NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 79 T 4.3281 8.1749 117.3746 62.9840 68.7256 173.2942 80 D 4.4868 8.3347 125.9882 52.4436 41.6165 175.9625 81 S 4.5437 9.9129 118.7796 57.5656 66.5121 174.7163 82 E 4.0345 8.7328 122.7081 59.5953 29.2602 178.7686 83 E 4.0658 8.1525 117.1392 59.1647 29.8629 178.7652 84 E 4.1454 8.2742 119.5471 59.5778 29.6658 179.4351 85 I 3.9558 8.1763 119.8861 64.3794 37.2375 178.3676 86 R 4.3009 8.2639 119.4945 58.9315 29.6628 178.3994 87 E 4.0499 8.0913 117.9762 59.2619 29.8090 178.5595 88 A 4.3024 8.2231 120.9318 55.2131 18.4175 179.3307 89 F 3.1630 8.2472 119.0637 61.4015 39.1837 177.6363 90 R 3.9131 7.8958 116.0207 58.8945 29.8214 178.8957 91 V 3.7122 7.5635 117.7592 65.9201 31.5875 177.8996 92 F 4.1620 8.1215 115.7358 60.0871 40.5375 176.8600 93 D 4.6966 7.6278 118.4463 53.3133 36.6808 176.3771 94 K 3.9521 7.7494 123.0581 59.4644 33.0308 177.9684 95 D 4.6433 7.7905 116.2278 52.5111 40.4674 174.9362 96 G 3.6015 8.3102 106.5109 48.1582 0.0000 173.3126 97 N 4.2336 7.6930 119.0789 51.4276 38.9890 174.9396 98 G 4.2041 8.3408 107.1427 44.9132 0.0000 173.4494 99 Y 5.1246 8.1507 114.4189 56.2867 42.8421 176.4758 100 I 4.3883 9.1964 124.7549 60.0347 38.9743 175.9533 101 S 4.9325 8.9851 122.4786 57.0055 65.2157 175.4071 102 A 3.9710 8.6973 120.9410 55.3073 18.1323 179.6246 103 A 3.8836 7.9356 118.7244 55.3007 18.6568 179.5830 104 E 3.9443 8.1657 117.0520 59.5268 29.4961 179.3083 105 L 4.0964 8.2900 120.7122 58.1052 42.0942 178.9688 106 R 3.8515 8.3201 118.9677 59.8402 29.9062 178.0943 107 H 4.1857 7.9807 115.7146 58.9710 28.6330 177.8302 108 V 3.4270 7.7034 119.5742 66.2808 31.4756 177.8687 109 M 4.0254 8.3250 118.6392 58.5699 31.8737 178.4491 110 T 4.5595 7.6455 115.5503 64.3509 68.9134 176.7792 111 N 4.4669 7.8279 117.9185 55.1869 38.6658 175.6196 112 L 4.6077 7.7945 119.9270 54.5523 43.7147 176.3983 113 G 3.9304 7.8995 103.3927 46.5087 0.0000 175.4061 114 E 4.4596 8.2242 118.1945 54.0183 32.3619 175.6931 115 K 4.1638 8.6197 124.3103 56.0530 32.7927 176.8725 116 L 4.9682 8.1654 122.7644 52.5408 45.4374 176.8722 117 T 4.3472 8.3718 111.9718 61.0360 71.2204 175.6622 118 D 4.3729 8.5454 121.0942 57.6673 40.8001 178.7963 119 E 3.9232 8.1293 119.2215 59.2404 29.6391 178.5427 120 E 4.0550 7.8391 117.7391 58.8764 29.4569 179.3399 121 V 3.5237 7.8403 118.4884 65.9943 31.6948 177.2169 122 D 4.3897 8.2320 118.1198 57.8668 41.1457 178.5004 123 E 4.0507 8.2931 118.5673 59.8514 28.9406 179.5711 124 M 4.0997 7.8477 118.1257 58.3549 32.0500 178.5317 125 I 3.7237 7.9654 120.0570 64.4170 37.1098 178.0103 126 R 3.8785 8.3254 118.7751 59.9293 29.9783 177.9604 127 E 4.0282 7.9993 116.1313 58.4417 29.6162 177.6266 128 A 4.5471 7.2619 118.3475 52.8789 21.3425 178.0478 129 D 4.8044 8.5870 118.1589 53.8427 38.0229 176.2704 130 I 3.7618 7.9676 124.0412 64.2763 37.6476 177.2419 131 D 4.4325 8.0081 117.4613 53.9984 39.3955 177.4781 132 G 3.9540 7.8896 107.3950 45.0664 0.0000 173.5313 133 D 4.6000 8.3142 119.9111 53.1695 40.0730 175.9677 134 G 4.3234 8.2622 106.3493 45.6299 0.0000 173.1150 135 Q 4.6462 8.0414 116.1677 54.5467 32.8420 173.8690 136 V 4.6622 8.8929 119.9628 61.4347 33.2471 175.0805 137 N 5.0284 10.6299 127.0679 51.8534 39.6893 175.5985 138 Y 3.5444 8.5516 119.3535 60.9022 38.0392 178.0811 139 E 3.8881 8.1832 117.6592 59.4434 29.6850 178.7614 140 E 4.0120 8.1420 119.1407 59.0662 29.5237 178.7587 141 F 3.9969 8.4425 120.9436 61.0472 39.3959 177.3412 142 V 3.3273 7.5919 118.0024 65.8821 31.3904 178.0960 143 Q 3.8702 7.5598 116.6564 59.1399 28.4296 178.2951 144 M 4.0453 7.7480 117.0950 57.8584 32.1991 177.0846 145 M 4.0750 7.0087 116.9853 57.3540 32.9974 177.5473 146 T 4.1214 7.6050 113.1921 64.2448 68.8796 174.5846 147 A 4.1257 7.2966 128.4447 52.3364 18.4431 177.2563 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 79 T 8.17 4.33 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 1.21 0.00 0.00 80 D 8.33 4.49 0.00 2.77 2.65 0.00 0.00 0.00 0.00 0.00 0.00 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 S 9.91 4.54 0.00 4.02 4.07 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.73 4.03 0.00 2.11 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 2.39 2.45 0.00 83 E 8.15 4.07 0.00 2.25 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 0.00 2.38 2.42 0.00 84 E 8.27 4.15 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 2.37 2.39 0.00 85 I 8.18 3.96 2.06 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.92 1.05 0.00 0.00 86 R 8.26 4.30 0.00 1.86 2.17 0.00 3.03 0.00 0.00 3.00 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.70 0.00 87 E 8.09 4.05 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 2.39 2.63 0.00 88 A 8.22 4.30 1.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 89 F 8.25 3.16 0.00 3.13 3.19 0.00 0.00 0.00 0.00 0.00 0.00 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 R 7.90 3.91 0.00 2.06 2.01 0.00 3.28 0.00 0.00 3.19 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.97 0.00 91 V 7.56 3.71 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 0.66 0.00 0.00 0.97 0.00 0.00 92 F 8.12 4.16 0.00 2.61 2.93 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 0.00 0.00 0.00 93 D 7.63 4.70 0.00 1.96 2.29 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 94 K 7.75 3.95 0.00 1.77 1.84 0.00 1.77 0.00 0.00 1.76 0.00 0.00 2.99 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.40 1.62 7.81 95 D 7.79 4.64 0.00 2.84 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 96 G 8.31 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 97 N 7.69 4.23 0.00 3.08 2.99 0.00 0.00 5.88 7.00 0.00 0.00 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 G 8.34 4.20 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 0.00 99 Y 8.15 5.12 0.00 3.01 2.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 100 I 9.20 4.39 1.89 0.00 0.00 0.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.95 0.24 0.99 0.00 0.00 101 S 8.99 4.93 0.00 3.93 4.04 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 0.00 0.00 0.00 102 A 8.70 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 0.00 103 A 7.94 3.88 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.17 3.94 0.00 2.24 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 0.00 2.34 2.34 0.00 105 L 8.29 4.10 0.00 1.77 1.73 1.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 106 R 8.32 3.85 0.00 1.87 1.82 0.00 3.12 0.00 0.00 3.14 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.65 0.00 107 H 7.98 4.19 0.00 3.39 3.31 0.00 5.67 0.00 0.00 0.00 0.00 6.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 108 V 7.70 3.43 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.53 0.00 0.00 0.63 0.00 0.00 109 M 8.32 4.03 0.00 2.06 2.13 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 3.01 0.00 110 T 7.65 4.56 4.52 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 1.22 0.00 0.00 111 N 7.83 4.47 0.00 2.71 2.84 0.00 0.00 6.96 8.41 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 0.00 112 L 7.79 4.61 0.00 1.60 1.66 0.85 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 113 G 7.90 3.93 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 0.00 0.00 0.00 0.00 0.00 0.00 114 E 8.22 4.46 0.00 2.05 1.83 0.00 0.00 0.00 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 2.41 0.00 115 K 8.62 4.16 0.00 1.74 1.75 0.00 1.68 0.00 0.00 1.70 0.00 0.00 2.80 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.44 1.46 7.81 116 L 8.17 4.97 0.00 1.58 1.52 0.94 0.92 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 0.00 117 T 8.37 4.35 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 1.21 0.00 0.00 118 D 8.55 4.37 0.00 2.74 2.77 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 0.00 0.00 0.00 119 E 8.13 3.92 0.00 2.03 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 2.53 2.40 0.00 120 E 7.84 4.05 0.00 2.34 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 2.31 0.00 121 V 7.84 3.52 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 1.12 0.00 0.00 0.97 0.00 0.00 122 D 8.23 4.39 0.00 2.93 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 0.00 123 E 8.29 4.05 0.00 2.36 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 2.37 0.00 124 M 7.85 4.10 0.00 2.09 2.26 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.83 2.60 0.00 125 I 7.97 3.72 2.10 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.13 0.96 0.00 0.00 126 R 8.33 3.88 0.00 1.82 2.21 0.00 3.27 0.00 0.00 3.15 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.68 0.00 127 E 8.00 4.03 0.00 2.32 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.47 0.00 128 A 7.26 4.55 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 0.00 129 D 8.59 4.80 0.00 2.86 2.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 130 I 7.97 3.76 1.89 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.81 0.92 0.00 0.00 131 D 8.01 4.43 0.00 2.78 2.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 132 G 7.89 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 0.00 0.00 0.00 133 D 8.31 4.60 0.00 2.80 2.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 134 G 8.26 4.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 135 Q 8.04 4.65 0.00 2.28 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.66 6.61 0.00 0.00 0.00 0.00 0.00 2.17 2.37 0.00 136 V 8.89 4.66 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.00 0.00 1.00 0.00 0.00 137 N 10.63 5.03 0.00 2.59 3.19 0.00 0.00 6.15 7.45 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 0.00 138 Y 8.55 3.54 0.00 2.44 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 0.00 139 E 8.18 3.89 0.00 2.28 2.24 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 2.38 2.48 0.00 140 E 8.14 4.01 0.00 2.22 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 0.00 2.42 2.40 0.00 141 F 8.44 4.00 0.00 3.36 3.16 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 0.00 0.00 0.00 142 V 7.59 3.33 2.03 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 0.87 0.00 0.00 0.38 0.00 0.00 143 Q 7.56 3.87 0.00 2.19 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.59 0.00 0.00 0.00 0.00 0.00 2.51 2.47 0.00 144 M 7.75 4.05 0.00 1.62 2.02 0.00 0.00 0.00 0.00 0.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.46 2.51 0.00 145 M 7.01 4.07 0.00 1.78 1.95 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.43 0.00 146 T 7.61 4.12 4.17 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 1.17 0.00 0.00 147 A 7.30 4.13 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