NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 35 A 4.1880 8.2644 123.5830 50.9367 21.2657 176.6359 36 D 4.1211 7.8349 113.9991 53.8518 39.2548 168.7660 37 V 3.5782 7.9433 123.5260 65.6324 32.9550 176.2277 38 Q 3.9558 8.0896 118.5925 59.0832 28.9173 178.0154 39 A 3.9627 8.0699 121.3119 55.2441 18.4778 179.2221 40 N 4.2652 7.9667 114.5855 56.4873 38.5599 177.8475 41 V 3.5839 8.1933 120.0328 66.1143 31.6428 178.2934 42 S 4.1500 8.3159 114.2740 61.4176 62.7515 176.0641 43 D 4.3462 8.2599 122.4820 57.3186 40.6340 178.9028 44 S 4.1176 8.1808 115.5787 61.6744 62.8183 176.8022 45 S 4.0928 8.4477 116.1798 61.1948 62.0803 176.1050 46 R 3.8361 8.2629 121.6232 59.6301 29.8956 178.4904 47 I 3.7573 7.9877 119.6888 64.5077 37.0866 178.3010 48 E 4.2793 8.1820 120.6405 59.1366 29.2572 179.5189 49 Q 4.0603 8.1351 118.0579 58.7896 28.4822 178.6294 50 E 3.7911 8.0917 118.8622 59.1737 29.5559 178.9346 51 A 3.3191 7.2428 119.4218 54.8448 18.6234 179.2164 52 I 3.7461 7.7754 118.8643 64.4440 37.1540 179.2891 53 G 3.6643 7.8187 103.1204 45.8650 0.0000 174.9680 *55 I 4.2022 7.6574 122.6962 61.2001 39.3810 177.7417 56 E 3.9932 8.5569 120.0687 59.7233 29.2457 179.3126 57 D 4.3279 8.1014 118.6823 57.1391 40.8960 178.4839 58 F 3.0348 7.6065 120.4845 61.3383 39.2926 176.6748 59 Y 3.4149 7.8756 116.1049 60.7707 37.4715 178.5126 60 E 3.8891 8.2856 119.3607 59.1810 29.3490 179.2557 61 A 3.9464 7.6530 119.6653 55.2945 18.8407 178.7112 62 Y 4.0641 8.1166 118.1646 60.7930 38.6632 178.0233 63 A 4.0469 8.1790 121.6107 55.2880 18.2110 179.4762 64 A 4.0027 7.6571 118.3031 55.1134 18.4625 179.7121 65 S 4.0692 7.6069 111.6350 60.8841 63.8695 175.5825 66 F 4.1406 7.6885 125.0739 57.5684 37.3326 176.1230 *68 S 4.2389 7.7155 117.9364 59.0518 64.2687 176.7360 69 T 4.7393 8.2547 114.4143 59.0671 69.2840 172.1470 70 G 4.2327 7.5205 111.9023 43.3230 0.0000 173.3181 71 K 3.8283 8.8312 118.2143 60.3045 31.8396 178.6174 72 E 3.8938 8.2259 117.5771 58.8405 29.2805 178.9077 73 A 3.9022 8.1435 122.4078 55.1898 18.5024 179.5607 74 L 3.7861 7.7468 116.5569 57.6713 41.6747 179.3672 75 A 3.9614 8.1276 120.8952 55.2217 18.2691 179.5403 76 L 3.9855 8.1816 119.0277 58.0865 42.1980 179.1416 77 G 3.6891 8.1040 105.8367 48.1343 0.0000 175.3827 78 D 4.4649 8.6255 121.8709 57.0512 40.8663 178.8637 79 S 4.1661 8.3553 115.9235 61.8665 62.7867 176.9878 80 I 3.9959 8.3256 122.6712 64.4669 36.9268 178.6828 81 K 3.9995 8.4169 119.3867 59.6141 31.6375 179.4415 82 Q 4.0125 8.3356 117.9170 58.5588 28.6208 178.6391 83 K 3.9093 7.7268 119.8682 59.5380 32.6633 178.5846 84 F 4.3447 8.5450 117.5869 57.6851 39.1526 175.5847 85 L 4.9663 6.9942 117.6569 52.5913 43.9497 176.4172 86 T 4.1341 8.1185 114.1486 61.5332 69.7468 176.4243 87 K 3.9500 8.5972 126.7863 60.0397 31.4937 179.8151 88 E 4.1366 8.0222 118.7893 59.3481 29.4780 179.0604 89 L 3.9599 7.6756 120.2972 58.1391 42.2120 178.9004 90 I 3.7040 7.7515 119.8285 64.5014 37.0772 178.2665 91 E 3.9767 8.0145 119.2093 59.3018 29.3240 179.3202 92 K 3.9896 8.0918 119.7275 59.4381 32.1798 179.0599 93 V 3.6657 8.2932 119.1414 65.9448 31.4022 177.7693 94 D 4.4007 8.1078 118.5972 57.3534 40.5989 178.8913 95 R 3.9439 7.9385 118.3889 59.4428 30.1215 179.2146 96 L 4.0775 8.1018 118.6428 57.7135 41.3492 179.5547 97 I 3.7957 8.0399 119.5669 64.5428 37.1153 178.0286 98 E 4.1308 8.2452 118.2375 59.0449 29.3401 179.0915 99 A 4.1472 8.1794 120.7258 55.0754 18.9434 177.9552 100 T 4.4073 8.0362 105.7885 60.8253 71.2250 173.7556 101 D 4.9947 8.2262 117.4438 52.8995 41.4078 175.1538 102 A 4.5775 7.3900 119.1893 50.8864 22.6475 175.9771 103 D 4.6763 9.1579 120.8774 52.9822 41.1494 175.8148 104 P 4.4385 0.0000 0.0000 65.5301 31.7881 177.9245 105 I 3.9947 8.1855 120.0987 63.9488 36.9308 176.9231 106 I 4.4917 7.9961 109.9047 59.9859 38.7741 175.0836 107 R 3.8219 8.1113 119.6068 56.4582 28.0870 174.7457 108 A 4.5186 7.1856 117.3770 51.8153 22.3116 177.8613 109 Q 4.1867 8.7279 118.6212 58.4696 29.1598 175.8533 110 D 4.6355 7.6177 113.9969 52.9514 44.4816 173.4164 111 L 4.7104 7.6858 121.2082 52.3657 44.2393 177.2434 112 G 3.8043 8.9914 112.3800 45.0860 0.0000 174.4735 113 E 3.9689 8.6339 121.6737 58.5202 29.8288 177.4110 114 N 4.6899 7.9859 113.6029 53.8862 39.1828 176.0443 115 D 5.0374 7.8344 116.0842 54.6144 40.1039 178.2461 *117 K 4.2596 8.0158 120.7706 56.4542 33.8386 176.7077 118 T 4.3772 7.6208 106.7757 61.2150 68.9507 174.4916 119 L 4.3192 7.6576 124.7641 55.8746 42.9771 176.3519 120 S 4.5473 9.2405 120.8178 57.1487 65.8858 172.5696 121 V 5.0675 8.4831 127.1409 61.1694 33.8650 174.4779 122 K 4.8300 8.7254 124.6666 55.6927 36.4208 174.7775 123 H 4.3386 8.9220 121.1615 56.0415 29.8454 173.8837 124 L 4.2757 7.1048 125.6964 54.8396 43.0739 175.9255 125 N 4.7231 7.5406 113.1978 53.6030 43.8915 175.7071 126 D 4.3647 8.2485 121.2252 56.3416 40.2265 174.4069 127 N 4.8883 8.7970 125.8042 53.9367 38.7521 173.6268 128 W 5.0698 8.2830 120.2398 56.2001 30.7246 175.1424 129 Y 5.1565 9.7599 120.7057 56.1950 42.5239 173.7171 130 E 4.8714 9.5432 122.1349 54.5710 32.7091 174.7297 131 V 4.1769 9.0068 127.9647 61.7311 32.9589 173.9607 132 N 5.6447 9.0876 126.7959 51.8289 41.0833 173.7093 133 Y 5.1756 8.4207 119.3309 56.4591 42.1566 173.4734 134 T 4.5881 9.0309 118.9030 62.2997 70.2426 173.9812 135 S 4.5806 8.9004 122.8133 57.8891 64.0434 173.9463 136 A 3.8230 8.9288 129.1462 52.8038 16.3823 177.4726 137 K 4.1145 7.9260 121.4681 58.4968 33.0193 175.4581 138 G 4.0535 9.4677 115.1310 45.5219 0.0000 173.9156 139 S 4.4777 7.6549 113.7906 56.9133 64.1462 175.1145 140 Q 3.8556 8.1820 118.1856 58.5656 28.2819 176.5852 141 Y 4.6814 6.7633 114.0890 57.5433 38.0705 175.0212 142 E 4.3730 7.7474 121.5261 56.8846 30.3569 176.3625 143 R 4.5974 9.0609 126.4824 54.4159 33.6454 173.6026 144 A 4.3646 8.7068 128.7716 51.7409 19.2702 176.3819 145 V 4.1659 8.3159 123.3520 61.2810 34.2131 175.0223 146 S 4.4976 8.4738 121.5887 57.2360 64.4184 172.4839 147 I 4.4623 8.6343 129.0975 58.9346 38.8696 173.6747 148 P 5.1166 0.0000 0.0000 62.6229 32.6505 175.9938 149 V 5.1614 9.7363 117.3735 59.6407 35.8018 174.4313 150 R 4.3937 8.6247 124.7740 54.3106 32.1927 174.7348 151 V 4.9156 8.2358 125.5476 60.9931 33.8904 174.9768 152 V 4.5393 9.0475 126.6758 59.8541 34.6499 173.7407 153 N 4.9630 8.6729 121.2335 51.9031 40.5940 173.9908 154 V 4.0873 8.5848 126.8563 61.7022 32.7947 175.0477 155 D 4.4163 9.8098 129.5264 55.2794 38.3295 174.9906 156 G 3.8468 8.3929 107.4526 45.1492 0.0000 174.0435 157 Q 4.3033 7.7964 119.6132 54.8716 29.8056 174.2058 158 Y 4.9423 8.3634 120.5546 57.3723 39.2794 174.9504 159 L 4.9801 8.9983 122.6432 53.1044 47.0472 175.4091 160 I 4.5759 8.5140 123.5585 60.8630 37.9196 176.0017 161 D 4.8567 8.6858 126.3536 53.3443 40.6425 175.6783 162 D 4.8215 7.4185 117.7130 53.5146 44.5509 173.7549 163 I 5.1640 8.0717 116.0126 60.0474 40.9295 174.7584 164 T 3.4755 8.5985 118.2777 64.0235 65.8727 169.8180 165 P 4.1964 0.0000 0.0000 62.2253 32.4417 176.4295 166 E 4.2959 8.8011 119.6305 56.4220 29.6462 175.6959 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 35 A 8.26 4.19 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 36 D 7.83 4.12 0.00 2.90 2.62 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 37 V 7.94 3.58 2.09 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 1.03 0.00 0.00 0.94 0.00 0.00 38 Q 8.09 3.96 0.00 2.21 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.69 0.00 0.00 0.00 0.00 0.00 2.43 2.50 0.00 39 A 8.07 3.96 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 40 N 7.97 4.27 0.00 2.95 2.90 0.00 0.00 6.72 7.12 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 41 V 8.19 3.58 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 1.14 0.00 0.00 1.01 0.00 0.00 42 S 8.32 4.15 0.00 4.09 4.11 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 0.00 0.00 0.00 43 D 8.26 4.35 0.00 2.82 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 44 S 8.18 4.12 0.00 4.04 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 45 S 8.45 4.09 0.00 3.93 3.86 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 46 R 8.26 3.84 0.00 2.02 2.13 0.00 3.18 0.00 0.00 3.19 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.69 0.00 47 I 7.99 3.76 2.00 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.79 1.06 0.00 0.00 48 E 8.18 4.28 0.00 2.25 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 0.00 2.21 2.26 0.00 49 Q 8.14 4.06 0.00 2.22 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.81 0.00 0.00 0.00 0.00 0.00 2.59 2.55 0.00 50 E 8.09 3.79 0.00 1.85 1.77 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 2.36 2.50 0.00 51 A 7.24 3.32 0.74 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 0.00 0.00 52 I 7.78 3.75 2.00 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.70 0.90 0.00 0.00 53 G 7.82 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 *55 I 7.66 4.20 1.94 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 1.41 0.83 1.04 0.00 0.00 56 E 8.56 3.99 0.00 2.14 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 2.32 2.47 0.00 57 D 8.10 4.33 0.00 2.75 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 58 F 7.61 3.03 0.00 2.05 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 59 Y 7.88 3.41 0.00 3.02 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 60 E 8.29 3.89 0.00 2.06 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 2.30 2.37 0.00 61 A 7.65 3.95 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 62 Y 8.12 4.06 0.00 2.18 2.34 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 63 A 8.18 4.05 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 64 A 7.66 4.00 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 65 S 7.61 4.07 0.00 3.95 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 66 F 7.69 4.14 0.00 3.05 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 *68 S 7.72 4.24 0.00 3.65 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 69 T 8.25 4.74 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 70 G 7.52 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 0.00 0.00 0.00 0.00 71 K 8.83 3.83 0.00 1.97 2.09 0.00 1.51 0.00 0.00 1.87 0.00 0.00 3.00 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.48 1.50 7.81 72 E 8.23 3.89 0.00 2.19 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 0.00 2.33 2.34 0.00 73 A 8.14 3.90 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 74 L 7.75 3.79 0.00 1.83 1.69 0.83 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 75 A 8.13 3.96 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 76 L 8.18 3.99 0.00 1.83 1.60 0.94 1.12 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 77 G 8.10 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 78 D 8.63 4.46 0.00 2.72 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 79 S 8.36 4.17 0.00 4.06 3.96 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 0.00 0.00 0.00 80 I 8.33 4.00 2.32 0.00 0.00 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 1.75 0.96 1.37 0.00 0.00 81 K 8.42 4.00 0.00 2.04 1.86 0.00 1.86 0.00 0.00 1.89 0.00 0.00 2.97 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.40 1.68 7.81 82 Q 8.34 4.01 0.00 2.17 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.09 6.97 0.00 0.00 0.00 0.00 0.00 2.59 2.52 0.00 83 K 7.73 3.91 0.00 1.68 1.90 0.00 1.64 0.00 0.00 1.50 0.00 0.00 2.89 0.00 0.00 2.54 0.00 0.00 0.00 0.00 0.41 1.10 7.81 84 F 8.54 4.34 0.00 2.82 2.62 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 85 L 6.99 4.97 0.00 1.58 1.41 0.73 -0.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 86 T 8.12 4.13 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 1.15 0.00 0.00 87 K 8.60 3.95 0.00 1.78 1.87 0.00 1.79 0.00 0.00 1.82 0.00 0.00 2.86 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.45 1.11 7.81 88 E 8.02 4.14 0.00 1.99 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 2.35 0.00 89 L 7.68 3.96 0.00 1.83 1.74 0.95 1.33 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 90 I 7.75 3.70 1.85 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.94 0.91 0.00 0.00 91 E 8.01 3.98 0.00 2.15 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 2.45 0.00 92 K 8.09 3.99 0.00 1.87 1.99 0.00 1.86 0.00 0.00 1.74 0.00 0.00 3.02 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.48 1.49 7.81 93 V 8.29 3.67 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 1.06 0.00 0.00 0.97 0.00 0.00 94 D 8.11 4.40 0.00 2.96 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 95 R 7.94 3.94 0.00 2.10 2.00 0.00 3.14 0.00 0.00 3.18 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.84 0.00 96 L 8.10 4.08 0.00 1.88 1.76 1.01 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 97 I 8.04 3.80 2.06 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.63 0.95 0.00 0.00 98 E 8.25 4.13 0.00 2.39 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 2.34 2.19 0.00 99 A 8.18 4.15 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 0.00 100 T 8.04 4.41 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 1.24 0.00 0.00 101 D 8.23 4.99 0.00 2.65 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 0.00 102 A 7.39 4.58 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 0.00 103 D 9.16 4.68 0.00 2.87 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 0.00 104 P 0.00 4.44 0.00 2.30 2.25 0.00 3.93 0.00 0.00 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.19 0.00 105 I 8.19 3.99 2.06 0.00 0.00 0.48 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 0.56 0.62 0.00 0.00 106 I 8.00 4.49 1.97 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 1.62 0.81 1.00 0.00 0.00 107 R 8.11 3.82 0.00 2.04 2.06 0.00 3.25 0.00 0.00 3.27 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.68 0.00 108 A 7.19 4.52 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 0.00 109 Q 8.73 4.19 0.00 2.08 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 6.71 0.00 0.00 0.00 0.00 0.00 2.52 2.37 0.00 110 D 7.62 4.64 0.00 2.62 2.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 L 7.69 4.71 0.00 1.25 1.30 0.39 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.69 0.00 0.00 0.00 0.00 0.00 0.00 112 G 8.99 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 0.00 0.00 0.00 113 E 8.63 3.97 0.00 1.94 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 2.29 2.32 0.00 114 N 7.99 4.69 0.00 2.76 2.85 0.00 0.00 6.95 8.06 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 0.00 115 D 7.83 5.04 0.00 2.78 2.83 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 *117 K 8.02 4.26 0.00 1.94 1.92 0.00 1.74 0.00 0.00 1.75 0.00 0.00 3.05 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.34 1.43 7.81 118 T 7.62 4.38 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 1.24 0.00 0.00 119 L 7.66 4.32 0.00 1.61 1.59 0.75 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 120 S 9.24 4.55 0.00 3.88 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 0.00 121 V 8.48 5.07 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 0.93 0.00 0.00 0.87 0.00 0.00 122 K 8.73 4.83 0.00 1.90 1.88 0.00 1.38 0.00 0.00 1.59 0.00 0.00 2.80 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.36 1.42 7.81 123 H 8.92 4.34 0.00 3.16 3.23 0.00 5.71 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 0.00 124 L 7.10 4.28 0.00 1.76 1.49 0.96 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 125 N 7.54 4.72 0.00 2.66 2.65 0.00 0.00 6.95 8.08 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 0.00 126 D 8.25 4.36 0.00 2.94 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 0.00 0.00 0.00 127 N 8.80 4.89 0.00 2.66 3.00 0.00 0.00 6.82 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 0.00 128 W 8.28 5.07 0.00 3.40 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 0.00 129 Y 9.76 5.16 0.00 2.93 2.96 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 0.00 0.00 0.00 130 E 9.54 4.87 0.00 2.01 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 0.00 2.30 2.24 0.00 131 V 9.01 4.18 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 0.14 0.00 0.00 0.81 0.00 0.00 132 N 9.09 5.64 0.00 2.74 2.67 0.00 0.00 6.15 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 0.00 133 Y 8.42 5.18 0.00 2.95 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 0.00 134 T 9.03 4.59 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 1.18 0.00 0.00 135 S 8.90 4.58 0.00 3.74 3.63 0.00 0.00 0.00 0.00 0.00 0.00 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 8.93 3.82 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 0.00 137 K 7.93 4.11 0.00 1.75 1.76 0.00 1.76 0.00 0.00 1.72 0.00 0.00 3.03 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.43 1.44 7.81 138 G 9.47 4.05 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 0.00 0.00 0.00 0.00 0.00 0.00 139 S 7.65 4.48 0.00 4.01 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 0.00 140 Q 8.18 3.86 0.00 1.83 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 7.44 0.00 0.00 0.00 0.00 0.00 1.16 1.70 0.00 141 Y 6.76 4.68 0.00 3.08 2.98 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 0.00 0.00 0.00 142 E 7.75 4.37 0.00 2.20 1.84 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 2.30 2.25 0.00 143 R 9.06 4.60 0.00 1.85 1.65 0.00 3.12 0.00 0.00 3.16 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.52 0.00 144 A 8.71 4.36 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 0.00 145 V 8.32 4.17 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 0.95 0.00 0.00 0.54 0.00 0.00 146 S 8.47 4.50 0.00 3.83 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 0.00 147 I 8.63 4.46 2.01 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 1.51 0.51 1.10 0.00 0.00 148 P 0.00 5.12 0.00 2.13 1.99 0.00 3.62 0.00 0.00 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.10 0.00 149 V 9.74 5.16 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 1.01 0.00 0.00 1.14 0.00 0.00 150 R 8.62 4.39 0.00 0.67 1.11 0.00 2.70 0.00 0.00 2.42 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 0.50 0.00 151 V 8.24 4.92 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 1.02 0.00 0.00 0.75 0.00 0.00 152 V 9.05 4.54 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 0.78 0.00 0.00 0.89 0.00 0.00 153 N 8.67 4.96 0.00 2.53 2.60 0.00 0.00 6.77 7.71 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 0.00 154 V 8.58 4.09 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 0.89 0.00 0.00 0.87 0.00 0.00 155 D 9.81 4.42 0.00 2.75 2.63 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.39 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 0.00 157 Q 7.80 4.30 0.00 2.13 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.96 6.87 0.00 0.00 0.00 0.00 0.00 2.25 2.38 0.00 158 Y 8.36 4.94 0.00 2.88 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 0.00 159 L 9.00 4.98 0.00 1.47 1.43 0.85 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 160 I 8.51 4.58 1.64 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.78 0.91 0.00 0.00 161 D 8.69 4.86 0.00 2.58 2.68 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 0.00 0.00 0.00 0.00 162 D 7.42 4.82 0.00 2.73 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 0.00 0.00 0.00 163 I 8.07 5.16 2.04 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 1.43 0.95 1.01 0.00 0.00 164 T 8.60 3.48 4.33 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 1.25 0.00 0.00 165 P 0.00 4.20 0.00 1.85 1.77 0.00 3.49 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.85 0.00 166 E 8.80 4.30 0.00 2.07 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 2.24 2.31 0.00 * Residues marked with a * may have inaccurate shift predictions.