NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 5 V 4.3648 8.0549 120.6579 63.0629 33.0194 174.3354 6 T 4.4427 8.6888 124.2850 61.4508 71.4563 171.6808 7 S 5.0724 9.5195 124.0874 57.5263 65.2103 173.4615 8 I 4.5157 8.5898 124.1829 59.3745 40.4736 174.7542 9 K 4.8061 8.7817 127.3023 55.9099 33.2245 175.7720 10 L 5.5639 9.2993 127.5026 53.1357 45.8711 175.3935 11 V 5.1325 8.7228 123.7014 59.9650 34.8459 174.1004 12 L 5.1373 8.8104 123.0750 53.1463 44.0824 175.5198 13 L 4.5721 9.6920 122.4925 51.9725 45.8042 176.1514 14 G 4.6963 8.3741 111.5517 44.2240 0.0000 171.6247 15 E 4.0894 8.3973 120.7241 55.7559 30.1800 176.2696 16 A 3.9840 8.5098 125.8941 53.9205 18.8007 177.8269 17 A 3.8598 8.8295 122.4374 52.6735 16.2622 179.4746 18 V 3.7607 7.4056 109.6497 62.9013 31.9453 177.1765 19 G 4.2859 8.6481 109.4042 45.6433 0.0000 175.7040 20 K 3.8406 8.6251 120.7514 59.7353 31.9838 179.2647 21 S 4.4724 7.9195 115.7867 61.1226 62.7748 176.8454 22 S 4.2496 8.0315 117.6254 61.3849 62.6777 176.5105 23 I 3.7680 8.2485 123.0917 64.5122 36.8789 178.8998 24 V 3.6900 7.8391 113.2602 64.3789 31.2923 178.4410 25 L 4.0111 8.3861 120.5561 57.9926 41.8636 179.0093 26 R 4.0854 8.1686 120.2037 58.7680 29.8028 178.3821 27 F 4.1415 7.9290 119.4959 61.1563 39.4295 177.1765 28 V 3.2773 7.8735 116.9598 65.2906 31.5623 176.8051 29 S 4.4639 7.8885 110.6745 57.1822 64.0294 173.2767 30 N 4.2275 7.8528 117.9340 54.7844 37.9516 172.6949 31 D 5.0699 7.7679 113.1628 52.1158 44.8658 173.4991 32 F 4.8470 8.4826 122.8305 56.3085 42.5489 173.4179 33 A 4.3217 7.2307 129.2540 49.8386 20.6427 176.6176 34 E 3.8259 8.6036 124.3242 58.7503 29.9385 176.9675 35 N 4.8590 7.6438 114.7281 52.2715 39.1443 174.5566 36 K 3.6415 7.2815 119.0726 57.1656 32.5303 175.7695 37 E 4.4880 8.3785 126.0567 53.9116 31.0783 173.7569 38 P 4.3796 0.0000 0.0000 62.9825 31.9568 176.7613 39 T 3.9199 8.3289 118.7348 63.6277 68.9742 174.6413 40 I 3.5297 8.0768 126.3832 60.5116 36.4127 174.3007 41 G 3.4303 6.2892 117.0289 43.9459 0.0000 171.6074 42 A 4.7584 6.8028 119.5517 50.3369 22.6130 174.6543 43 A 4.8349 8.8126 120.4493 50.1897 22.5272 174.9518 44 F 4.5255 8.7077 123.4731 56.4605 41.0064 174.7954 45 L 4.7522 7.5178 124.3472 53.1963 46.4015 175.1827 46 T 5.3554 7.9471 109.3397 59.2518 72.0771 172.8161 47 Q 4.4590 8.3761 121.9955 55.0056 32.6082 173.0332 48 R 5.2512 8.4159 123.3848 54.5202 33.0823 175.4316 49 V 4.5900 8.8531 121.5097 61.5282 35.5176 174.1026 50 T 4.9697 8.5366 122.4077 62.3379 70.1878 174.5614 51 I 4.4339 8.4190 126.4048 59.9878 40.4405 176.6270 52 N 4.0012 8.5573 127.2947 54.8253 38.6732 175.5217 53 E 4.3858 8.9911 112.8452 56.4397 30.5884 175.6873 54 H 4.4786 8.2207 118.5415 55.9843 29.7392 173.9425 55 T 4.9276 8.3690 119.4998 62.0187 70.7393 173.4583 56 V 4.4734 8.9844 127.3272 61.0648 33.7114 174.1921 57 K 4.7907 8.8733 130.9173 54.8775 33.8803 174.9830 58 F 4.9364 9.2834 127.9651 56.9668 40.6048 174.8104 59 E 4.2425 9.3499 124.3976 55.0312 31.0164 174.8692 60 I 4.7120 7.6782 126.9891 59.1981 39.7330 175.0943 61 W 4.9424 9.1951 128.4260 55.4357 30.6001 175.3633 62 D 4.9807 9.2540 127.7383 53.0010 41.0246 175.7148 63 T 4.1849 8.1330 116.2206 60.8339 70.1927 174.4218 64 A 4.2227 8.5018 125.8359 52.0339 18.6605 178.0950 65 G 4.1175 8.8044 109.4718 45.1502 0.0000 174.3172 66 Q 4.1895 8.1575 119.9628 55.8754 29.4531 177.1491 67 E 3.9832 9.0083 122.6606 59.1930 29.8409 179.0648 68 R 3.7764 7.9265 113.9185 58.1727 29.6714 177.0392 69 F 4.9320 8.1891 116.5476 57.2497 39.4234 177.2744 70 A 4.3240 8.4719 126.4673 54.9189 17.8304 179.6148 71 S 4.5251 7.9586 109.8594 59.5035 63.6554 175.5453 72 L 4.1279 8.0717 122.6752 56.9961 41.8083 178.2364 73 A 4.4624 7.9193 121.1693 54.6373 18.5127 178.6222 74 P 2.9700 0.0000 0.0000 62.2341 31.5313 177.9837 *76 Y 4.4598 7.9638 117.1127 57.7424 39.9106 176.0407 77 Y 4.6328 7.6659 116.7810 57.4399 39.1601 177.6163 78 R 3.9871 7.8331 117.8161 59.2051 29.1430 177.8294 79 N 5.0054 7.9769 113.0897 52.0831 39.3178 174.4545 80 A 4.3104 7.8671 121.6587 52.6465 19.1298 178.7625 81 Q 4.4827 9.2434 120.7860 57.5585 30.4287 175.7510 82 A 5.3625 7.9646 119.2132 50.2661 23.0759 174.8282 83 A 5.1969 9.1101 121.7906 50.1178 22.9984 174.9742 84 L 4.8154 8.8251 121.8368 53.1377 44.0064 175.8085 85 V 4.4286 8.7893 125.3116 61.5409 32.5543 174.3862 86 V 4.9182 8.7814 129.5309 61.4041 33.8529 174.1403 87 Y 5.0262 8.8196 124.9019 55.3678 42.3986 173.1431 88 D 5.3188 9.1723 119.1774 52.4848 42.8214 177.5081 89 V 3.9302 8.8506 120.2230 63.7367 31.7246 177.4731 90 T 4.5916 8.4421 108.5961 60.5361 69.2579 175.1785 91 K 4.5208 8.1806 122.6268 53.1776 33.7665 174.7565 92 P 4.3566 0.0000 0.0000 65.8819 31.1276 178.1717 93 Q 4.0889 8.2732 117.6274 59.0406 28.6533 178.9470 94 S 4.3488 8.3341 114.9835 61.1356 63.1145 176.2861 95 F 4.1205 8.1869 124.2320 60.7998 39.0378 177.2018 96 I 3.4605 7.7925 119.2312 64.2727 36.8770 177.9966 97 K 3.9163 8.0682 120.0326 59.3966 31.9968 178.5329 98 A 4.1773 8.0727 121.0655 55.3323 18.3475 179.7276 99 R 3.6800 7.6244 116.4060 59.7941 30.0011 179.0952 100 H 4.2518 7.8748 115.8724 58.5001 28.5380 177.9017 101 W 4.1992 8.4303 121.2489 59.7636 28.8759 178.7266 102 V 3.5478 8.0468 118.2828 65.7815 30.9595 178.0677 103 K 3.9580 7.9115 119.0329 59.4116 31.9586 178.4702 104 E 3.9427 8.4571 119.9275 59.2750 29.4690 178.8364 105 L 3.7939 8.3081 119.3513 57.9625 41.3936 179.1957 106 H 4.3394 8.0692 115.5945 58.6499 28.6487 177.4276 107 E 4.1874 8.2733 119.8879 58.7856 29.5452 177.7376 108 Q 4.5231 8.3444 114.9392 55.8366 31.0469 175.5675 109 A 4.7362 7.7471 120.4671 50.5376 20.8476 176.7555 110 S 4.3610 8.4627 113.5355 58.7706 63.2488 176.2806 111 K 4.1455 8.7419 123.3214 58.6604 32.0018 177.4998 112 D 4.8974 7.8636 116.9495 52.7812 39.6415 176.0428 113 I 4.1055 7.5480 119.8798 61.8510 38.8886 175.0604 114 I 4.4874 8.5664 129.0211 59.9000 39.1514 174.5400 115 I 4.9534 8.4482 127.1893 59.3977 40.1326 174.1100 116 A 5.1368 8.9332 128.9290 50.0952 21.6014 175.0395 117 L 4.8905 9.1929 125.8204 54.1724 43.9344 175.5135 118 V 4.5600 9.0414 126.3144 61.0528 34.6025 174.4541 119 G 3.0607 8.5207 116.9275 44.7892 0.0000 172.3394 120 N 5.0629 8.5982 125.8878 51.4711 42.0206 175.0259 121 K 4.2087 8.5283 117.2475 57.1144 28.9138 178.6249 122 I 3.8365 7.5479 114.3428 63.2444 37.9220 177.3531 123 D 4.5029 7.3756 123.5748 52.9658 37.6704 177.5797 *125 L 4.4226 7.7491 117.1566 55.5528 43.6801 177.7910 126 Q 4.7201 8.0204 116.5568 55.6064 30.1902 175.0939 127 E 4.6652 7.4766 120.1896 56.3485 30.0286 179.6470 128 G 3.9605 8.7165 111.1567 44.6782 0.0000 171.9065 129 G 4.1688 7.6290 109.7479 44.2756 0.0000 169.4709 130 E 4.4232 8.5714 122.2235 54.1330 30.9442 175.3802 131 R 4.2325 8.5902 124.6253 56.4446 29.8227 175.7565 132 K 4.3973 8.9609 124.7310 55.9419 32.7513 176.6524 133 V 3.9828 7.4539 118.0923 60.3383 33.3704 174.7947 134 A 4.0534 8.3217 130.6793 52.1745 19.0780 177.7901 135 R 4.2208 8.7420 122.9956 59.1737 30.0958 178.9166 136 E 3.9104 8.1413 117.4451 59.2601 29.3884 178.9422 137 E 4.1357 8.1300 118.9420 58.7531 29.4832 179.3938 138 G 3.5345 7.7130 105.5052 47.8173 0.0000 175.4154 139 E 3.2575 7.6458 121.6867 58.5944 29.3164 179.4694 140 K 3.8564 7.9150 119.6025 59.2913 32.2956 178.6431 141 L 3.8785 7.9002 120.4168 58.0508 41.9757 178.7489 142 A 4.0155 8.0686 120.8073 55.1605 18.0085 179.1923 143 E 3.8407 8.6232 118.0876 59.6151 29.5154 178.9771 144 E 4.0960 8.2744 117.4622 58.4107 29.5843 178.4344 145 K 4.5081 7.9258 115.5586 55.0251 33.3009 175.9477 146 G 3.7681 7.8250 105.4450 46.9893 0.0000 173.5474 147 L 5.0486 7.7858 117.1601 52.2905 45.0843 177.9071 148 L 4.3131 8.6901 121.3055 54.9601 43.1816 175.9420 149 F 5.3800 7.8683 121.9128 56.8377 42.2839 173.6637 150 F 4.5400 8.3150 123.1647 55.6916 43.9155 173.1420 151 E 5.0062 8.4598 120.6187 54.8578 32.0528 175.1059 152 T 4.9326 8.8851 113.1622 60.0198 73.4377 172.6210 153 S 4.5672 8.7176 116.0200 56.3528 64.4552 174.6750 154 A 4.0496 8.6425 131.6174 54.9753 18.5727 178.5689 155 K 2.5877 7.7568 116.5021 58.8180 32.2315 177.7462 156 T 4.0553 7.6891 106.8759 61.6383 69.6162 175.8250 157 G 3.8659 8.2179 111.3872 44.7699 0.0000 172.8006 158 E 3.9130 7.7896 120.9877 57.8841 29.5525 176.8992 159 N 4.4173 9.0700 121.0963 54.0653 37.0802 176.1593 160 V 3.5256 7.7667 119.3434 66.2673 31.5018 177.8483 161 N 4.4739 8.1408 115.6022 56.3303 38.3286 176.9127 162 D 4.2719 7.6702 119.1850 57.0905 40.9255 179.0355 163 V 2.0000 6.8723 118.2002 65.4398 31.3395 178.2361 164 F 3.4838 7.3094 116.8522 60.2099 38.5990 177.5502 165 L 4.2239 8.2681 119.1579 57.8340 41.1727 179.8161 166 G 3.7634 8.0128 104.9293 47.8270 0.0000 175.6043 167 I 4.0625 7.7650 121.9216 64.2797 37.3576 178.8819 168 G 3.7254 8.6325 106.5321 47.3715 0.0000 174.8236 169 E 4.4352 8.4989 119.0026 57.2932 29.6684 177.2708 170 K 4.5626 7.9845 117.4628 55.8280 33.1058 175.6594 171 I 4.5345 7.1254 118.9695 58.3663 39.3938 173.9141 172 P 4.3052 0.0000 0.0000 62.8531 31.7520 175.7331 173 L 4.6951 8.0210 121.9014 52.5549 43.9170 176.7276 174 K 4.1658 8.8463 120.3164 56.9322 31.8603 177.1046 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 5 V 8.05 4.36 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.95 0.00 0.00 0.92 0.00 0.00 6 T 8.69 4.44 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 1.16 0.00 0.00 7 S 9.52 5.07 0.00 3.75 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 8 I 8.59 4.52 1.54 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 1.15 0.63 1.01 0.00 0.00 9 K 8.78 4.81 0.00 1.84 1.93 0.00 1.71 0.00 0.00 1.90 0.00 0.00 2.91 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.68 1.54 7.81 10 L 9.30 5.56 0.00 1.91 1.63 0.94 0.95 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 11 V 8.72 5.13 2.28 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 0.94 0.00 0.00 1.06 0.00 0.00 12 L 8.81 5.14 0.00 1.60 1.53 0.99 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 13 L 9.69 4.57 0.00 0.76 0.13 0.28 0.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 14 G 8.37 4.70 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 0.00 0.00 0.00 15 E 8.40 4.09 0.00 2.22 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 2.48 2.49 0.00 16 A 8.51 3.98 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 17 A 8.83 3.86 1.44 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 18 V 7.41 3.76 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.85 0.00 0.00 1.09 0.00 0.00 19 G 8.65 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 20 K 8.63 3.84 0.00 1.81 1.97 0.00 1.63 0.00 0.00 1.90 0.00 0.00 3.18 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.51 1.56 7.81 21 S 7.92 4.47 0.00 3.85 3.89 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 22 S 8.03 4.25 0.00 4.09 4.14 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 23 I 8.25 3.77 2.03 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.02 0.97 0.00 0.00 24 V 7.84 3.69 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 0.78 0.00 0.00 1.05 0.00 0.00 25 L 8.39 4.01 0.00 1.76 1.66 0.87 0.69 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 26 R 8.17 4.09 0.00 2.05 2.20 0.00 3.25 0.00 0.00 3.21 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.58 0.00 27 F 7.93 4.14 0.00 2.77 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 28 V 7.87 3.28 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 0.75 0.00 0.00 0.75 0.00 0.00 29 S 7.89 4.46 0.00 3.93 3.78 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 30 N 7.85 4.23 0.00 2.78 2.80 0.00 0.00 6.82 8.55 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 31 D 7.77 5.07 0.00 2.65 2.43 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 32 F 8.48 4.85 0.00 2.93 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 33 A 7.23 4.32 1.04 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 0.00 0.00 34 E 8.60 3.83 0.00 2.03 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 2.34 2.41 0.00 35 N 7.64 4.86 0.00 2.68 2.76 0.00 0.00 6.82 7.61 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 36 K 7.28 3.64 0.00 1.66 1.66 0.00 1.55 0.00 0.00 1.50 0.00 0.00 3.00 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.40 1.39 7.81 37 E 8.38 4.49 0.00 1.96 1.80 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 2.24 2.33 0.00 38 P 0.00 4.38 0.00 2.16 2.06 0.00 3.76 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.16 0.00 39 T 8.33 3.92 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 1.16 0.00 0.00 40 I 8.08 3.53 1.81 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 1.42 0.53 0.96 0.00 0.00 41 G 6.29 3.43 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 0.00 42 A 6.80 4.76 0.57 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 0.00 0.00 43 A 8.81 4.83 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 F 8.71 4.53 0.00 1.51 2.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 L 7.52 4.75 0.00 1.23 1.22 0.81 0.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 46 T 7.95 5.36 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 1.15 0.00 0.00 47 Q 8.38 4.46 0.00 1.69 1.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.89 0.00 0.00 0.00 0.00 0.00 1.16 1.77 0.00 48 R 8.42 5.25 0.00 1.67 1.79 0.00 3.16 0.00 0.00 3.12 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.55 0.00 49 V 8.85 4.59 2.36 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 0.99 0.00 0.00 1.30 0.00 0.00 50 T 8.54 4.97 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 1.25 0.00 0.00 51 I 8.42 4.43 1.92 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 1.25 0.81 0.95 0.00 0.00 52 N 8.56 4.00 0.00 2.86 1.97 0.00 0.00 7.19 7.65 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 53 E 8.99 4.39 0.00 2.06 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 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0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.28 0.00 131 R 8.59 4.23 0.00 1.77 1.86 0.00 3.20 0.00 0.00 3.31 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.66 0.00 132 K 8.96 4.40 0.00 1.75 1.80 0.00 1.72 0.00 0.00 1.64 0.00 0.00 2.93 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.38 1.46 7.81 133 V 7.45 3.98 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 -0.37 0.00 0.00 0.79 0.00 0.00 134 A 8.32 4.05 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 0.00 135 R 8.74 4.22 0.00 1.94 1.98 0.00 3.30 0.00 0.00 3.38 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.06 0.00 136 E 8.14 3.91 0.00 2.04 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 2.37 2.43 0.00 137 E 8.13 4.14 0.00 1.90 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 2.26 2.40 0.00 138 G 7.71 3.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 139 E 7.65 3.26 0.00 1.88 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 2.01 2.01 0.00 140 K 7.91 3.86 0.00 1.86 1.97 0.00 1.61 0.00 0.00 1.55 0.00 0.00 3.00 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.43 1.50 7.81 141 L 7.90 3.88 0.00 1.84 1.85 0.81 0.84 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 0.00 142 A 8.07 4.02 1.48 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 0.00 0.00 143 E 8.62 3.84 0.00 2.06 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 2.29 2.47 0.00 144 E 8.27 4.10 0.00 1.99 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.57 0.00 145 K 7.93 4.51 0.00 1.85 1.90 0.00 1.88 0.00 0.00 1.74 0.00 0.00 3.03 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.38 1.55 7.81 146 G 7.82 3.77 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 0.00 0.00 0.00 0.00 0.00 0.00 147 L 7.79 5.05 0.00 1.59 1.77 0.97 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 148 L 8.69 4.31 0.00 1.76 1.56 1.02 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 149 F 7.87 5.38 0.00 2.86 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 0.00 150 F 8.32 4.54 0.00 2.71 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 0.00 151 E 8.46 5.01 0.00 1.82 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 2.20 2.18 0.00 152 T 8.89 4.93 4.14 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 1.05 0.00 0.00 153 S 8.72 4.57 0.00 3.79 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 0.00 154 A 8.64 4.05 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 0.00 155 K 7.76 2.59 0.00 0.79 1.52 0.00 1.46 0.00 0.00 1.72 0.00 0.00 2.90 0.00 0.00 2.96 0.00 0.00 0.00 0.00 0.98 0.33 7.81 156 T 7.69 4.06 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 1.10 0.00 0.00 157 G 8.22 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 158 E 7.79 3.91 0.00 2.00 1.82 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 2.28 2.28 0.00 159 N 9.07 4.42 0.00 3.05 2.87 0.00 0.00 6.75 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 0.00 160 V 7.77 3.53 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 1.13 0.00 0.00 0.96 0.00 0.00 161 N 8.14 4.47 0.00 2.80 2.93 0.00 0.00 7.08 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 0.00 162 D 7.67 4.27 0.00 2.76 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 0.00 163 V 6.87 2.00 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 0.18 0.00 0.00 0.22 0.00 0.00 164 F 7.31 3.48 0.00 2.15 1.80 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 0.00 165 L 8.27 4.22 0.00 1.79 1.78 0.98 1.08 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 G 8.01 3.76 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 0.00 0.00 0.00 167 I 7.77 4.06 2.12 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.69 1.08 0.00 0.00 168 G 8.63 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 0.00 169 E 8.50 4.44 0.00 2.04 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.39 2.61 0.00 170 K 7.98 4.56 0.00 1.75 1.83 0.00 1.70 0.00 0.00 1.74 0.00 0.00 3.03 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.40 1.52 7.81 171 I 7.13 4.53 1.87 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.64 0.91 0.00 0.00 172 P 0.00 4.31 0.00 2.04 1.99 0.00 3.65 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.12 0.00 173 L 8.02 4.70 0.00 1.44 1.45 0.71 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 174 K 8.85 4.17 0.00 1.68 1.74 0.00 1.62 0.00 0.00 1.73 0.00 0.00 3.15 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.48 1.43 7.81 * Residues marked with a * may have inaccurate shift predictions.