NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 0 A 4.1452 8.2531 123.5805 51.8787 20.1945 175.9429 *2 G 3.7252 8.2121 107.9234 45.9779 0.0000 171.6787 3 K 4.6912 8.5039 122.1263 54.2413 34.9287 175.2245 4 V 4.7980 8.9735 126.1866 60.8624 34.4250 173.7920 5 L 5.3081 9.2074 130.5189 53.4945 44.4000 174.8427 6 V 5.0018 9.2301 126.9740 61.3614 33.5217 174.0680 7 I 5.8264 9.2302 128.2543 58.6453 41.3615 173.5704 8 Y 5.2474 7.8910 124.3114 55.8535 41.3742 172.8038 9 D 4.9334 8.7865 120.5190 53.0188 43.9189 175.0857 10 T 4.6283 8.0891 116.0866 61.1685 69.9925 172.9471 11 R 4.3780 8.7533 126.2261 57.1497 31.6641 176.4951 12 T 4.4252 7.9722 108.4216 60.8048 69.1558 173.8845 13 G 4.1529 8.5108 109.2180 46.2860 0.0000 175.8068 14 N 4.2942 8.1376 116.3402 56.7476 38.7025 176.5180 15 T 4.1521 7.8340 113.2490 66.1417 69.2731 175.9012 16 K 3.2454 8.2101 122.3027 59.3377 32.0515 179.2645 17 K 4.0237 8.1095 115.7515 57.4054 32.2735 178.4426 *19 A 3.9500 8.1262 123.7818 52.2263 20.4981 179.6448 20 E 3.9004 8.0344 115.3453 59.6647 29.3467 179.7441 21 L 3.9477 7.5170 118.4628 57.3762 41.6773 179.4253 22 V 3.5408 7.4755 117.5664 65.9633 31.3999 177.3921 23 A 3.9796 8.1360 120.6895 55.3763 18.1029 178.9804 24 E 3.9188 8.1390 117.5670 59.6061 29.3590 179.2080 25 G 3.6088 8.2573 105.4399 47.7769 0.0000 175.5173 26 A 4.1502 7.7449 122.4054 55.1500 18.3836 179.7103 27 R 3.9298 8.2944 115.9326 59.4093 30.1810 179.0823 28 S 4.2946 8.1854 113.5143 59.7604 63.1417 174.2968 29 L 4.1872 7.3773 125.3094 53.6177 42.2118 175.6297 30 E 4.1508 8.6467 126.5074 58.1253 29.6473 177.4158 31 G 3.9493 9.0301 112.5496 45.1063 0.0000 172.9810 32 T 4.3711 7.3831 116.7983 63.0642 69.1294 173.9574 33 E 4.6333 9.4898 128.6181 55.1575 31.6154 174.9669 34 V 5.1806 8.4424 125.1737 61.3828 34.7297 174.3610 35 R 4.5923 9.4519 127.0859 54.3416 32.6557 174.8841 36 L 5.2162 8.5897 125.4752 53.4908 43.7634 175.3450 37 K 4.6872 9.1686 126.5484 54.4229 35.7650 176.0549 38 H 3.2999 8.9370 124.4025 55.4125 30.6627 176.5760 39 V 2.9946 7.7978 118.5198 64.3300 31.5031 178.5661 40 D 4.3285 7.9868 118.4625 56.0110 40.7831 176.5196 41 E 4.4453 7.7308 114.2848 55.5367 30.7057 176.2751 42 A 4.2630 7.0112 122.9160 52.4271 18.9681 176.7335 43 T 4.9391 8.6723 110.5682 58.7230 72.1865 175.3725 44 K 4.1329 8.4966 121.3607 59.8832 32.4147 178.9988 45 E 4.1205 8.1951 119.7572 58.9907 29.4394 178.4184 46 D 4.4610 8.0067 118.8399 57.6893 40.7587 179.1832 47 V 3.7669 7.3440 115.5868 65.9673 31.5584 177.7495 48 L 4.2087 7.9315 118.2899 57.3934 41.5273 178.8809 49 W 4.2453 8.4194 127.7310 59.2003 31.0505 176.6080 50 A 3.7127 7.6979 121.6409 52.1141 18.6747 176.9263 51 D 4.4606 8.5459 122.7398 56.2464 42.3507 176.9312 52 G 4.6018 7.7829 103.4858 44.5497 0.0000 171.6680 53 L 5.6855 9.3832 121.0868 52.6217 46.3498 175.3616 54 A 5.3755 9.1786 124.0902 50.2522 21.9680 175.0628 55 V 4.7678 8.8868 123.1456 61.0574 34.3865 174.5325 56 G 3.4448 8.7484 115.1381 44.3371 0.0000 171.6201 57 S 5.0532 7.9983 118.0173 55.2397 66.3836 171.2898 58 P 4.7030 0.0000 0.0000 63.3420 32.1621 176.0526 59 T 4.0659 9.1431 118.7910 63.2391 69.4024 174.9574 60 N 5.1269 9.1263 127.2149 53.0976 39.0948 176.6051 *62 G 3.8063 8.0984 105.0495 44.8727 0.0000 172.7770 63 L 4.7049 7.6486 119.1223 51.8764 45.7336 175.8547 64 V 3.7363 7.9267 119.7302 63.1190 31.7958 176.2628 65 S 4.4599 8.5444 120.9666 57.7369 63.5804 174.5744 66 W 4.4217 8.6992 118.5616 59.7086 28.3819 178.8197 67 K 3.6958 7.0101 114.6947 56.8431 31.0334 178.2458 *69 K 4.3512 8.1644 122.2846 56.6950 33.9671 177.8711 70 R 4.0817 8.6741 118.2116 59.4632 29.9625 178.7245 71 F 4.0850 8.3013 119.9330 61.2944 38.8440 177.2445 72 F 3.7079 8.4912 116.7818 60.5530 38.4175 177.1337 73 D 4.4881 8.6802 118.8283 57.5895 40.4832 178.5812 74 D 4.4221 8.6289 118.0543 56.4726 41.3294 178.7793 75 V 3.8173 7.1087 117.8387 64.1526 32.4963 177.9729 76 L 4.1525 7.1129 118.1619 55.1149 41.6169 178.8701 77 G 4.0300 7.5677 107.3284 47.4673 0.0000 175.4271 78 D 4.5358 8.1732 119.1826 56.4512 40.9993 177.8528 79 L 4.4439 8.1139 118.2623 53.9314 41.9097 176.3757 80 W 4.0749 7.9256 130.7890 58.6006 30.9200 176.0294 81 G 3.3984 8.6261 114.0099 45.0155 0.0000 173.3686 82 E 4.6555 7.7987 115.0672 55.6201 31.0439 175.8285 83 I 4.6207 7.5929 111.1813 60.7785 38.1770 174.8867 84 D 4.8598 7.4341 120.2031 55.8976 41.0214 177.5695 85 G 4.0148 9.1369 110.6426 45.1478 0.0000 174.0974 86 K 4.0633 7.4170 118.1915 56.2724 33.5451 175.8271 87 I 5.0071 8.1915 123.0478 59.8434 39.6697 174.8186 88 A 5.9400 9.6748 127.4030 50.4984 23.4341 174.3490 89 C 4.9348 8.5261 112.6966 57.0453 33.8201 172.1602 90 A 5.4588 8.3863 118.9579 50.3945 22.6642 174.9158 91 F 5.4635 8.5562 113.3736 56.0230 42.2766 173.3191 92 S 5.3063 9.0966 112.7762 58.1079 66.3701 172.8224 93 S 5.2685 8.7115 121.4353 56.6706 64.6998 172.7130 94 S 4.8448 8.5454 120.4816 56.1525 66.1706 175.3390 95 G 3.6246 8.7374 108.7880 47.9003 0.0000 174.0863 96 G 4.1784 7.4207 106.5247 42.9318 0.0000 171.6268 97 W 4.3564 8.5029 120.5193 57.8769 29.4670 176.9886 98 G 3.9786 9.3478 110.6121 46.0151 0.0000 173.9446 99 G 3.7896 7.7044 106.2891 45.0868 0.0000 174.9577 100 G 4.1704 8.2953 108.8839 45.2858 0.0000 175.5803 101 N 4.5631 8.1570 121.0623 55.2004 36.9353 176.8683 102 E 4.1167 8.0866 119.8684 58.9246 29.8229 178.6958 103 V 3.6557 7.7031 117.0521 65.7073 31.9998 177.3869 104 A 4.3284 8.1033 122.0779 54.7172 18.1586 180.3552 105 C 3.9687 7.7828 114.3181 60.4268 27.3785 176.2338 *107 S 4.3415 8.1036 117.3242 58.4711 64.6363 175.8838 108 I 3.6871 7.7912 120.8528 64.1307 36.9739 177.4881 109 L 4.1409 8.0282 119.2539 58.1552 41.4830 179.1599 110 T 3.8435 7.1314 109.1783 64.9754 68.2697 174.3174 *112 L 3.9797 7.7354 120.4661 54.7096 43.0491 178.3321 *114 N 4.7157 8.2461 118.5321 53.7402 40.8200 174.7019 115 F 3.9609 8.0759 115.0318 57.4855 39.1807 176.7074 116 G 4.0343 8.0793 108.6239 46.5549 0.0000 173.4213 117 F 5.1303 7.9581 117.2066 57.2740 39.9946 174.8951 118 L 4.4698 8.8641 122.4370 54.3790 42.7567 176.1832 119 V 5.5555 8.6785 122.7598 60.2866 34.6148 174.1325 120 F 5.0285 8.5168 119.9908 56.0426 41.0472 172.8570 121 G 4.7239 8.6881 107.3957 42.7525 0.0000 171.8405 122 V 4.5738 8.0607 118.3398 60.9251 33.3546 176.8580 123 T 4.1089 8.8151 117.6318 64.3916 69.1333 174.8650 124 D 3.7465 8.1115 120.6631 54.9760 41.3080 175.7879 125 Y 4.4571 8.2859 121.9310 57.0433 37.7201 176.4175 126 V 3.8662 8.3957 125.4112 63.8735 32.4516 175.5489 127 G 4.4232 7.9758 106.5211 42.0942 0.0000 173.1513 128 K 4.0669 8.9789 120.5838 58.6936 32.1465 177.3836 129 K 4.9121 7.9336 116.5121 56.3260 33.3294 175.6313 130 F 4.2599 8.3298 120.9964 57.7251 42.1752 173.2930 131 T 4.6970 7.0488 121.0445 61.6365 70.4666 172.7698 132 L 4.6177 7.7324 117.0080 54.8950 40.5450 176.3722 133 H 4.2542 7.8598 116.7620 58.5530 29.2433 177.0279 134 Y 4.5666 8.2158 113.2467 56.8283 39.1241 174.1800 135 G 4.7487 8.2802 104.1490 43.6500 0.0000 173.4449 136 A 4.3277 8.5237 122.6920 51.8907 19.4406 177.1156 137 V 5.0761 8.4415 114.7760 59.7195 35.6982 175.2207 138 V 4.5766 8.4245 122.2130 61.2069 35.6947 173.7461 139 A 4.1919 7.7161 127.4536 51.0180 19.1009 178.0659 140 G 3.6443 8.9715 113.4459 46.4593 0.0000 172.4957 141 E 4.0607 8.6061 124.1360 54.6835 30.3770 175.0440 142 P 4.5343 0.0000 0.0000 63.3833 30.8907 175.3807 143 R 4.3750 8.9516 123.0284 57.6460 31.9592 178.3849 144 S 4.2955 7.9108 111.9596 57.9893 65.0794 174.6041 145 E 3.8822 8.5335 122.8759 59.2840 28.8706 178.8271 146 E 3.7727 7.8770 118.1694 59.3172 29.6115 178.8962 147 E 3.8607 7.4374 117.7773 59.5347 29.6171 179.7253 148 K 3.9629 7.9854 118.3014 59.3933 32.0375 179.0618 149 E 3.9579 8.1063 118.9611 58.6685 29.4758 178.3822 150 A 4.0585 8.3669 121.4931 55.5170 18.3581 179.3842 151 C 3.9485 7.9028 114.3667 62.9971 28.1690 176.3547 152 R 4.0354 7.8674 119.5650 59.5545 29.6294 179.0870 153 R 3.8302 8.3752 118.5916 59.0618 29.9788 178.0016 154 L 4.1282 7.7787 120.0466 58.3407 42.0611 179.1384 155 G 4.2184 7.6897 106.5361 47.3120 0.0000 175.5117 156 R 4.0343 8.1696 122.8811 58.6338 30.1483 178.6392 157 R 3.6829 8.4936 120.4380 58.3205 29.9045 178.1048 158 L 3.9979 8.2052 120.1598 58.2183 42.0801 178.6489 159 A 3.9949 7.8836 120.5459 55.4117 18.4048 179.4830 160 E 3.7859 7.9780 116.7932 59.3114 29.4084 179.6063 161 W 5.0827 8.2399 119.3486 60.0967 29.1279 178.7742 162 V 3.6846 8.4244 118.3802 65.9433 30.8538 177.9974 163 A 4.0233 8.2896 120.9077 54.9237 17.6997 179.7436 164 I 3.5427 8.0892 118.6353 64.1178 37.0731 178.1311 165 F 4.5581 8.2316 116.8947 58.4346 39.4252 177.2374 166 V 4.0009 7.7136 117.0789 64.7327 31.9506 176.3221 167 D 4.4295 8.0546 115.7865 54.1884 41.4310 176.2655 168 G 3.8396 8.0702 105.6932 47.3459 0.0000 175.0503 169 R 4.3477 7.9115 119.3049 54.0576 28.5794 177.6824 170 K 3.8215 7.8101 120.1270 59.6108 33.2212 179.6000 171 E 3.9490 8.3685 118.0430 59.4848 29.1870 178.9364 172 L 4.0114 7.7865 118.6039 57.8697 41.6833 179.0228 173 L 3.9643 7.4957 119.6595 58.7479 41.9888 178.9326 174 E 3.9721 8.1300 118.2816 58.8047 29.4358 178.3864 175 K 3.8866 7.4561 117.7314 59.5592 32.5606 178.4879 176 I 3.8161 7.9808 120.1162 64.6471 36.8662 178.5935 177 R 4.0960 8.0050 117.3101 58.6077 29.9735 178.2042 178 K 4.6350 7.5702 114.6074 55.0726 32.8854 176.3613 179 D 4.4407 7.6984 120.8040 53.7474 41.9115 174.8804 180 P 4.4279 0.0000 0.0000 65.0587 31.3317 178.3150 181 A 4.1318 8.1810 120.0494 54.6424 18.5505 178.9634 182 R 3.6740 7.8170 115.4472 58.0559 30.1496 176.0054 183 F 5.0192 7.5549 115.3572 54.9790 40.1235 175.0724 184 V 3.5960 8.4002 126.6319 64.1643 31.7572 175.8776 185 D 4.8544 9.0337 125.8712 54.7600 40.2091 175.3035 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 0 A 8.25 4.15 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 *2 G 8.21 3.73 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 0.00 0.00 0.00 3 K 8.50 4.69 0.00 1.04 0.74 0.00 0.61 0.00 0.00 0.79 0.00 0.00 2.56 0.00 0.00 2.62 0.00 0.00 0.00 0.00 0.93 1.06 7.81 4 V 8.97 4.80 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 1.12 0.00 0.00 0.97 0.00 0.00 5 L 9.21 5.31 0.00 2.04 1.69 1.05 0.70 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 6 V 9.23 5.00 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 1.14 0.00 0.00 1.02 0.00 0.00 7 I 9.23 5.83 1.91 0.00 0.00 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.74 1.91 1.11 0.00 0.00 8 Y 7.89 5.25 0.00 3.05 3.07 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 9 D 8.79 4.93 0.00 2.45 2.42 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 10 T 8.09 4.63 4.41 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 1.34 0.00 0.00 11 R 8.75 4.38 0.00 1.73 1.89 0.00 3.28 0.00 0.00 3.12 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.64 0.00 12 T 7.97 4.43 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 13 G 8.51 4.15 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 0.00 14 N 8.14 4.29 0.00 2.71 3.02 0.00 0.00 6.97 7.54 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 15 T 7.83 4.15 4.43 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 1.28 0.00 0.00 16 K 8.21 3.25 0.00 1.80 1.95 0.00 1.95 0.00 0.00 1.87 0.00 0.00 3.08 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.48 1.04 7.81 17 K 8.11 4.02 0.00 1.98 1.77 0.00 1.73 0.00 0.00 1.61 0.00 0.00 2.89 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.59 1.53 7.81 *19 A 8.13 3.95 1.17 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 0.00 0.00 20 E 8.03 3.90 0.00 2.08 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 2.25 2.30 0.00 21 L 7.52 3.95 0.00 1.57 1.62 0.86 0.69 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 22 V 7.48 3.54 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 0.91 0.00 0.00 0.03 0.00 0.00 23 A 8.14 3.98 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 24 E 8.14 3.92 0.00 2.10 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 0.00 2.28 2.31 0.00 25 G 8.26 3.61 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 0.00 0.00 0.00 26 A 7.74 4.15 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 27 R 8.29 3.93 0.00 1.87 2.02 0.00 3.19 0.00 0.00 3.29 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.77 0.00 28 S 8.19 4.29 0.00 3.97 4.10 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 0.00 0.00 0.00 29 L 7.38 4.19 0.00 1.67 1.66 0.87 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 30 E 8.65 4.15 0.00 1.96 1.88 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 2.30 2.36 0.00 31 G 9.03 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 32 T 7.38 4.37 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 1.24 0.00 0.00 33 E 9.49 4.63 0.00 2.14 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 2.57 2.40 0.00 34 V 8.44 5.18 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 0.96 0.00 0.00 1.03 0.00 0.00 35 R 9.45 4.59 0.00 1.73 1.68 0.00 2.21 0.00 0.00 2.69 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.72 0.00 36 L 8.59 5.22 0.00 1.66 1.61 1.08 0.56 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 37 K 9.17 4.69 0.00 1.56 1.54 0.00 1.76 0.00 0.00 1.51 0.00 0.00 2.76 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.32 1.45 7.81 38 H 8.94 3.30 0.00 2.91 2.93 0.00 5.60 0.00 0.00 0.00 0.00 6.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 39 V 7.80 2.99 1.69 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 0.33 0.00 0.00 0.72 0.00 0.00 40 D 7.99 4.33 0.00 2.38 2.59 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 41 E 7.73 4.45 0.00 1.99 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 2.08 2.32 0.00 42 A 7.01 4.26 0.93 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 43 T 8.67 4.94 4.45 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 1.28 0.00 0.00 44 K 8.50 4.13 0.00 1.99 2.03 0.00 1.51 0.00 0.00 1.79 0.00 0.00 2.97 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.48 1.54 7.81 45 E 8.20 4.12 0.00 2.11 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 2.42 2.49 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0.00 0.00 0.00 0.00 0.00 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 V 8.89 4.77 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 1.00 0.00 0.00 1.18 0.00 0.00 56 G 8.75 3.44 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 57 S 8.00 5.05 0.00 3.73 3.50 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.70 0.00 2.07 2.01 0.00 3.73 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 1.92 1.96 0.00 59 T 9.14 4.07 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 1.18 0.00 0.00 60 N 9.13 5.13 0.00 2.84 2.80 0.00 0.00 6.47 7.19 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 *62 G 8.10 3.81 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 63 L 7.65 4.70 0.00 1.68 1.51 0.92 0.71 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 64 V 7.93 3.74 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 0.67 0.00 0.00 0.88 0.00 0.00 65 S 8.54 4.46 0.00 3.78 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 66 W 8.70 4.42 0.00 3.54 3.38 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 67 K 7.01 3.70 0.00 1.43 1.52 0.00 1.00 0.00 0.00 1.11 0.00 0.00 2.64 0.00 0.00 2.85 0.00 0.00 0.00 0.00 0.99 0.21 7.81 *69 K 8.16 4.35 0.00 2.07 2.19 0.00 1.64 0.00 0.00 1.85 0.00 0.00 3.05 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.49 1.78 7.81 70 R 8.67 4.08 0.00 2.30 2.15 0.00 3.64 0.00 0.00 3.25 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 2.21 0.00 71 F 8.30 4.08 0.00 3.18 3.15 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 72 F 8.49 3.71 0.00 3.40 3.27 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 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0.00 0.00 0.00 0.00 0.00 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 7.80 4.66 0.00 1.98 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 2.40 2.26 0.00 83 I 7.59 4.62 2.10 0.00 0.00 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 1.88 1.41 1.02 0.00 0.00 84 D 7.43 4.86 0.00 2.80 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 85 G 9.14 4.01 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 0.00 0.00 0.00 86 K 7.42 4.06 0.00 0.79 0.94 0.00 1.39 0.00 0.00 1.49 0.00 0.00 2.89 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.24 1.37 7.81 87 I 8.19 5.01 1.94 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 1.11 0.60 1.14 0.00 0.00 88 A 9.67 5.94 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 89 C 8.53 4.93 0.00 2.46 1.55 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 90 A 8.39 5.46 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 91 F 8.56 5.46 0.00 3.18 3.03 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 92 S 9.10 5.31 0.00 3.85 3.67 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 93 S 8.71 5.27 0.00 3.92 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 94 S 8.55 4.84 0.00 3.78 3.80 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.74 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.42 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 97 W 8.50 4.36 0.00 3.35 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 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0.00 0.00 0.00 0.00 0.00 0.00 0.00 126 V 8.40 3.87 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 0.89 0.00 0.00 0.92 0.00 0.00 127 G 7.98 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 0.00 0.00 0.00 0.00 128 K 8.98 4.07 0.00 1.79 1.93 0.00 1.83 0.00 0.00 2.05 0.00 0.00 2.88 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.48 1.51 7.81 129 K 7.93 4.91 0.00 1.87 1.89 0.00 1.55 0.00 0.00 1.60 0.00 0.00 2.94 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.33 1.42 7.81 130 F 8.33 4.26 0.00 3.13 2.86 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 0.00 0.00 0.00 131 T 7.05 4.70 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 0.42 0.00 0.00 132 L 7.73 4.62 0.00 1.94 1.72 1.00 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 133 H 7.86 4.25 0.00 2.74 2.58 0.00 5.83 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 0.00 134 Y 8.22 4.57 0.00 3.00 2.97 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 0.00 135 G 8.28 4.75 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 0.00 136 A 8.52 4.33 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 0.00 137 V 8.44 5.08 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 0.81 0.00 0.00 1.08 0.00 0.00 138 V 8.42 4.58 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 1.04 0.00 0.00 1.10 0.00 0.00 139 A 7.72 4.19 0.24 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 0.00 140 G 8.97 3.64 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 0.00 141 E 8.61 4.06 0.00 2.05 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 0.00 2.27 2.28 0.00 142 P 0.00 4.53 0.00 2.20 2.11 0.00 3.76 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 1.96 1.97 0.00 143 R 8.95 4.38 0.00 1.79 1.98 0.00 3.17 0.00 0.00 3.27 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.69 0.00 144 S 7.91 4.30 0.00 3.95 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 0.00 145 E 8.53 3.88 0.00 2.04 1.92 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 2.34 2.42 0.00 146 E 7.88 3.77 0.00 1.49 1.12 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 0.00 2.30 2.26 0.00 147 E 7.44 3.86 0.00 2.11 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 2.44 1.94 0.00 148 K 7.99 3.96 0.00 1.76 1.81 0.00 1.62 0.00 0.00 1.53 0.00 0.00 2.97 0.00 0.00 3.21 0.00 0.00 0.00 0.00 1.42 1.53 7.81 149 E 8.11 3.96 0.00 2.16 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 2.28 2.35 0.00 150 A 8.37 4.06 1.71 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 0.00 0.00 151 C 7.90 3.95 0.00 3.10 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 0.00 152 R 7.87 4.04 0.00 1.99 1.94 0.00 3.34 0.00 0.00 3.05 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.77 0.00 153 R 8.38 3.83 0.00 1.94 2.03 0.00 3.24 0.00 0.00 3.00 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.62 0.00 154 L 7.78 4.13 0.00 1.77 1.74 0.98 1.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 155 G 7.69 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 0.00 0.00 0.00 0.00 156 R 8.17 4.03 0.00 1.97 2.09 0.00 3.35 0.00 0.00 3.08 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.41 0.00 157 R 8.49 3.68 0.00 1.82 1.88 0.00 2.21 0.00 0.00 2.25 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.66 0.00 158 L 8.21 4.00 0.00 2.13 1.84 1.10 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 159 A 7.88 3.99 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 0.00 160 E 7.98 3.79 0.00 1.70 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 2.17 2.33 0.00 161 W 8.24 5.08 0.00 3.23 3.12 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 0.00 0.00 0.00 0.00 162 V 8.42 3.68 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 0.98 0.00 0.00 1.00 0.00 0.00 163 A 8.29 4.02 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 0.00 164 I 8.09 3.54 1.41 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.92 0.06 0.00 0.00 165 F 8.23 4.56 0.00 3.09 3.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 166 V 7.71 4.00 2.23 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 0.70 0.00 0.00 0.95 0.00 0.00 167 D 8.05 4.43 0.00 2.63 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 0.00 168 G 8.07 3.84 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 0.00 0.00 0.00 169 R 7.91 4.35 0.00 1.85 2.00 0.00 3.12 0.00 0.00 3.14 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.69 0.00 170 K 7.81 3.82 0.00 1.77 1.83 0.00 1.66 0.00 0.00 1.80 0.00 0.00 2.86 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.48 1.58 7.81 171 E 8.37 3.95 0.00 2.02 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 2.39 2.46 0.00 172 L 7.79 4.01 0.00 1.89 1.69 0.86 0.36 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 0.00 173 L 7.50 3.96 0.00 1.72 1.83 1.06 0.77 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 0.00 174 E 8.13 3.97 0.00 2.13 1.93 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 2.38 2.43 0.00 175 K 7.46 3.89 0.00 1.83 1.92 0.00 1.84 0.00 0.00 1.68 0.00 0.00 2.98 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.44 1.48 7.81 176 I 7.98 3.82 2.02 0.00 0.00 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.45 0.81 0.00 0.00 177 R 8.00 4.10 0.00 2.04 2.08 0.00 3.20 0.00 0.00 3.29 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.92 0.00 178 K 7.57 4.64 0.00 1.74 1.85 0.00 1.74 0.00 0.00 1.66 0.00 0.00 3.17 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.51 1.64 7.81 179 D 7.70 4.44 0.00 2.92 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 0.00 180 P 0.00 4.43 0.00 2.23 2.13 0.00 3.67 0.00 0.00 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.18 0.00 181 A 8.18 4.13 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 0.00 182 R 7.82 3.67 0.00 1.59 1.21 0.00 3.28 0.00 0.00 3.05 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.68 0.00 183 F 7.55 5.02 0.00 3.04 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 0.00 184 V 8.40 3.60 2.31 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 0.82 0.00 0.00 1.04 0.00 0.00 185 D 9.03 4.85 0.00 2.79 2.97 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 * Residues marked with a * may have inaccurate shift predictions.