NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 52 S 4.4098 8.1885 115.4128 57.7681 64.5258 174.2526 53 A 3.8401 8.3142 121.4587 54.1854 17.9739 178.1316 54 R 3.9298 8.4665 118.5360 59.3883 30.4868 176.9629 55 D 4.3125 7.8059 118.7243 57.5074 40.8414 178.7994 56 I 3.7439 7.6178 119.7457 64.7075 37.2039 178.1151 57 H 4.3989 8.5495 117.4908 58.7866 28.5296 177.9480 58 Q 3.9936 7.9889 119.4518 59.0011 28.5650 178.7370 59 L 3.9896 7.9484 119.8501 57.8475 41.5932 179.3973 60 E 3.9297 8.5617 118.6000 59.5185 29.4378 179.3127 61 A 4.0183 8.1633 120.6409 55.2128 18.4816 179.9843 62 R 3.8740 7.9702 116.3931 59.4878 30.1236 179.3315 63 I 3.7405 7.9769 119.7420 64.4004 37.0450 178.1842 64 D 4.3541 8.4710 120.1687 57.3807 40.6712 178.6499 65 S 4.0894 8.0572 113.5663 61.5764 62.3473 176.3623 66 L 4.0034 7.9125 121.0567 57.6918 41.3267 179.3402 67 A 4.0344 8.4882 121.0274 55.0755 18.2679 179.5702 68 A 3.9552 8.2216 119.3920 55.3232 18.3481 180.1529 69 R 3.8593 8.1101 116.7013 59.1672 30.1188 178.4942 70 N 4.2477 8.5774 117.3771 57.0449 38.8100 176.9978 71 S 4.1071 8.1956 116.2730 61.3414 62.9089 176.4068 72 K 3.8397 8.1639 122.3372 59.6038 31.8225 178.4700 73 L 3.9651 8.1574 119.3575 58.1878 41.5250 179.3104 74 M 3.9963 8.1259 117.8200 58.6372 32.2292 177.8516 75 E 3.9076 8.4739 119.7299 59.5837 29.8159 178.7979 76 T 3.8735 8.0382 115.7894 66.7411 68.4589 176.5981 77 L 4.0245 8.3030 121.1673 57.6206 41.7415 179.5807 78 K 3.9357 8.3164 118.7129 59.6448 32.0129 179.2264 79 E 4.1584 8.2381 118.4821 59.2669 29.2797 179.2413 80 A 3.9994 8.0636 120.9774 54.9690 18.3920 179.5087 81 R 3.8205 8.1663 117.3237 59.7998 30.1590 178.6985 82 Q 3.9938 7.9034 117.1749 59.2602 28.6629 179.0468 83 Q 4.0323 8.1975 118.9494 58.8251 28.6632 178.7162 84 L 3.9930 8.3557 120.5825 57.7090 41.6751 179.4853 85 L 3.9664 8.1870 118.8796 57.7600 41.4506 179.4692 86 A 4.0256 8.2135 120.8090 54.8588 18.2987 179.4387 87 L 3.8706 8.1802 119.2256 58.3482 42.0933 179.2549 88 R 3.9322 8.2504 118.8059 59.3801 30.0447 178.3934 89 E 4.0101 8.2074 118.5158 59.3050 29.2093 179.1150 90 E 3.9721 8.2602 118.1614 59.2485 29.7633 179.1992 91 V 3.7349 7.8864 118.2573 66.2633 31.4134 177.8689 92 D 4.3983 7.6929 116.8807 57.2614 40.7109 178.3381 93 R 4.2325 7.6847 115.3522 57.0490 30.0095 176.4136 94 L 4.0898 7.9005 126.7967 55.4604 42.3966 174.7967 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 52 S 8.19 4.41 0.00 4.03 4.10 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 53 A 8.31 3.84 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.47 3.93 0.00 1.95 1.95 0.00 3.28 0.00 0.00 3.18 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.82 0.00 55 D 7.81 4.31 0.00 2.90 2.69 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 56 I 7.62 3.74 1.78 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.93 0.85 0.00 0.00 57 H 8.55 4.40 0.00 3.28 3.33 0.00 5.82 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 58 Q 7.99 3.99 0.00 2.41 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.80 0.00 0.00 0.00 0.00 0.00 2.39 2.56 0.00 59 L 7.95 3.99 0.00 1.83 1.71 0.92 0.72 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 60 E 8.56 3.93 0.00 2.20 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 0.00 2.33 2.42 0.00 61 A 8.16 4.02 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 62 R 7.97 3.87 0.00 2.18 1.99 0.00 3.30 0.00 0.00 3.17 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.81 0.00 63 I 7.98 3.74 1.99 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 0.76 0.91 0.00 0.00 64 D 8.47 4.35 0.00 2.89 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 65 S 8.06 4.09 0.00 3.90 4.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 7.91 4.00 0.00 1.94 1.70 0.92 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 67 A 8.49 4.03 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 68 A 8.22 3.96 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 69 R 8.11 3.86 0.00 2.00 1.99 0.00 3.15 0.00 0.00 3.09 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.79 0.00 70 N 8.58 4.25 0.00 2.71 3.01 0.00 0.00 7.23 7.48 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 71 S 8.20 4.11 0.00 4.04 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 72 K 8.16 3.84 0.00 1.89 1.99 0.00 1.65 0.00 0.00 1.65 0.00 0.00 2.94 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.44 1.50 7.81 73 L 8.16 3.97 0.00 1.86 1.71 0.92 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 74 M 8.13 4.00 0.00 2.23 2.06 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.59 0.00 75 E 8.47 3.91 0.00 2.20 1.93 0.00 0.00 0.00 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 2.39 0.00 76 T 8.04 3.87 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 1.21 0.00 0.00 77 L 8.30 4.02 0.00 1.82 1.71 0.92 1.02 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 78 K 8.32 3.94 0.00 2.00 1.86 0.00 1.66 0.00 0.00 1.65 0.00 0.00 2.94 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.46 1.49 7.81 79 E 8.24 4.16 0.00 2.17 1.99 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 2.33 2.54 0.00 80 A 8.06 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 81 R 8.17 3.82 0.00 1.89 2.11 0.00 3.10 0.00 0.00 3.17 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.68 0.00 82 Q 7.90 3.99 0.00 2.34 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.59 0.00 0.00 0.00 0.00 0.00 2.38 2.53 0.00 83 Q 8.20 4.03 0.00 2.11 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.81 0.00 0.00 0.00 0.00 0.00 2.38 2.60 0.00 84 L 8.36 3.99 0.00 1.81 1.71 0.92 0.47 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 85 L 8.19 3.97 0.00 1.83 1.72 0.92 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 86 A 8.21 4.03 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 87 L 8.18 3.87 0.00 1.89 1.86 0.92 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 88 R 8.25 3.93 0.00 1.91 1.91 0.00 3.15 0.00 0.00 3.17 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.67 0.00 89 E 8.21 4.01 0.00 2.08 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 2.33 2.56 0.00 90 E 8.26 3.97 0.00 2.15 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 2.34 2.31 0.00 91 V 7.89 3.73 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 1.03 0.00 0.00 0.95 0.00 0.00 92 D 7.69 4.40 0.00 2.80 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 93 R 7.68 4.23 0.00 1.81 1.97 0.00 3.33 0.00 0.00 3.15 7.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 1.77 0.00 94 L 7.90 4.09 0.00 1.53 1.46 0.92 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00