NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 52 S 4.8290 8.4287 114.6862 58.3791 64.6901 175.6074 53 A 3.7955 8.1290 122.2275 54.6565 18.0733 177.6549 54 R 3.9093 8.9651 117.6072 59.8462 30.4680 177.0332 55 D 4.3198 7.9098 117.4743 57.4349 40.9299 178.8342 56 I 3.6476 7.7279 120.0969 64.8471 37.0972 178.1518 57 H 4.2229 8.2483 117.1521 59.0974 28.5006 177.9494 58 Q 3.9900 8.1826 119.7754 58.8378 28.5180 178.5640 59 L 3.9779 8.2377 120.3787 57.9281 41.6111 179.4616 60 E 3.9322 8.8490 118.4829 59.3012 29.3872 179.1292 61 A 3.9932 8.2134 120.8998 55.4246 18.4896 179.9714 62 R 3.8834 7.9591 116.3168 59.4283 30.0481 179.3863 63 I 3.7231 7.9766 119.7246 64.4487 37.0947 178.1500 64 D 4.3413 8.3478 119.9405 57.4211 40.6350 178.7740 65 S 4.0989 8.0772 113.5577 61.4946 62.3028 176.3050 66 L 4.0055 7.8678 121.2912 57.6797 41.2889 179.3781 67 A 3.9775 8.2996 120.9129 54.9966 18.2311 179.5411 68 A 3.9421 8.1699 119.3840 55.3904 18.3634 180.1548 69 R 3.8519 8.0660 116.6798 59.1395 30.0859 178.5317 70 N 4.2527 8.4688 117.3266 57.0033 38.8222 177.0184 71 S 4.0966 8.2125 116.3329 61.4133 62.9261 176.4471 72 K 3.8592 8.2330 122.4208 59.5583 31.8520 178.6705 73 L 3.9537 8.2185 119.3918 58.0446 41.5009 179.1609 74 M 4.0136 8.1588 118.0399 58.7727 32.1859 178.0772 75 E 3.9576 8.4660 118.9334 59.7497 29.6147 179.5063 76 T 3.8911 7.9562 115.7457 66.6561 68.5148 176.7708 77 L 4.0238 8.3852 121.3414 57.6227 41.7305 179.5702 78 K 3.9525 8.3674 118.8093 59.6459 31.9925 179.2028 79 E 4.2500 8.5694 119.8774 58.7362 29.2635 179.2278 80 A 3.9768 8.0341 120.9518 55.0388 18.4536 179.5537 81 R 3.8155 8.0961 117.1885 59.7845 30.2876 178.6368 82 Q 4.0168 7.9161 117.2480 59.2860 28.6248 179.1194 83 Q 4.1345 8.1190 118.8968 58.7624 28.6760 178.5962 84 L 3.9851 8.2872 120.4952 57.6978 41.6482 179.5073 85 L 3.9550 8.1015 118.7373 57.8289 41.5639 179.4987 86 A 4.0197 8.1590 120.7053 54.8815 18.2626 179.4364 87 L 3.8848 8.2318 119.2971 58.2985 42.1670 179.1660 88 R 3.8973 8.2777 118.9207 59.5496 29.9825 178.4046 89 E 4.0187 8.2163 118.3848 59.3313 29.1969 179.1904 90 E 3.9751 8.1639 118.0547 59.1587 29.7903 179.1759 91 V 3.7189 7.9293 118.3020 66.1054 31.4023 177.3993 92 D 4.3787 7.7313 117.1758 57.9189 40.8842 179.2960 93 R 4.0837 7.7254 116.2524 58.6173 30.0930 176.7853 94 L 4.3070 7.7039 122.8074 54.9166 42.8857 175.8712 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 8.43 4.83 0.00 3.87 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53 A 8.13 3.80 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 54 R 8.97 3.91 0.00 1.84 2.04 0.00 3.31 0.00 0.00 3.35 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.71 0.00 55 D 7.91 4.32 0.00 2.86 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 56 I 7.73 3.65 1.75 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 1.63 0.95 0.82 0.00 0.00 57 H 8.25 4.22 0.00 3.17 3.34 0.00 5.62 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 8.18 3.99 0.00 2.36 2.15 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 2.39 2.52 0.00 59 L 8.24 3.98 0.00 1.81 1.71 0.91 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 60 E 8.85 3.93 0.00 2.11 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 2.33 2.47 0.00 61 A 8.21 3.99 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 62 R 7.96 3.88 0.00 2.04 1.99 0.00 3.13 0.00 0.00 3.17 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.67 0.00 63 I 7.98 3.72 1.87 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 0.80 0.91 0.00 0.00 64 D 8.35 4.34 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 8.08 4.10 0.00 4.00 3.99 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 0.00 0.00 0.00 66 L 7.87 4.01 0.00 1.94 1.70 0.92 0.95 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 67 A 8.30 3.98 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 68 A 8.17 3.94 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 69 R 8.07 3.85 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 1.81 0.00 70 N 8.47 4.25 0.00 2.73 3.00 0.00 0.00 7.22 7.49 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 71 S 8.21 4.10 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 8.23 3.86 0.00 1.88 1.98 0.00 1.64 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 1.49 7.81 73 L 8.22 3.95 0.00 1.87 1.70 0.92 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 74 M 8.16 4.01 0.00 2.12 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 2.63 0.00 75 E 8.47 3.96 0.00 2.00 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 2.50 0.00 76 T 7.96 3.89 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 8.39 4.02 0.00 1.80 1.71 0.92 0.76 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 78 K 8.37 3.95 0.00 1.98 1.86 0.00 1.67 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 8.57 4.25 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 2.41 0.00 80 A 8.03 3.98 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 81 R 8.10 3.82 0.00 1.90 2.08 0.00 3.11 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 7.92 4.02 0.00 2.34 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.59 0.00 0.00 0.00 0.00 0.00 2.38 2.55 0.00 83 Q 8.12 4.13 0.00 2.23 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.81 0.00 0.00 0.00 0.00 0.00 2.53 2.54 0.00 84 L 8.29 3.99 0.00 1.82 1.71 0.92 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 85 L 8.10 3.95 0.00 1.84 1.71 0.95 0.82 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 86 A 8.16 4.02 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 8.23 3.88 0.00 1.85 1.86 0.92 1.14 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 8.28 3.90 0.00 1.90 2.04 0.00 3.15 0.00 0.00 3.17 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.67 0.00 89 E 8.22 4.02 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 8.16 3.98 0.00 2.19 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 7.93 3.72 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 1.03 0.00 0.00 0.93 0.00 0.00 92 D 7.73 4.38 0.00 2.87 2.75 0.00 0.00 0.00 0.00 0.00 0.00 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 7.73 4.08 0.00 1.94 2.02 0.00 3.27 0.00 0.00 3.22 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.83 0.00 94 L 7.70 4.31 0.00 1.58 1.48 0.92 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00