NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 54 F 4.6093 8.1833 119.3904 57.4014 41.2212 173.3398 55 D 5.1931 9.0088 122.8728 51.6098 44.2356 170.1696 56 V 4.5523 9.5078 123.4886 61.5410 34.3082 174.0700 57 I 4.7224 8.7841 129.4427 59.5658 40.3253 174.5495 58 L 4.7397 8.7796 127.0583 53.8693 43.6018 176.1116 59 K 4.2821 8.8426 125.9284 57.6463 32.7862 176.4075 60 A 4.7041 7.5965 119.6463 49.8218 20.5789 176.2631 61 A 3.7941 8.8479 126.0594 53.3439 19.2816 178.2532 62 G 3.9121 7.9950 102.3624 45.2973 0.0000 172.7953 63 A 4.4569 8.2833 119.1855 52.0478 19.8965 178.2539 64 N 4.9280 7.3406 111.0348 52.9289 40.3749 175.3004 65 K 4.0588 7.8707 121.6491 59.6156 32.9580 176.8843 66 V 3.5387 7.9526 118.3268 66.2545 31.2369 177.4499 67 A 4.0079 8.6001 119.9594 55.0447 18.3988 179.6558 68 V 3.4996 7.8387 116.6818 66.4641 31.6720 178.1069 69 I 3.7689 8.3018 119.6726 64.5041 36.9280 178.6425 70 K 3.9204 7.9385 118.4536 59.4655 31.9612 178.9662 71 A 4.0306 8.1620 121.2466 56.0329 18.1401 179.0825 72 V 3.5790 8.3176 117.2724 65.8625 31.4194 178.0618 73 R 4.0695 8.5908 116.1864 59.4982 29.0848 179.2646 74 G 3.5774 8.5112 105.8186 47.4059 0.0000 175.1826 75 A 4.2814 8.0099 122.3869 54.3821 18.7934 177.5681 76 T 4.3221 8.7631 106.2422 58.8188 70.5361 173.7129 77 G 3.9201 8.1970 110.5123 43.8167 0.0000 173.8478 78 L 4.1623 7.5486 120.7186 53.7966 42.3865 177.9242 79 G 3.7574 8.6197 108.0021 44.9557 0.0000 174.2155 80 L 3.9003 8.6622 125.6794 58.3893 42.0279 179.2553 81 K 3.9100 8.0473 118.6898 59.3835 32.2539 178.0311 82 E 3.9143 8.2739 117.9404 59.6908 29.4866 179.4396 83 A 3.9709 8.3952 120.6931 54.9258 18.4772 179.4408 84 K 3.8263 8.1533 118.2858 59.8506 32.0735 178.4370 85 D 4.3424 8.2736 117.9279 57.6288 40.9911 178.0928 86 L 3.9452 8.2261 120.6156 58.9642 41.9802 179.3468 87 V 3.5897 8.1052 117.4681 65.9757 31.4209 177.6896 88 E 4.2800 8.5868 116.8975 57.6418 29.2957 178.0160 89 S 4.7606 7.7620 114.1617 57.0721 64.4160 174.1723 90 A 4.2355 7.0381 124.4279 52.2883 18.7273 176.5376 91 P 4.8087 0.0000 0.0000 62.8192 32.8142 175.5937 92 A 4.7327 8.6234 121.4019 49.9971 22.6547 175.4229 93 A 4.2243 8.7260 124.8793 52.4290 18.4539 177.2751 94 L 4.2989 8.9030 123.8631 57.1482 42.6579 177.4756 95 K 4.7622 7.7479 115.4929 55.2316 37.1524 175.4850 96 E 4.6700 8.3717 120.8299 56.0912 33.2292 175.7494 97 G 3.6606 8.7331 113.5465 46.7579 0.0000 172.9975 98 V 4.5225 7.6793 110.4570 58.7603 34.9796 177.4368 99 S 4.3515 8.3250 116.8573 58.2740 64.8152 175.1424 100 K 3.4489 8.7162 124.6289 59.8650 31.8332 178.7895 101 D 4.2890 7.9310 118.4243 57.5504 40.8086 178.4474 102 D 4.3232 7.7830 117.8613 57.0704 40.8483 178.6200 103 A 3.9602 8.1911 121.5927 55.3177 18.4710 179.3949 104 E 3.8973 8.6533 117.5580 58.6363 29.3365 178.8474 105 A 3.9029 7.9079 121.3129 55.1219 18.4393 179.2370 106 L 3.9450 7.8661 118.7913 58.0296 42.0720 178.7899 107 K 3.8278 8.0888 119.8472 59.6661 32.1072 178.8525 108 K 4.1474 8.1371 118.2853 59.5222 32.1595 179.0941 109 A 3.9587 7.5190 121.1258 55.0254 18.2746 179.5373 110 L 3.9532 8.0514 117.7302 57.9701 41.4971 179.4536 111 E 3.9562 8.0948 117.2967 59.7173 29.5264 179.0039 112 E 4.0657 8.0420 116.8512 59.3488 29.5424 178.9160 113 A 4.2357 7.5853 119.7607 52.5957 20.1510 178.0122 114 G 4.0044 8.7342 105.3671 46.1919 0.0000 172.2769 115 A 4.7753 7.1499 118.8453 50.0213 23.7170 176.7309 116 E 4.2241 9.0443 121.4608 55.6792 30.3056 175.7579 117 V 4.6745 8.3321 126.8355 61.2357 34.2488 174.2133 118 E 4.7610 9.2613 125.5387 54.2737 32.7606 174.4586 119 V 4.9951 8.4517 126.0727 60.8974 34.2277 175.1818 120 K 4.2334 8.7310 125.7233 57.4018 32.6559 175.6969 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 54 F 8.18 4.61 0.00 3.15 3.06 0.00 0.00 0.00 0.00 0.00 0.00 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 D 9.01 5.19 0.00 2.65 2.55 0.00 0.00 0.00 0.00 0.00 0.00 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 V 9.51 4.55 2.11 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 1.08 0.00 0.00 0.98 0.00 0.00 57 I 8.78 4.72 1.97 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.49 0.99 0.00 0.00 58 L 8.78 4.74 0.00 1.68 1.69 0.92 0.38 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 59 K 8.84 4.28 0.00 1.83 1.81 0.00 1.70 0.00 0.00 1.71 0.00 0.00 2.94 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.42 1.39 7.81 60 A 7.60 4.70 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 61 A 8.85 3.79 1.31 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 62 G 7.99 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 A 8.28 4.46 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 64 N 7.34 4.93 0.00 2.69 2.66 0.00 0.00 6.91 6.22 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 65 K 7.87 4.06 0.00 1.86 1.79 0.00 1.78 0.00 0.00 1.74 0.00 0.00 2.91 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.51 1.49 7.81 66 V 7.95 3.54 2.22 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 0.99 0.00 0.00 0.93 0.00 0.00 67 A 8.60 4.01 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 68 V 7.84 3.50 2.30 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 1.04 0.00 0.00 1.04 0.00 0.00 69 I 8.30 3.77 2.09 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 0.52 0.91 0.00 0.00 70 K 7.94 3.92 0.00 1.99 1.85 0.00 1.68 0.00 0.00 1.65 0.00 0.00 2.98 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.46 1.69 7.81 71 A 8.16 4.03 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 72 V 8.32 3.58 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 1.11 0.00 0.00 0.97 0.00 0.00 73 R 8.59 4.07 0.00 2.14 2.19 0.00 2.87 0.00 0.00 3.17 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 2.01 0.00 74 G 8.51 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 75 A 8.01 4.28 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 76 T 8.76 4.32 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 1.25 0.00 0.00 77 G 8.20 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 0.00 0.00 0.00 78 L 7.55 4.16 0.00 1.60 1.62 0.92 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 79 G 8.62 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 80 L 8.66 3.90 0.00 1.76 1.72 0.92 0.72 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 81 K 8.05 3.91 0.00 1.86 1.77 0.00 1.80 0.00 0.00 1.82 0.00 0.00 2.99 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.69 1.53 7.81 82 E 8.27 3.91 0.00 2.18 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 2.41 2.36 0.00 83 A 8.40 3.97 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 84 K 8.15 3.83 0.00 1.88 1.99 0.00 1.66 0.00 0.00 1.65 0.00 0.00 2.94 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.59 1.49 7.81 85 D 8.27 4.34 0.00 2.80 2.73 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.23 3.95 0.00 1.79 1.91 0.92 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 87 V 8.11 3.59 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 0.98 0.00 0.00 0.97 0.00 0.00 88 E 8.59 4.28 0.00 2.11 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 2.34 2.45 0.00 89 S 7.76 4.76 0.00 3.98 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 90 A 7.04 4.24 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 91 P 0.00 4.81 0.00 2.09 2.06 0.00 3.72 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 1.97 0.00 92 A 8.62 4.73 1.22 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 0.00 0.00 93 A 8.73 4.22 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 94 L 8.90 4.30 0.00 1.70 1.74 0.93 1.12 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 95 K 7.75 4.76 0.00 1.68 1.65 0.00 1.63 0.00 0.00 1.83 0.00 0.00 2.81 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.44 1.48 7.81 96 E 8.37 4.67 0.00 1.89 1.81 0.00 0.00 0.00 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 2.30 0.00 97 G 8.73 3.66 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 0.00 0.00 0.00 98 V 7.68 4.52 2.11 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 0.78 0.00 0.00 1.09 0.00 0.00 99 S 8.32 4.35 0.00 4.06 4.02 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 0.00 0.00 0.00 100 K 8.72 3.45 0.00 1.53 1.66 0.00 1.52 0.00 0.00 1.56 0.00 0.00 2.65 0.00 0.00 2.83 0.00 0.00 0.00 0.00 0.45 0.31 7.81 101 D 7.93 4.29 0.00 2.77 2.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 102 D 7.78 4.32 0.00 2.94 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 0.00 103 A 8.19 3.96 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 0.00 104 E 8.65 3.90 0.00 1.98 1.87 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 2.25 2.23 0.00 105 A 7.91 3.90 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 0.00 106 L 7.87 3.95 0.00 1.78 1.68 0.92 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 107 K 8.09 3.83 0.00 2.00 1.91 0.00 1.68 0.00 0.00 1.67 0.00 0.00 2.97 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.44 1.47 7.81 108 K 8.14 4.15 0.00 2.03 2.04 0.00 1.35 0.00 0.00 1.63 0.00 0.00 2.96 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.63 1.51 7.81 109 A 7.52 3.96 1.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 110 L 8.05 3.95 0.00 1.88 1.73 0.92 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 111 E 8.09 3.96 0.00 2.07 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 2.35 2.51 0.00 112 E 8.04 4.07 0.00 2.17 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 2.42 2.47 0.00 113 A 7.59 4.24 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 0.00 114 G 8.73 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 0.00 0.00 0.00 115 A 7.15 4.78 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 0.00 116 E 9.04 4.22 0.00 2.10 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 2.28 2.30 0.00 117 V 8.33 4.67 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 0.86 0.00 0.00 0.93 0.00 0.00 118 E 9.26 4.76 0.00 2.01 1.74 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 2.20 2.23 0.00 119 V 8.45 5.00 2.15 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 1.09 0.00 0.00 0.97 0.00 0.00 120 K 8.73 4.23 0.00 1.89 1.82 0.00 1.25 0.00 0.00 1.67 0.00 0.00 3.00 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.33 1.45 7.81