NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 16 N 4.5676 8.2785 119.1984 53.1724 39.8689 174.8827 17 A 3.8833 8.3536 128.8690 54.8526 18.3007 177.4527 18 Y 4.4230 8.5587 116.3538 61.4697 38.3959 177.0627 19 R 3.9980 8.6332 119.2203 59.1181 30.0638 178.8660 20 Q 3.9559 8.2001 119.5232 59.1045 29.1744 178.1092 21 S 4.1189 8.5088 114.5483 61.6519 62.4592 176.2442 22 Q 3.9977 8.4711 120.9515 58.9003 28.4473 178.5818 23 S 4.1087 8.4093 114.4699 61.6308 62.4781 176.4317 24 R 3.9337 8.3425 120.6597 59.2632 29.7374 178.9756 25 A 4.0066 8.0089 119.9899 55.0969 18.3947 179.5461 26 A 4.0278 8.1883 119.2926 55.3483 18.5470 180.0935 27 R 3.7725 8.1772 116.6186 59.3009 30.1393 179.1047 28 L 3.9162 8.0096 120.0301 58.1775 42.0518 179.1438 29 R 3.8748 8.2599 118.3174 59.0483 29.9635 178.4681 30 L 3.8437 7.9056 120.1065 58.2848 41.9353 179.1605 31 L 3.8604 7.6016 118.1797 57.9311 41.6252 180.0418 32 V 3.6039 7.8590 112.2967 64.4666 31.2684 178.5094 33 D 4.3036 8.3915 118.9711 57.7314 40.6170 179.0448 34 T 3.9663 8.1100 116.4498 66.4559 67.9005 177.0136 35 G 3.6036 8.1692 107.9501 47.9029 0.0000 175.7636 36 Q 4.0595 7.8288 119.0928 58.6350 28.9351 177.9110 37 E 4.0450 7.8942 121.2289 58.8043 29.4579 178.1147 38 L 3.8918 8.0911 121.4083 58.1600 42.1054 178.6242 39 I 3.9731 7.2751 108.0356 62.3214 37.6589 176.2584 40 Q 4.3888 7.8518 119.2910 56.1395 29.6378 175.5730 41 L 4.6005 7.2030 117.8250 52.1657 43.1198 174.7608 42 P 4.5134 0.0000 0.0000 61.8602 32.2348 175.4759 43 P 4.1738 0.0000 0.0000 65.9615 31.7527 177.7779 44 E 4.0016 8.3941 117.8873 59.3775 29.7552 179.7871 45 A 3.9443 7.3897 119.7915 52.7894 18.4453 179.4146 *47 R 4.2305 8.1392 120.0715 57.7503 32.3887 178.0797 48 K 3.9370 8.0051 118.1360 59.8442 32.1353 178.6909 49 C 4.1708 8.3894 117.2136 62.6015 28.0068 176.2092 50 V 3.5731 7.6899 119.4676 65.7667 31.0841 177.6357 51 L 3.9333 7.8152 119.7430 58.3106 41.9169 178.9869 52 Q 3.8397 8.1402 117.8909 59.0997 28.6680 179.1215 53 R 3.9260 8.1445 118.8312 58.9287 29.8284 178.9462 54 A 4.0394 8.0509 120.0159 55.4318 18.2972 179.0178 55 C 4.2310 8.3457 115.1963 63.1793 28.3901 176.4258 56 A 4.0485 8.2399 122.2218 55.0299 17.6760 179.3867 57 F 4.2725 8.2565 118.6180 60.8245 39.5008 176.2757 58 V 3.6665 7.3611 107.9217 59.6371 31.6327 174.2600 59 A 3.4017 7.4540 123.7220 52.7121 16.1032 177.2635 *61 D 4.7620 8.4137 119.1488 54.0271 41.4734 175.0372 62 H 5.2252 8.5967 116.1726 54.8213 33.7358 172.2956 63 G 4.4437 8.9719 105.9688 45.9910 0.0000 172.2770 64 L 5.3851 8.9961 119.7218 52.7840 46.7211 175.2610 65 L 5.0744 8.8987 124.3815 53.4275 44.2332 174.9469 66 L 5.3894 8.8691 126.4066 53.1624 44.8341 175.4670 67 E 4.8275 9.2351 121.4177 54.5126 34.1230 174.4308 68 W 5.5146 7.7210 119.1912 55.0553 31.8713 173.9052 69 G 3.7458 10.0535 104.9785 45.7251 0.0000 174.3990 70 A 4.3739 7.6536 116.3847 53.7879 22.2074 178.0262 *72 N 4.6346 7.6657 112.9354 51.6262 40.2877 179.0979 73 G 4.0348 8.0535 100.9021 45.6130 0.0000 172.8531 74 V 4.4804 8.4917 126.0236 62.7708 32.5450 175.0377 75 Q 4.8075 9.4823 126.9251 54.4178 32.1692 174.7234 76 T 4.9226 8.6124 120.2084 63.0690 68.9882 174.6056 77 T 4.6176 8.9181 116.6621 61.5827 70.1725 174.1683 78 A 4.7139 7.6117 122.6141 51.2638 22.6239 175.0770 79 R 5.0403 8.4238 119.2890 55.0709 33.7715 173.6888 80 H 4.7426 9.4425 124.9933 55.6887 33.1783 174.0993 81 G 3.5876 8.7004 112.6127 44.4047 0.0000 172.4818 82 S 4.0329 8.3618 111.9379 58.7473 62.9547 174.8403 83 K 3.9926 8.7278 130.2807 59.4088 31.8216 178.4034 84 E 3.9141 8.0680 117.7414 59.6169 29.9284 179.0025 85 R 4.0118 8.0233 117.8766 59.3330 29.9414 179.1950 86 L 4.1199 8.1701 118.6852 57.2835 41.3408 179.5736 87 S 4.1643 7.8554 114.2534 61.3508 63.0274 176.2634 88 T 3.9671 7.4874 112.1798 65.9361 68.7099 175.0884 89 L 4.0218 7.4829 120.7922 54.0391 42.8706 176.5042 *93 A 3.8186 8.2157 120.9482 52.9338 18.5075 174.7402 94 D 4.5360 7.9358 120.3604 52.1777 41.5912 175.3497 95 P 4.8436 0.0000 0.0000 64.5232 31.7210 177.7654 96 L 4.2506 7.9845 118.0099 55.4597 42.1592 176.9802 97 A 4.2904 7.6972 122.2625 51.9429 18.8067 177.2778 98 I 4.4444 8.3508 113.0773 60.4186 39.6552 175.8808 99 G 4.2441 7.8420 107.3254 43.8603 0.0000 171.8542 100 P 4.9457 0.0000 0.0000 62.8897 32.6020 175.5686 101 Q 4.6189 8.9164 121.5741 54.5341 32.8859 172.8825 102 W 5.3252 9.0122 135.0000 55.8167 32.6062 174.6491 103 L 4.6293 8.5692 127.4430 52.9083 43.7923 175.2644 104 E 4.6518 8.5596 123.1130 55.0903 31.1769 176.8300 105 R 4.5879 8.9241 121.9733 53.2745 30.7690 172.5181 106 P 4.2049 0.0000 0.0000 63.8204 32.2703 177.1260 107 G 3.8226 8.8474 109.5993 45.9794 0.0000 172.9099 108 T 4.4601 7.2980 109.0722 59.5902 70.9915 174.1453 109 H 4.3755 8.4514 117.3066 57.9491 28.8642 174.9942 110 L 5.1440 7.1471 118.2498 50.6006 41.7717 174.8994 111 P 4.7982 0.0000 0.0000 64.1735 32.9343 175.7104 112 C 4.8133 7.6783 117.2468 57.6933 32.5002 173.5100 113 V 4.5984 7.5632 121.9011 61.0766 35.0486 173.2350 114 L 5.2971 9.2302 129.9453 53.3970 44.5880 174.6438 115 L 5.1422 9.0695 126.4861 53.1056 44.4853 175.5309 116 L 4.7157 8.9096 123.4353 51.8884 44.0636 173.9960 117 P 4.6716 0.0000 0.0000 62.6883 32.4654 175.8926 118 L 4.3696 8.5158 123.9313 53.1402 43.3496 175.7563 119 R 4.8829 8.4908 123.4059 54.3634 32.2944 175.5997 120 G 4.2665 8.3749 112.6967 44.9290 0.0000 175.3336 121 A 4.1355 8.7007 125.5452 54.1018 18.4845 177.1341 122 D 4.9522 7.1185 115.1102 51.8738 43.4299 175.6330 123 E 4.0844 8.5261 121.0305 57.6386 30.8759 178.5766 124 G 3.9508 8.6168 110.3999 46.4822 0.0000 173.7799 125 S 4.8266 9.2726 118.7226 56.5898 66.1028 174.1815 126 F 4.3712 7.8876 115.5377 55.9672 38.2853 174.9838 127 G 2.8056 6.0580 107.5759 46.5960 0.0000 171.9570 128 T 5.0348 7.9854 113.2628 60.7128 71.3253 172.5546 129 L 4.7067 8.9228 129.0523 54.1741 43.4834 175.8387 130 V 4.7398 9.1535 123.7725 61.1848 34.3491 173.9121 131 L 5.1703 9.0513 128.4426 53.0380 44.0852 175.6343 132 A 5.1353 9.3519 124.7266 50.2916 23.0849 174.1813 133 N 5.6286 8.9772 117.9514 51.8829 42.3084 175.4987 134 S 4.6094 9.1470 118.3030 58.7287 63.8334 174.3354 135 V 4.3878 7.3709 120.0293 60.3416 34.1131 174.6884 136 A 4.1497 8.5673 129.2944 52.6379 18.7031 176.6259 137 I 4.7304 7.9964 114.1053 59.0071 40.9333 174.5791 138 S 4.1819 8.4439 115.1129 57.5958 62.7839 173.5929 139 A 2.0000 7.8427 129.1121 50.7279 18.4881 175.9104 140 P 4.1418 0.0000 0.0000 62.2964 32.1929 176.7365 141 D 4.6769 8.2560 121.2335 52.5746 41.8212 177.5730 142 G 3.6647 8.4817 105.8785 48.1773 0.0000 175.6664 143 E 4.0526 8.1759 120.2973 59.1294 29.5888 178.9779 144 D 4.6008 8.6012 119.1331 57.4320 40.8858 178.7900 145 I 3.7740 7.9255 120.3724 64.3224 37.1080 178.0102 146 E 4.2080 8.2517 121.4611 58.8945 29.4743 179.1228 147 S 4.0758 8.1025 115.1045 61.6263 62.8313 176.6896 148 L 3.9583 8.0181 121.6304 57.7660 40.8873 179.5976 149 Q 3.9772 8.5644 118.5257 58.7316 28.6976 178.4462 150 L 3.9541 7.8768 121.3152 58.2042 42.0719 178.7732 151 L 3.8938 7.9185 119.8642 58.1870 41.9058 178.7607 152 A 3.9717 8.4183 121.3039 55.2725 18.2300 179.7311 153 T 3.8168 7.9633 108.5421 64.7300 68.8325 176.7515 154 L 3.9283 7.7978 122.7222 57.7030 42.1196 178.4518 155 L 3.8968 8.0753 120.2117 58.2647 41.9296 178.5764 156 A 4.1813 8.2690 120.5517 55.4203 18.2398 179.4567 157 A 3.9668 8.1199 118.9957 55.7628 18.4041 179.6642 158 H 4.0977 8.4137 114.7400 58.7132 28.8597 177.9902 159 L 3.9808 8.3932 121.3076 57.8735 41.4589 179.2229 160 E 3.6300 8.3684 119.2999 59.3179 29.5216 178.5834 161 N 4.2673 8.5055 116.9337 56.3642 38.5713 177.1698 162 N 4.3694 8.3901 118.1015 56.3272 38.5357 177.7361 163 R 3.9093 7.8589 119.2337 59.1288 30.1380 179.1208 164 L 3.9314 8.1461 119.1169 57.5299 41.5542 179.2384 165 L 3.9533 8.2235 119.4138 58.1769 41.4302 179.5377 166 E 3.9581 7.9878 116.4226 59.4090 29.4420 179.0274 167 A 4.1123 7.9862 120.0279 55.1226 18.4937 179.3617 168 L 4.1029 7.8788 116.4566 57.1617 41.8159 177.9491 169 V 3.8914 7.3136 121.9817 63.1274 31.6432 175.3193 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 16 N 8.28 4.57 0.00 2.71 2.78 0.00 0.00 6.96 7.17 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 17 A 8.35 3.88 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 18 Y 8.56 4.42 0.00 3.17 2.92 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 19 R 8.63 4.00 0.00 1.84 1.99 0.00 3.30 0.00 0.00 3.12 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.80 0.00 20 Q 8.20 3.96 0.00 2.27 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.78 0.00 0.00 0.00 0.00 0.00 2.37 2.38 0.00 21 S 8.51 4.12 0.00 4.01 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 0.00 22 Q 8.47 4.00 0.00 2.29 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.56 0.00 0.00 0.00 0.00 0.00 2.38 2.56 0.00 23 S 8.41 4.11 0.00 3.95 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 24 R 8.34 3.93 0.00 1.90 1.99 0.00 3.30 0.00 0.00 3.19 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.77 0.00 25 A 8.01 4.01 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 26 A 8.19 4.03 1.52 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 0.00 0.00 0.00 27 R 8.18 3.77 0.00 2.19 1.99 0.00 3.17 0.00 0.00 3.30 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.99 0.00 28 L 8.01 3.92 0.00 1.85 1.80 0.91 0.78 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 29 R 8.26 3.87 0.00 1.87 2.15 0.00 3.37 0.00 0.00 3.10 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.80 0.00 30 L 7.91 3.84 0.00 1.52 1.55 0.77 -0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 31 L 7.60 3.86 0.00 1.85 1.63 0.86 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 32 V 7.86 3.60 2.06 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 0.82 0.00 0.00 1.01 0.00 0.00 33 D 8.39 4.30 0.00 2.72 2.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 T 8.11 3.97 4.22 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 1.17 0.00 0.00 35 G 8.17 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 36 Q 7.83 4.06 0.00 2.21 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.12 6.92 0.00 0.00 0.00 0.00 0.00 2.36 2.69 0.00 37 E 7.89 4.04 0.00 2.03 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 2.29 2.30 0.00 38 L 8.09 3.89 0.00 1.79 1.83 0.85 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 39 I 7.28 3.97 1.89 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 1.54 0.70 0.96 0.00 0.00 40 Q 7.85 4.39 0.00 2.21 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.12 6.75 0.00 0.00 0.00 0.00 0.00 2.31 2.45 0.00 41 L 7.20 4.60 0.00 1.62 1.58 0.91 0.92 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 42 P 0.00 4.51 0.00 2.22 2.18 0.00 3.72 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 1.99 0.00 43 P 0.00 4.17 0.00 2.06 2.18 0.00 3.68 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.10 0.00 44 E 8.39 4.00 0.00 2.00 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 2.38 2.32 0.00 45 A 7.39 3.94 1.26 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 0.00 0.00 0.00 0.00 0.00 *47 R 8.14 4.23 0.00 2.05 2.03 0.00 3.24 0.00 0.00 3.28 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.86 0.00 48 K 8.01 3.94 0.00 1.87 2.00 0.00 1.64 0.00 0.00 1.65 0.00 0.00 3.00 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.45 1.50 7.81 49 C 8.39 4.17 0.00 3.04 3.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 V 7.69 3.57 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 1.09 0.00 0.00 0.90 0.00 0.00 51 L 7.82 3.93 0.00 1.93 1.82 1.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 52 Q 8.14 3.84 0.00 2.25 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.58 0.00 0.00 0.00 0.00 0.00 2.31 2.54 0.00 53 R 8.14 3.93 0.00 1.92 1.97 0.00 3.11 0.00 0.00 3.15 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.75 0.00 54 A 8.05 4.04 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 55 C 8.35 4.23 0.00 3.05 3.01 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 0.00 0.00 0.00 56 A 8.24 4.05 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 57 F 8.26 4.27 0.00 3.08 3.36 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 58 V 7.36 3.67 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 0.67 0.00 0.00 1.14 0.00 0.00 59 A 7.45 3.40 1.30 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 0.00 0.00 0.00 0.00 0.00 0.00 *61 D 8.41 4.76 0.00 2.68 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 62 H 8.60 5.23 0.00 3.24 3.20 0.00 5.84 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 G 8.97 4.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 9.00 5.39 0.00 1.56 1.54 0.95 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 65 L 8.90 5.07 0.00 1.74 1.51 0.91 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 66 L 8.87 5.39 0.00 1.82 1.80 1.06 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 67 E 9.24 4.83 0.00 1.86 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 2.16 2.17 0.00 68 W 7.72 5.51 0.00 3.31 3.23 0.00 0.00 0.00 0.00 0.00 0.00 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 G 10.05 3.75 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 0.00 0.00 0.00 70 A 7.65 4.37 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 *72 N 7.67 4.63 0.00 2.78 2.59 0.00 0.00 6.73 7.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 73 G 8.05 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 0.00 0.00 0.00 74 V 8.49 4.48 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 1.06 0.00 0.00 0.86 0.00 0.00 75 Q 9.48 4.81 0.00 2.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.64 0.00 0.00 0.00 0.00 0.00 2.49 2.50 0.00 76 T 8.61 4.92 4.27 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 1.28 0.00 0.00 77 T 8.92 4.62 4.26 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 0.00 0.00 1.30 0.00 0.00 78 A 7.61 4.71 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 R 8.42 5.04 0.00 1.80 1.76 0.00 3.20 0.00 0.00 3.17 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.65 0.00 80 H 9.44 4.74 0.00 3.22 3.19 0.00 5.84 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 G 8.70 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 S 8.36 4.03 0.00 3.92 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 83 K 8.73 3.99 0.00 1.87 1.79 0.00 1.79 0.00 0.00 1.82 0.00 0.00 2.97 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.51 1.54 7.81 84 E 8.07 3.91 0.00 1.96 1.96 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 0.00 2.30 2.33 0.00 85 R 8.02 4.01 0.00 1.87 1.87 0.00 3.21 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 1.58 1.63 0.00 86 L 8.17 4.12 0.00 1.80 1.73 1.08 0.86 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 87 S 7.86 4.16 0.00 4.04 4.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 88 T 7.49 3.97 4.26 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 0.00 0.00 1.21 0.00 0.00 89 L 7.48 4.02 0.00 1.76 1.68 0.90 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 *93 A 8.22 3.82 0.94 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 0.00 0.00 0.00 0.00 0.00 94 D 7.94 4.54 0.00 2.62 2.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 P 0.00 4.84 0.00 2.34 1.94 0.00 3.52 0.00 0.00 3.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.73 0.00 96 L 7.98 4.25 0.00 1.80 1.77 0.91 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0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 2.38 0.00 105 R 8.92 4.59 0.00 1.57 1.72 0.00 3.01 0.00 0.00 3.27 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.42 0.00 106 P 0.00 4.20 0.00 2.02 1.98 0.00 3.71 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.08 0.00 107 G 8.85 3.82 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 0.00 0.00 0.00 108 T 7.30 4.46 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 1.21 0.00 0.00 109 H 8.45 4.38 0.00 3.19 3.35 0.00 5.56 0.00 0.00 0.00 0.00 6.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 110 L 7.15 5.14 0.00 1.72 1.46 0.86 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 111 P 0.00 4.80 0.00 2.04 2.06 0.00 3.95 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 1.93 0.00 112 C 7.68 4.81 0.00 2.83 2.04 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 0.00 113 V 7.56 4.60 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.86 0.00 0.00 0.79 0.00 0.00 114 L 9.23 5.30 0.00 2.27 1.71 1.25 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 115 L 9.07 5.14 0.00 1.64 1.59 0.94 0.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 116 L 8.91 4.72 0.00 1.55 1.57 0.97 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 117 P 0.00 4.67 0.00 1.93 2.02 0.00 3.66 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 2.17 0.00 118 L 8.52 4.37 0.00 0.72 0.83 0.69 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 119 R 8.49 4.88 0.00 1.78 1.87 0.00 3.33 0.00 0.00 3.23 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.55 0.00 120 G 8.37 4.27 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 0.00 121 A 8.70 4.14 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 0.00 122 D 7.12 4.95 0.00 2.94 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 0.00 123 E 8.53 4.08 0.00 1.96 1.91 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 2.34 2.35 0.00 124 G 8.62 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 0.00 125 S 9.27 4.83 0.00 4.06 3.82 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 0.00 126 F 7.89 4.37 0.00 3.00 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 0.00 127 G 6.06 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 0.00 0.00 0.00 128 T 7.99 5.03 4.42 0.00 0.00 0.00 0.00 0.00 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 0.00 0.00 129 L 8.92 4.71 0.00 1.76 1.58 0.91 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 130 V 9.15 4.74 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 1.06 0.00 0.00 0.98 0.00 0.00 131 L 9.05 5.17 0.00 1.72 1.64 1.04 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 132 A 9.35 5.14 1.15 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 0.00 0.00 0.00 0.00 0.00 0.00 133 N 8.98 5.63 0.00 2.88 2.77 0.00 0.00 7.15 8.03 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 0.00 134 S 9.15 4.61 0.00 4.07 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 0.00 135 V 7.37 4.39 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 0.87 0.00 0.00 0.95 0.00 0.00 136 A 8.57 4.15 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 0.00 137 I 8.00 4.73 1.96 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.05 0.97 0.00 0.00 138 S 8.44 4.18 0.00 3.81 3.72 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 0.00 139 A 7.84 2.00 0.03 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 0.00 0.00 140 P 0.00 4.14 0.00 1.94 1.87 0.00 2.96 0.00 0.00 2.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.93 0.00 141 D 8.26 4.68 0.00 2.89 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 0.00 142 G 8.48 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 0.00 143 E 8.18 4.05 0.00 2.21 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 0.00 2.40 2.46 0.00 144 D 8.60 4.60 0.00 2.89 2.91 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 0.00 145 I 7.93 3.77 2.03 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.66 0.94 0.00 0.00 146 E 8.25 4.21 0.00 2.16 2.18 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 2.31 2.22 0.00 147 S 8.10 4.08 0.00 3.99 3.71 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 0.00 148 L 8.02 3.96 0.00 1.92 1.75 1.13 0.79 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 0.00 149 Q 8.56 3.98 0.00 2.24 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.78 0.00 0.00 0.00 0.00 0.00 2.39 2.54 0.00 150 L 7.88 3.95 0.00 1.75 1.80 0.91 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 151 L 7.92 3.89 0.00 1.72 1.79 0.86 0.73 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 0.00 152 A 8.42 3.97 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 0.00 153 T 7.96 3.82 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 154 L 7.80 3.93 0.00 1.79 1.85 0.98 0.60 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 0.00 155 L 8.08 3.90 0.00 1.77 1.86 0.92 1.19 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 0.00 156 A 8.27 4.18 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 157 A 8.12 3.97 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 158 H 8.41 4.10 0.00 3.34 3.38 0.00 5.63 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 0.00 159 L 8.39 3.98 0.00 2.03 1.83 1.01 0.75 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 0.00 160 E 8.37 3.63 0.00 1.77 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 2.17 2.10 0.00 161 N 8.51 4.27 0.00 2.68 2.78 0.00 0.00 7.07 6.52 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 0.00 162 N 8.39 4.37 0.00 2.95 2.85 0.00 0.00 7.02 7.97 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 0.00 163 R 7.86 3.91 0.00 1.94 1.87 0.00 3.02 0.00 0.00 3.06 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.74 0.00 164 L 8.15 3.93 0.00 1.76 1.67 0.86 0.83 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 0.00 165 L 8.22 3.95 0.00 1.82 1.71 0.90 0.79 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 0.00 166 E 7.99 3.96 0.00 2.07 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 2.33 2.31 0.00 167 A 7.99 4.11 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 0.00 168 L 7.88 4.10 0.00 1.78 1.73 0.90 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 169 V 7.31 3.89 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 0.78 0.00 0.00 0.99 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.