4.3658 8.3999 118.0019 57.6610 65.2428 175.0695 41 A 3.9971 8.6129 123.1570 55.6110 17.8483 179.8193 42 A 4.0414 7.9601 118.4391 55.3887 18.5479 179.4594 43 D 4.6261 7.9929 117.6443 57.5798 40.8310 178.9749 44 R 4.1701 8.5106 119.5989 59.6159 30.1474 178.7757 45 R 3.9910 8.0465 117.4398 59.1571 30.0710 178.6191 46 E 3.9519 8.5965 119.4030 59.3960 29.6565 178.7228 47 F 3.8281 9.1683 121.1058 61.1302 39.5137 176.9097 48 E 3.6304 8.6344 118.4858 59.0910 29.0239 179.0293 49 A 3.8614 7.6338 119.6165 55.6145 18.8977 178.9255 50 H 3.9519 7.7477 116.4630 59.1870 29.8508 177.4424 51 L 3.5276 7.5564 121.0585 57.3204 41.1201 179.0968 52 A 4.1863 7.5758 119.1611 53.6986 18.2584 178.1747 53 G 3.8733 7.3338 103.9309 44.8178 0.0000 173.5002 54 C 4.4864 7.7548 119.7812 55.6522 33.1597 172.1642 55 P 4.2338 0.0000 0.0000 65.6835 30.7613 178.1678 56 E 3.9563 8.0417 117.7468 59.5986 29.4519 178.9602 57 C 4.2363 7.9750 116.1968 62.7303 28.2922 175.8773 58 R 3.9567 8.0007 119.9034 59.5447 29.7064 179.3052 59 G 3.6180 8.1428 104.9167 47.4960 0.0000 175.6963 60 A 4.2054 7.7298 122.2338 55.3466 18.8830 179.8906 61 V 3.8836 8.1313 111.0178 64.8976 31.0381 179.0506 62 T 3.9603 8.0201 115.6296 66.7000 68.0694 176.5854 63 E 4.0690 8.2610 119.5025 58.8144 29.7950 178.4862 64 L 4.4847 7.7228 117.0103 55.3170 41.9711 178.3629 65 C 4.2974 7.7151 114.1564 61.2501 29.7481 175.8181 66 G 3.7806 8.1855 107.4677 47.1297 0.0000 175.7250 67 V 3.5707 7.8811 120.7132 65.7548 31.6351 176.2896 68 P 4.3364 0.0000 0.0000 65.4455 30.8612 178.4393 69 A 3.9982 7.8732 118.6111 55.0659 18.7419 179.2230 70 L 4.1029 7.7006 117.2378 57.8868 41.8679 179.5846 71 L 4.0443 8.3919 119.6713 57.6838 41.3663 179.3145 72 S 4.3547 8.0205 112.3333 60.2624 62.9875 175.5647 73 Q 4.2280 7.8363 120.6463 56.2132 28.9118 175.3692 74 L 4.9605 7.1016 119.2070 52.7500 45.2431 176.0984 75 D 4.9228 8.4809 120.7867 52.6689 44.1159 178.2678 76 R 4.0096 8.3864 118.0692 59.2489 29.1988 178.7898 77 D 4.3032 7.9898 119.8495 56.3428 39.6120 178.0998 78 E 3.9218 8.1256 119.7124 59.1137 29.5444 179.3474 79 V 3.5467 7.7182 117.6230 65.9435 31.5732 177.7726 80 A 3.9766 8.2536 120.4221 55.2566 18.1973 179.4378 81 A 3.9534 8.2805 119.4946 55.2863 18.1686 179.9619 82 I 3.6457 7.7823 117.8752 64.5664 37.5004 178.5682 83 S 4.2351 8.1023 115.9120 61.5065 62.4801 175.9391 84 E 3.9178 7.9658 120.9381 59.5699 29.4097 178.6133 85 S 4.4174 7.7568 109.7211 58.6533 63.3509 174.3674 86 A 4.2741 8.1755 130.4289 53.0042 18.2991 177.2477 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 24 D 8.36 4.38 0.00 2.63 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 25 H 8.70 3.89 0.00 3.40 3.25 0.00 5.75 0.00 0.00 0.00 0.00 6.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 H 8.59 4.16 0.00 3.39 3.43 0.00 5.54 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 27 Y 7.06 3.25 0.00 2.60 2.79 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 28 A 7.17 4.11 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 M 7.97 4.38 0.00 2.12 2.45 0.00 0.00 0.00 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.67 2.78 0.00 30 W 8.66 4.28 0.00 2.79 2.52 0.00 0.00 0.00 0.00 0.00 0.00 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 D 8.27 4.51 0.00 3.02 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 32 A 8.02 3.97 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.93 3.91 1.17 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 34 Y 8.05 4.00 0.00 2.90 3.21 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 35 V 7.76 3.45 2.28 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 0.93 0.00 0.00 1.09 0.00 0.00 36 L 7.89 4.32 0.00 1.68 1.66 0.90 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 37 G 7.54 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 38 A 7.83 4.36 1.21 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 39 L 7.58 4.02 0.00 1.67 1.67 0.47 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 40 S 8.40 4.37 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 41 A 8.61 4.00 1.37 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 0.00 0.00 42 A 7.96 4.04 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.99 4.63 0.00 2.84 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 44 R 8.51 4.17 0.00 2.02 2.11 0.00 3.21 0.00 0.00 3.24 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 2.09 0.00 45 R 8.05 3.99 0.00 2.24 2.02 0.00 3.34 0.00 0.00 3.13 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.70 0.00 46 E 8.60 3.95 0.00 2.41 2.44 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 0.00 2.42 2.44 0.00 47 F 9.17 3.83 0.00 3.47 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 48 E 8.63 3.63 0.00 2.19 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 0.00 2.34 2.68 0.00 49 A 7.63 3.86 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 50 H 7.75 3.95 0.00 2.44 2.53 0.00 5.79 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 51 L 7.56 3.53 0.00 1.46 1.36 0.21 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 52 A 7.58 4.19 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 53 G 7.33 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 0.00 0.00 0.00 54 C 7.75 4.49 0.00 2.63 2.48 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.23 0.00 2.27 2.27 0.00 3.68 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.03 0.00 56 E 8.04 3.96 0.00 2.13 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 2.41 2.47 0.00 57 C 7.98 4.24 0.00 2.95 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 58 R 8.00 3.96 0.00 1.95 1.96 0.00 3.07 0.00 0.00 3.08 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.78 0.00 59 G 8.14 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 60 A 7.73 4.21 1.51 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 0.00 0.00 61 V 8.13 3.88 2.36 0.00 0.00 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 0.00 0.00 1.09 0.00 0.00 62 T 8.02 3.96 4.51 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 1.23 0.00 0.00 63 E 8.26 4.07 0.00 2.19 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 0.00 2.37 2.51 0.00 64 L 7.72 4.48 0.00 1.89 1.74 0.98 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 65 C 7.72 4.30 0.00 3.19 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 66 G 8.19 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 67 V 7.88 3.57 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 1.05 0.00 0.00 0.94 0.00 0.00 68 P 0.00 4.34 0.00 2.18 2.07 0.00 3.88 0.00 0.00 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.14 0.00 69 A 7.87 4.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 7.70 4.10 0.00 1.81 1.72 0.93 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 71 L 8.39 4.04 0.00 1.84 1.71 0.92 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 72 S 8.02 4.35 0.00 4.02 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 73 Q 7.84 4.23 0.00 2.20 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.94 6.71 0.00 0.00 0.00 0.00 0.00 2.39 2.39 0.00 74 L 7.10 4.96 0.00 1.62 1.53 0.92 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 75 D 8.48 4.92 0.00 2.89 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 76 R 8.39 4.01 0.00 2.02 2.19 0.00 2.95 0.00 0.00 3.38 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.68 0.00 77 D 7.99 4.30 0.00 2.89 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 78 E 8.13 3.92 0.00 2.12 2.04 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 0.00 2.40 2.37 0.00 79 V 7.72 3.55 2.20 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 1.00 0.00 0.00 0.97 0.00 0.00 80 A 8.25 3.98 1.38 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 81 A 8.28 3.95 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 I 7.78 3.65 2.03 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 1.52 0.72 0.91 0.00 0.00 83 S 8.10 4.24 0.00 3.87 3.90 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 0.00 0.00 0.00 84 E 7.97 3.92 0.00 2.07 2.16 0.00 0.00 0.00 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 2.39 0.00 85 S 7.76 4.42 0.00 4.08 3.95 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 86 A 8.18 4.27 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00