NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 Q 4.2728 8.3444 119.6910 55.4916 30.3840 175.3686 4 N 4.8641 7.7115 116.9898 52.5651 39.4632 174.0459 5 P 4.3527 0.0000 0.0000 65.7249 32.2386 178.1169 6 E 3.9162 8.0781 117.9747 59.3712 29.5531 179.1006 7 R 3.8878 7.9247 117.9609 58.9528 30.0287 178.3411 8 R 3.4640 7.6459 118.4852 59.1467 30.0698 178.2673 9 A 3.9770 7.8006 120.1926 55.0138 18.2431 179.4105 10 A 3.9192 7.8158 118.9098 55.4036 18.4415 179.9308 11 L 3.9404 7.6293 117.1790 57.6732 41.5978 179.9052 12 V 3.5406 8.1685 118.6308 65.9406 31.4429 177.6768 13 N 4.2289 8.2713 116.0240 56.4281 38.4292 176.9000 14 A 3.9533 8.2400 122.0124 55.4399 18.3019 179.6126 15 A 3.8324 8.1025 118.9601 55.2780 18.4934 179.9530 16 I 3.6025 8.1030 118.8014 64.3412 37.1029 178.5612 17 E 3.9033 8.5225 119.9092 59.4072 29.2829 179.4652 18 V 3.5601 7.8186 118.2121 65.9892 31.3963 178.0275 19 L 3.9491 8.1518 118.6503 57.8590 41.2740 179.4453 20 A 4.0074 7.6929 119.2127 55.0187 18.3339 179.5149 21 R 4.1100 7.8848 115.7715 58.2968 30.4334 177.6336 22 E 4.5334 8.4849 116.0942 58.7996 31.4404 174.9220 23 G 3.7928 7.4325 102.6066 42.8627 0.0000 174.4494 24 A 4.1258 9.0719 123.7129 55.9610 18.5669 180.9950 25 R 4.0331 8.0855 112.9844 59.1758 29.6230 180.0710 26 G 3.6546 7.4989 105.8960 47.5483 0.0000 173.3082 27 L 4.0414 7.4395 121.9711 54.7996 41.8656 176.1477 28 T 4.4701 7.8777 118.9974 59.2759 72.1215 174.0155 29 F 4.4855 8.2217 122.6363 60.6127 38.7841 178.0847 30 R 3.9358 8.1512 117.0462 59.4627 29.8828 178.8621 31 A 4.0101 7.9838 119.8314 54.8505 18.3544 179.7406 32 V 3.4918 7.9617 116.9750 66.2487 31.2780 177.7815 33 D 4.3777 8.0430 118.5825 57.5841 40.5186 178.8210 34 V 3.5913 7.2264 117.1617 66.3698 31.5206 177.3455 35 E 4.1083 7.8631 116.4140 57.3004 28.7103 176.6258 36 A 4.3057 7.3232 121.8991 51.6175 19.1596 178.0281 37 N 4.5660 8.5757 116.7728 55.1482 38.5054 176.4347 38 V 4.3176 7.0971 115.2729 59.2163 31.3159 173.7402 39 P 5.2346 0.0000 0.0000 63.7707 30.6014 178.6459 40 K 4.0583 7.3459 120.4212 54.5749 32.4884 181.5373 41 G 5.0625 7.0369 115.2475 45.9978 0.0000 172.0720 42 T 4.3171 7.1960 116.9636 65.1480 70.7148 177.8003 43 A 4.1916 8.4333 123.7092 55.2414 18.1285 179.6264 44 S 3.2035 7.7693 110.1208 60.8170 62.5859 175.2462 45 N 4.4534 7.6289 116.8168 54.5336 38.7221 175.2567 46 Y 3.8211 7.5652 116.8006 57.7826 38.0845 175.0498 47 F 5.1783 7.8062 118.3717 54.9317 41.8494 173.6063 48 P 4.5138 0.0000 0.0000 65.3435 31.6235 177.3035 49 S 4.9820 7.8561 108.8223 55.8596 67.2840 174.9976 50 R 3.6235 8.8353 122.4338 59.5142 29.4172 178.2525 51 D 4.4289 8.2105 117.6277 57.4314 41.2707 177.5392 52 D 4.5620 8.7389 118.8734 56.6647 41.1333 178.0357 53 L 3.3125 8.0718 121.2329 58.0533 42.0938 178.7605 54 F 3.9702 7.8394 117.7183 60.7840 38.6821 177.4647 55 D 4.4881 8.1031 119.5265 57.9547 40.7209 179.3608 56 Q 4.0822 7.9098 120.7366 60.4323 28.1642 180.8287 57 V 3.8874 7.5854 120.3784 65.6767 31.3147 178.0724 58 G 3.8665 8.5696 107.3059 48.4063 0.0000 175.6725 59 K 4.4349 8.3569 127.7362 57.6875 32.4049 181.1970 60 R 4.6720 7.6186 117.5263 59.6363 30.2863 183.3880 61 I 3.8842 7.8557 117.2859 65.2610 37.7727 177.3621 62 H 4.3618 8.3849 116.9298 58.5865 28.6269 177.5638 63 E 4.1505 8.1674 119.9920 60.3277 29.6444 183.1707 64 R 4.2555 7.9240 119.2782 58.2140 30.7442 176.6591 65 L 3.9460 7.2723 116.8245 52.5889 43.0753 179.3545 *81 N 4.8077 8.4425 111.6945 55.2930 40.6465 176.4910 82 L 4.0444 7.7851 119.0367 57.8173 42.1668 178.4097 83 E 3.9874 8.1998 118.4150 59.1652 29.3076 178.9827 84 L 3.9603 7.7708 119.5610 58.0682 42.1698 178.3019 85 A 4.0873 7.4795 119.4534 55.4717 18.3474 179.2875 86 I 3.8238 7.6830 116.5695 64.7120 37.5859 177.7560 87 E 4.3219 8.3347 119.9338 59.5666 29.3504 178.6031 88 Y 4.0781 8.2894 116.2170 58.6130 38.5832 177.2884 *90 Q 4.3363 8.1139 119.4423 55.5277 31.0967 177.8762 91 G 3.6036 8.1810 104.4607 47.7648 0.0000 175.5596 92 L 3.8036 8.1303 123.3364 57.3557 41.8033 177.9583 93 F 4.4191 7.7015 116.8406 58.9575 39.7510 176.6133 94 G 3.6902 8.0108 105.1347 47.6419 0.0000 175.5670 95 R 4.0745 7.2326 117.8180 56.9953 29.5517 178.0245 96 I 3.9122 7.3824 118.0406 65.3117 37.9427 177.7164 97 T 4.0071 7.6860 116.0980 66.2968 68.0413 176.7163 98 R 3.9077 7.8435 119.5308 59.1380 30.7595 177.9957 99 D 4.7670 7.8006 117.3409 54.1134 42.1705 178.7883 100 R 4.0377 7.4271 121.1436 60.3803 29.9714 177.6293 101 T 3.9983 7.9163 114.7254 66.4758 68.5302 176.8592 102 G 3.4335 7.8525 107.1760 48.0753 0.0000 175.2881 103 Y 4.3377 7.6619 118.9153 60.6097 37.8258 178.5281 104 L 4.0266 8.2336 119.9187 57.6564 41.7059 179.1744 105 A 4.0011 8.2284 120.9441 55.0403 18.1923 179.2582 106 L 3.9324 8.0365 118.7206 58.5177 42.2718 179.2049 107 Q 4.0212 8.0871 117.7462 59.2353 28.1826 178.7995 108 E 4.0349 8.3627 119.4237 59.4004 29.4529 179.5307 109 L 4.1010 8.3289 119.4010 57.7674 41.8633 179.5234 110 R 3.9584 8.2885 118.3172 59.5607 29.8584 179.1849 111 L 4.0934 7.5998 116.7769 57.7079 41.9134 178.9276 112 E 3.9308 8.3220 119.1473 58.9267 29.6428 178.6218 113 A 3.9539 8.0179 121.1452 54.9972 18.1384 179.4611 114 V 3.5954 7.1434 114.9583 66.2633 31.5789 177.9002 115 R 4.4674 7.7726 115.6562 56.0393 30.6001 176.4868 116 R 4.4506 7.2391 116.2735 53.1355 32.0757 174.4464 117 P 4.2853 0.0000 0.0000 65.0574 31.3779 178.4809 118 E 3.9043 8.0611 118.1741 59.0938 29.6905 178.3282 119 L 4.3285 7.7938 121.2571 57.6031 42.1336 178.5860 120 R 3.8857 8.0739 118.6005 59.8262 29.9783 178.5460 121 T 3.8580 8.1444 115.5552 66.9917 68.4892 176.8351 122 T 3.8703 7.7509 117.0276 66.5733 68.4425 176.7169 123 L 3.9819 8.4222 122.6834 58.2823 42.0338 178.8256 124 T 3.8732 8.1075 115.9282 66.8311 68.3632 176.5278 125 R 3.8988 7.9231 119.5134 59.6273 30.0901 179.1184 126 T 3.8226 7.7558 115.2296 66.8281 68.4370 176.7795 127 I 3.7752 7.9535 121.6145 64.4234 37.1877 178.4882 128 S 4.0633 8.2765 116.3391 61.8224 62.6071 176.8833 129 E 3.9370 8.3794 121.1559 59.3698 29.2430 178.8496 130 N 4.2705 8.0941 117.1435 56.5892 39.0056 176.6228 131 L 3.8359 8.2499 122.1434 57.8627 42.0639 178.6603 132 K 3.8456 8.4430 119.9692 59.7147 32.0940 178.7743 133 R 3.9665 8.2403 118.3650 59.5762 30.0241 178.8355 134 D 4.4821 8.1743 118.5548 57.2753 40.7183 178.9726 135 I 3.8517 8.0559 120.5558 64.2723 37.1512 178.5414 136 G 3.6933 8.4302 106.9470 47.8058 0.0000 175.1847 137 F 4.0056 8.8457 123.7475 61.2575 39.1818 176.5631 138 H 4.1277 8.3516 116.1440 59.4425 29.7636 176.8225 139 L 4.1347 7.9262 119.4235 57.9897 41.4385 179.0580 140 D 4.4225 8.2653 118.9260 56.8508 40.5053 178.6796 141 S 3.9382 7.5217 113.9692 59.1768 63.0663 175.5009 142 G 3.8549 7.2600 110.1506 45.2906 0.0000 173.7840 143 L 4.1379 7.3466 119.5277 53.4939 42.1634 175.3779 144 P 4.3814 0.0000 0.0000 63.1187 32.0648 175.0179 145 G 4.2859 8.1976 105.3348 44.0009 0.0000 173.2206 146 D 5.2596 8.4693 119.6886 51.8018 41.6898 176.7807 147 R 3.9586 8.6925 115.4045 60.0181 29.9028 178.5666 148 S 4.1168 8.0893 113.3548 61.9803 62.8691 176.2727 149 T 4.1318 7.8286 117.2048 67.1023 68.5085 176.3599 150 V 3.8167 7.3564 118.8555 65.7030 31.5170 178.1665 151 L 4.1687 8.0176 114.9847 55.7970 40.8163 178.6856 *153 L 4.2460 7.7913 121.1005 55.1115 43.6306 178.3342 154 Y 4.1661 8.4263 118.4887 60.8534 39.0763 177.6595 155 L 3.8597 8.4395 119.1332 57.9676 41.8970 180.3751 156 A 3.7317 7.2645 118.1097 53.1690 18.1542 178.9128 *158 N 4.3862 8.3604 117.4164 54.6886 40.5424 177.0224 159 A 3.9443 7.7786 119.7546 54.7298 18.3202 179.3446 160 L 3.8007 8.0747 119.2247 58.3660 42.1417 179.1793 161 I 3.7090 7.6605 119.0888 64.5330 37.0419 178.3915 162 V 3.5379 7.6293 118.8730 65.8370 31.2357 177.6278 163 E 3.8717 8.4037 119.2282 59.5594 29.3172 178.1428 164 H 4.1170 8.0361 116.8142 59.5214 30.0270 176.9798 165 L 4.1100 8.0500 119.5109 56.7950 41.4401 178.4964 166 T 4.4183 7.6714 108.0912 62.3508 71.5070 175.2889 167 L 4.7772 7.8412 122.1010 50.9424 41.8241 175.1454 168 P 4.1672 0.0000 0.0000 65.6833 31.2773 179.7688 169 G 3.6881 8.0701 107.0942 47.8285 0.0000 175.5264 170 V 3.6187 7.9697 119.7541 65.2291 31.7096 176.5580 171 L 4.5621 7.6739 117.6680 54.2027 42.0732 177.5769 172 E 3.8703 7.8132 120.6807 59.2927 29.4597 177.9368 173 G 3.9180 7.9897 103.9475 45.3857 0.0000 172.8917 174 V 4.0582 7.5893 120.6169 61.5333 32.5605 176.8628 175 D 4.6430 8.3694 127.0112 53.6786 39.5082 176.3995 176 T 3.7922 8.0625 116.1669 63.7637 69.1153 176.2216 177 E 3.8580 8.0547 122.1037 59.3085 29.8089 178.5605 178 R 3.8869 7.9540 118.8126 59.1021 30.0214 178.2182 179 L 3.8644 8.0075 120.2947 58.1744 42.1601 179.1673 180 V 3.4795 7.7161 117.9684 65.7820 31.4204 177.7512 181 A 4.0064 7.9597 120.5628 55.3958 18.2677 179.3838 182 D 4.3105 8.4956 117.8046 57.2295 40.8430 178.8391 183 L 3.9119 8.2524 121.2942 58.1048 42.2621 179.2651 184 V 3.5690 7.8264 118.1042 66.4031 31.3103 178.0244 185 T 3.9074 7.6801 114.1351 66.8517 68.3986 176.4780 186 R 4.1087 8.2154 119.6212 58.9168 29.9287 178.8885 187 A 4.0200 7.8219 120.0168 55.0917 18.4738 179.7237 188 V 3.7557 7.6172 108.7958 62.5837 32.0460 176.9455 189 A 4.2329 7.0588 121.9088 52.3287 19.3087 177.3344 190 T 4.6867 7.9762 108.4221 59.9172 68.6450 171.6068 191 P 4.5277 0.0000 0.0000 62.7719 32.9453 175.9600 192 D 4.4799 8.3969 118.9673 53.8411 41.3959 176.7409 193 A 4.2203 8.5458 125.9330 52.3997 18.7534 176.8123 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 3 Q 8.34 4.27 0.00 2.08 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.85 0.00 0.00 0.00 0.00 0.00 2.27 2.31 0.00 4 N 7.71 4.86 0.00 2.92 2.72 0.00 0.00 7.44 6.82 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 5 P 0.00 4.35 0.00 2.33 2.32 0.00 3.78 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.07 0.00 6 E 8.08 3.92 0.00 2.00 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 2.41 2.31 0.00 7 R 7.92 3.89 0.00 1.93 1.79 0.00 3.15 0.00 0.00 3.21 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.62 0.00 8 R 7.65 3.46 0.00 2.12 2.20 0.00 3.30 0.00 0.00 3.29 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.72 0.00 9 A 7.80 3.98 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 10 A 7.82 3.92 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 11 L 7.63 3.94 0.00 1.95 1.90 0.27 1.21 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 12 V 8.17 3.54 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 1.08 0.00 0.00 13 N 8.27 4.23 0.00 3.09 2.83 0.00 0.00 6.93 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 14 A 8.24 3.95 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 15 A 8.10 3.83 1.18 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 16 I 8.10 3.60 1.95 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.15 0.87 0.00 0.00 17 E 8.52 3.90 0.00 2.11 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 2.40 2.43 0.00 18 V 7.82 3.56 2.13 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 1.05 0.00 0.00 0.95 0.00 0.00 19 L 8.15 3.95 0.00 1.89 1.70 0.86 1.33 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 20 A 7.69 4.01 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 21 R 7.88 4.11 0.00 1.88 1.98 0.00 3.11 0.00 0.00 3.21 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.76 0.00 22 E 8.48 4.53 0.00 2.00 1.95 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 2.23 2.41 0.00 23 G 7.43 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 9.07 4.13 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 25 R 8.09 4.03 0.00 1.84 1.86 0.00 3.27 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 1.55 1.20 0.00 26 G 7.50 3.65 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 0.00 0.00 0.00 27 L 7.44 4.04 0.00 1.49 1.73 0.69 0.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 28 T 7.88 4.47 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 1.24 0.00 0.00 29 F 8.22 4.49 0.00 3.21 3.04 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 30 R 8.15 3.94 0.00 1.89 2.02 0.00 3.17 0.00 0.00 3.38 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.79 0.00 31 A 7.98 4.01 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 32 V 7.96 3.49 2.33 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 1.07 0.00 0.00 0.90 0.00 0.00 33 D 8.04 4.38 0.00 2.79 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 34 V 7.23 3.59 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 0.79 0.00 0.00 1.00 0.00 0.00 35 E 7.86 4.11 0.00 1.93 2.17 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 2.46 2.34 0.00 36 A 7.32 4.31 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 37 N 8.58 4.57 0.00 2.68 2.87 0.00 0.00 6.70 7.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 V 7.10 4.32 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 0.78 0.00 0.00 0.93 0.00 0.00 39 P 0.00 5.23 0.00 2.07 2.22 0.00 3.73 0.00 0.00 4.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.28 0.00 40 K 7.35 4.06 0.00 1.81 1.62 0.00 1.92 0.00 0.00 1.71 0.00 0.00 2.92 0.00 0.00 2.69 0.00 0.00 0.00 0.00 1.39 1.26 7.81 41 G 7.04 5.06 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 0.00 0.00 0.00 42 T 7.20 4.32 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 1.23 0.00 0.00 43 A 8.43 4.19 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 44 S 7.77 3.20 0.00 3.67 3.74 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 0.00 0.00 0.00 45 N 7.63 4.45 0.00 2.85 2.73 0.00 0.00 6.93 7.34 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 46 Y 7.57 3.82 0.00 2.65 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 0.00 0.00 0.00 47 F 7.81 5.18 0.00 3.26 3.09 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 0.00 0.00 0.00 0.00 48 P 0.00 4.51 0.00 2.13 2.17 0.00 4.11 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.10 0.00 49 S 7.86 4.98 0.00 4.09 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 50 R 8.84 3.62 0.00 1.76 1.99 0.00 3.07 0.00 0.00 3.27 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.19 0.00 51 D 8.21 4.43 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 52 D 8.74 4.56 0.00 2.93 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 53 L 8.07 3.31 0.00 1.65 1.59 0.07 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 54 F 7.84 3.97 0.00 3.16 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 8.10 4.49 0.00 3.00 2.79 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 7.91 4.08 0.00 2.05 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.80 0.00 0.00 0.00 0.00 0.00 2.30 2.25 0.00 57 V 7.59 3.89 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 0.91 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0.00 2.82 2.88 0.00 0.00 6.56 6.66 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 82 L 7.79 4.04 0.00 1.81 1.66 0.95 1.02 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 83 E 8.20 3.99 0.00 2.07 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 2.42 2.39 0.00 84 L 7.77 3.96 0.00 1.75 1.80 0.95 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 85 A 7.48 4.09 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 86 I 7.68 3.82 2.05 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 1.43 0.71 0.98 0.00 0.00 87 E 8.33 4.32 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 2.36 2.37 0.00 88 Y 8.29 4.08 0.00 3.20 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 *90 Q 8.11 4.34 0.00 2.35 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 6.69 0.00 0.00 0.00 0.00 0.00 2.35 2.52 0.00 91 G 8.18 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 92 L 8.13 3.80 0.00 1.26 1.51 0.86 0.95 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 93 F 7.70 4.42 0.00 2.99 3.14 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 0.00 0.00 0.00 0.00 94 G 8.01 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 7.23 4.07 0.00 1.77 1.91 0.00 3.07 0.00 0.00 3.05 7.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.60 0.00 96 I 7.38 3.91 1.64 0.00 0.00 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.70 0.44 0.00 0.00 97 T 7.69 4.01 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 1.19 0.00 0.00 98 R 7.84 3.91 0.00 1.77 1.92 0.00 3.19 0.00 0.00 3.19 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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8.09 4.02 0.00 2.35 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.56 0.00 0.00 0.00 0.00 0.00 2.62 2.57 0.00 108 E 8.36 4.03 0.00 2.18 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 0.00 2.54 2.73 0.00 109 L 8.33 4.10 0.00 1.90 1.78 0.97 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 110 R 8.29 3.96 0.00 2.07 2.01 0.00 3.15 0.00 0.00 3.20 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.87 0.00 111 L 7.60 4.09 0.00 1.65 1.72 0.92 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 112 E 8.32 3.93 0.00 2.12 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 1.47 1.87 0.00 113 A 8.02 3.95 1.42 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 0.00 0.00 0.00 114 V 7.14 3.60 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 0.85 0.00 0.00 0.97 0.00 0.00 115 R 7.77 4.47 0.00 1.85 1.88 0.00 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8.27 4.42 0.00 2.69 2.57 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 0.00 0.00 0.00 0.00 141 S 7.52 3.94 0.00 3.73 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 0.00 142 G 7.26 3.85 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 143 L 7.35 4.14 0.00 1.35 1.55 0.92 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 144 P 0.00 4.38 0.00 2.34 2.06 0.00 3.75 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.97 0.00 145 G 8.20 4.29 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 0.00 146 D 8.47 5.26 0.00 2.82 2.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 147 R 8.69 3.96 0.00 1.88 2.01 0.00 3.14 0.00 0.00 3.34 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.72 0.00 148 S 8.09 4.12 0.00 4.01 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 0.00 149 T 7.83 4.13 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 1.18 0.00 0.00 150 V 7.36 3.82 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 1.15 0.00 0.00 0.84 0.00 0.00 151 L 8.02 4.17 0.00 1.87 1.70 0.92 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 *153 L 7.79 4.25 0.00 1.78 1.80 0.95 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 154 Y 8.43 4.17 0.00 2.95 3.30 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 0.00 155 L 8.44 3.86 0.00 1.80 1.69 1.04 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 0.00 0.00 0.00 0.00 0.00 0.00 156 A 7.26 3.73 1.25 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 0.00 0.00 0.00 *158 N 8.36 4.39 0.00 2.74 2.70 0.00 0.00 6.91 7.66 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 0.00 159 A 7.78 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 0.00 160 L 8.07 3.80 0.00 1.69 1.56 0.63 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 161 I 7.66 3.71 1.74 0.00 0.00 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.48 0.08 0.00 0.00 162 V 7.63 3.54 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 0.98 0.00 0.00 0.93 0.00 0.00 163 E 8.40 3.87 0.00 2.23 1.95 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 2.31 2.37 0.00 164 H 8.04 4.12 0.00 3.51 3.51 0.00 5.81 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 165 L 8.05 4.11 0.00 1.66 1.72 1.06 0.76 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 0.00 166 T 7.67 4.42 4.23 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 1.23 0.00 0.00 167 L 7.84 4.78 0.00 1.65 1.59 0.96 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 168 P 0.00 4.17 0.00 2.16 2.26 0.00 3.76 0.00 0.00 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 1.92 0.00 169 G 8.07 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 170 V 7.97 3.62 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 0.79 0.00 0.00 1.00 0.00 0.00 171 L 7.67 4.56 0.00 1.75 1.69 1.02 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 172 E 7.81 3.87 0.00 2.06 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 2.29 0.00 173 G 7.99 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 0.00 174 V 7.59 4.06 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 0.73 0.00 0.00 0.92 0.00 0.00 175 D 8.37 4.64 0.00 2.74 2.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176 T 8.06 3.79 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 1.24 0.00 0.00 177 E 8.05 3.86 0.00 2.07 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 2.39 2.39 0.00 178 R 7.95 3.89 0.00 1.85 2.14 0.00 3.14 0.00 0.00 3.08 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.62 0.00 179 L 8.01 3.86 0.00 1.79 1.68 0.86 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 180 V 7.72 3.48 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 0.94 0.00 0.00 0.72 0.00 0.00 181 A 7.96 4.01 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 0.00 182 D 8.50 4.31 0.00 2.87 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 0.00 183 L 8.25 3.91 0.00 1.76 1.90 0.90 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 184 V 7.83 3.57 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 1.02 0.00 0.00 1.04 0.00 0.00 185 T 7.68 3.91 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 1.22 0.00 0.00 186 R 8.22 4.11 0.00 1.94 1.97 0.00 3.12 0.00 0.00 3.16 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.70 0.00 187 A 7.82 4.02 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 0.00 188 V 7.62 3.76 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 0.88 0.00 0.00 1.06 0.00 0.00 189 A 7.06 4.23 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 0.00 190 T 7.98 4.69 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 1.22 0.00 0.00 191 P 0.00 4.53 0.00 2.20 2.10 0.00 3.76 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.98 0.00 192 D 8.40 4.48 0.00 2.69 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 0.00 193 A 8.55 4.22 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 * Residues marked with a * may have inaccurate shift predictions.