NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 79 T 4.3226 8.1749 117.3745 62.9889 69.2263 173.5087 80 D 4.4473 8.6322 126.8681 52.9261 41.4198 176.0213 81 S 4.5424 9.7629 119.1032 57.4613 66.5097 174.9811 82 E 4.0477 8.6052 121.9432 59.4732 29.5363 178.4475 83 E 4.0523 8.1770 117.1179 59.2685 29.5967 178.8560 84 E 4.0600 8.2453 119.8483 59.3973 29.4810 179.2796 85 I 3.9741 8.2684 120.2579 64.3206 37.1818 178.3970 86 R 4.1812 8.4692 119.7202 59.6184 29.6753 178.3735 87 E 4.0495 8.0726 116.7191 59.4488 29.7688 178.9704 88 A 4.3245 8.1195 120.8754 55.1520 18.4450 179.2582 89 F 2.8648 8.8491 119.6384 61.3752 39.1648 177.6291 90 R 3.9717 8.0155 116.3220 58.8642 29.8246 178.9244 91 V 3.7055 7.5668 117.9200 65.8633 31.5776 177.8141 92 F 4.1972 8.0834 116.0938 59.8475 40.3481 176.1134 93 D 4.7193 7.5526 118.6464 52.4555 39.4042 175.3218 94 K 3.9442 8.0992 123.0553 59.3491 32.6424 177.7659 95 D 4.6621 8.1665 116.2026 52.9521 40.6611 176.2003 96 G 4.1919 8.3214 106.9332 44.6897 0.0000 172.9060 97 N 5.0206 8.6294 116.5276 50.7665 39.6565 177.7817 98 G 3.9724 8.4995 108.8181 45.5114 0.0000 172.7455 99 Y 5.2868 9.4250 116.4787 56.0590 42.6017 175.2281 100 I 4.6469 8.8997 123.1511 59.8589 39.4955 175.9621 101 S 4.8610 8.9732 122.4775 56.8903 65.2319 175.3245 102 A 4.0055 8.6248 120.7845 55.0309 18.0553 179.6629 103 A 3.9126 7.9190 118.9092 55.3216 18.6177 179.5025 104 E 3.9385 7.9755 116.8948 59.5319 29.5191 179.1867 105 L 4.0716 8.0797 120.3437 58.4437 42.2527 178.9581 106 R 3.8767 8.2707 118.5858 59.8029 29.8782 178.2242 107 H 4.1747 8.1442 115.8419 58.6456 28.6116 177.9097 108 V 3.4408 7.8771 120.0103 66.3629 31.3956 178.0076 109 M 4.0220 8.3400 118.6843 58.5724 31.7038 178.5670 110 T 4.5950 7.7592 116.0168 64.8431 68.6456 176.9361 111 N 4.3738 7.7712 117.8510 55.7450 38.5396 175.8963 112 L 4.5356 7.8756 119.1493 54.7609 42.6939 177.3341 113 G 3.8297 8.1161 105.3706 46.2265 0.0000 174.6863 114 E 4.3649 8.6109 119.6766 53.9468 31.1297 175.0878 115 K 4.2766 8.5345 123.9654 55.6779 32.0623 176.8814 116 L 4.9341 8.1174 123.8530 52.7239 44.5311 177.3209 117 T 4.2339 8.2102 111.3587 61.4152 70.9664 175.4487 118 D 4.3377 8.6871 122.0022 57.8620 40.8200 179.0097 119 E 3.9483 8.0894 119.1647 59.2143 29.7448 178.5620 120 E 3.9988 8.0500 118.5013 59.1701 29.4660 179.4398 121 V 3.5749 8.0701 118.6022 66.0105 31.6377 177.3437 122 D 4.3535 8.2186 117.8352 57.6597 41.1307 178.1389 123 E 4.0177 8.2511 118.7674 59.8220 28.9301 179.3836 124 M 4.1224 8.1541 118.6231 58.4038 31.9319 178.9493 125 I 3.7840 8.2385 120.4689 64.3760 37.0845 178.3618 126 R 3.8899 8.2601 118.9089 59.4460 29.8611 177.8004 127 E 4.0329 8.0092 117.8180 58.6771 29.7448 177.8564 128 A 4.4799 7.3781 117.4218 52.3451 21.0653 177.9445 129 D 4.6434 8.0482 119.3057 52.6951 37.6188 176.1085 130 I 3.7286 7.6714 124.4943 64.3120 37.6989 177.4590 131 D 4.4448 8.6351 116.7690 53.6620 39.6847 177.3931 132 G 3.8785 8.0403 108.5923 45.5560 0.0000 173.3197 133 D 4.6919 8.3162 119.6837 52.7298 40.7474 176.1250 134 G 4.1757 8.2498 106.4209 45.1135 0.0000 172.8234 135 Q 4.6289 8.2312 116.1986 54.4979 32.8248 174.2736 136 V 4.5988 8.9220 120.2717 61.5646 33.0694 175.2790 137 N 5.1993 9.6812 127.3080 52.0583 39.5872 175.5845 138 Y 3.5733 8.4472 118.5439 60.8015 38.6711 177.7655 139 E 3.8176 8.1797 117.9495 59.4595 29.5981 178.7302 140 E 3.9405 8.1513 119.0399 59.0640 29.5550 178.8499 141 F 4.0400 8.2113 120.7083 61.1294 39.4118 177.1261 142 V 3.2707 7.6848 118.1030 66.2571 31.0281 178.0768 143 Q 3.9180 7.5925 116.0432 58.9822 28.6914 178.1664 144 M 4.0447 7.9405 119.3947 58.9267 32.0944 178.2686 145 M 3.9572 7.7071 117.5585 57.9508 32.0475 178.1752 146 T 4.1258 7.2454 114.2137 64.9016 68.9532 174.5731 147 A 4.1242 7.3342 126.5891 52.4693 18.3798 176.9702 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 4.32 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 1.21 0.00 0.00 80 D 8.63 4.45 0.00 2.73 2.66 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 81 S 9.76 4.54 0.00 4.03 4.03 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 0.00 0.00 0.00 0.00 82 E 8.61 4.05 0.00 2.12 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 2.38 2.44 0.00 83 E 8.18 4.05 0.00 2.25 2.21 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 2.39 2.43 0.00 84 E 8.25 4.06 0.00 2.36 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 8.27 3.97 2.10 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 1.46 0.98 1.04 0.00 0.00 86 R 8.47 4.18 0.00 1.82 2.18 0.00 3.01 0.00 0.00 2.92 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.69 0.00 87 E 8.07 4.05 0.00 2.28 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 0.00 2.40 2.57 0.00 88 A 8.12 4.32 1.67 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 0.00 0.00 89 F 8.85 2.86 0.00 3.13 3.29 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 90 R 8.02 3.97 0.00 2.13 2.03 0.00 3.40 0.00 0.00 3.19 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.87 0.00 91 V 7.57 3.71 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 0.62 0.00 0.00 0.96 0.00 0.00 92 F 8.08 4.20 0.00 2.54 2.87 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 93 D 7.55 4.72 0.00 2.14 2.45 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 94 K 8.10 3.94 0.00 1.76 1.85 0.00 1.73 0.00 0.00 1.72 0.00 0.00 2.95 0.00 0.00 2.74 0.00 0.00 0.00 0.00 1.40 1.41 7.81 95 D 8.17 4.66 0.00 2.82 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 96 G 8.32 4.19 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 0.00 0.00 0.00 97 N 8.63 5.02 0.00 3.22 3.06 0.00 0.00 6.94 6.57 0.00 0.00 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 8.50 3.97 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 0.00 0.00 0.00 0.00 0.00 0.00 99 Y 9.43 5.29 0.00 2.80 2.90 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 0.00 100 I 8.90 4.65 1.82 0.00 0.00 -0.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.62 0.36 0.93 0.00 0.00 101 S 8.97 4.86 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 8.62 4.01 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 7.92 3.91 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 0.00 104 E 7.98 3.94 0.00 2.16 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 2.35 2.35 0.00 105 L 8.08 4.07 0.00 1.98 1.83 0.99 0.99 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 0.00 106 R 8.27 3.88 0.00 1.89 2.01 0.00 3.10 0.00 0.00 3.13 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.64 0.00 107 H 8.14 4.17 0.00 3.47 3.29 0.00 5.68 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 108 V 7.88 3.44 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 0.69 0.00 0.00 0.66 0.00 0.00 109 M 8.34 4.02 0.00 2.05 2.11 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.66 2.95 0.00 110 T 7.76 4.60 4.49 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 0.00 0.00 0.00 1.21 0.00 0.00 111 N 7.77 4.37 0.00 2.78 2.84 0.00 0.00 7.00 8.96 0.00 0.00 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 7.88 4.54 0.00 1.63 1.65 0.83 1.03 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 0.00 113 G 8.12 3.83 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 0.00 0.00 0.00 0.00 0.00 0.00 114 E 8.61 4.36 0.00 2.01 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.38 2.40 0.00 115 K 8.53 4.28 0.00 1.74 1.77 0.00 1.70 0.00 0.00 1.70 0.00 0.00 2.83 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.43 1.45 7.81 116 L 8.12 4.93 0.00 1.60 1.55 0.94 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 117 T 8.21 4.23 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 8.69 4.34 0.00 2.74 2.78 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 0.00 119 E 8.09 3.95 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 2.47 2.40 0.00 120 E 8.05 4.00 0.00 2.32 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 2.31 0.00 121 V 8.07 3.57 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 1.09 0.00 0.00 0.95 0.00 0.00 122 D 8.22 4.35 0.00 2.75 2.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 123 E 8.25 4.02 0.00 2.32 2.00 0.00 0.00 0.00 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 2.36 0.00 124 M 8.15 4.12 0.00 2.11 2.27 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 2.80 2.60 0.00 125 I 8.24 3.78 1.90 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.76 0.94 0.00 0.00 126 R 8.26 3.89 0.00 1.85 2.13 0.00 3.27 0.00 0.00 3.15 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.65 0.00 127 E 8.01 4.03 0.00 2.33 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 2.32 2.47 0.00 128 A 7.38 4.48 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 0.00 129 D 8.05 4.64 0.00 2.88 2.60 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 0.00 130 I 7.67 3.73 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 0.85 0.92 0.00 0.00 131 D 8.64 4.44 0.00 2.78 2.81 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 0.00 0.00 0.00 132 G 8.04 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 133 D 8.32 4.69 0.00 2.78 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 0.00 134 G 8.25 4.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.23 4.63 0.00 2.26 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.67 6.66 0.00 0.00 0.00 0.00 0.00 2.61 2.53 0.00 136 V 8.92 4.60 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 0.98 0.00 0.00 137 N 9.68 5.20 0.00 2.75 3.26 0.00 0.00 6.20 7.52 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 0.00 138 Y 8.45 3.57 0.00 2.43 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 0.00 139 E 8.18 3.82 0.00 2.27 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 2.39 2.48 0.00 140 E 8.15 3.94 0.00 2.26 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 0.00 2.43 2.41 0.00 141 F 8.21 4.04 0.00 3.36 3.18 0.00 0.00 0.00 0.00 0.00 0.00 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 7.68 3.27 2.07 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 0.87 0.00 0.00 0.38 0.00 0.00 143 Q 7.59 3.92 0.00 2.16 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.73 0.00 0.00 0.00 0.00 0.00 2.53 2.47 0.00 144 M 7.94 4.04 0.00 1.86 2.02 0.00 0.00 0.00 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.47 2.53 0.00 145 M 7.71 3.96 0.00 1.73 1.84 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.33 0.00 146 T 7.25 4.13 4.28 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 1.17 0.00 0.00 147 A 7.33 4.12 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