NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 4 A 4.3417 8.2649 123.5876 51.9360 20.0379 175.8750 5 I 4.2791 8.2355 122.4219 59.0092 39.8515 172.9221 6 K 4.8143 9.3157 127.8109 54.4925 35.1247 175.8273 7 V 4.1939 9.2052 118.4661 60.8588 34.9899 176.6651 8 G 2.0000 7.9268 108.8308 43.6461 0.0000 172.7795 9 A 3.7926 7.8028 121.3000 51.0144 19.7556 176.9566 10 W 4.1115 9.9148 120.5626 54.1717 31.0157 176.8485 11 G 3.2829 6.7756 109.6726 44.6443 0.0000 171.7949 12 G 4.0638 7.8341 111.6352 43.5669 0.0000 173.1176 13 N 4.6119 8.4844 114.5759 53.0916 39.0007 176.3179 14 G 3.7975 7.7721 107.7599 45.6351 0.0000 173.4327 15 G 3.9830 8.5514 108.2852 44.8386 0.0000 172.6721 16 S 4.9614 8.3822 112.2790 56.0021 66.4610 173.5856 17 A 4.6619 8.6565 123.5730 52.0966 18.9658 176.7822 18 F 5.1003 8.5469 116.7184 55.4079 41.9526 174.2101 19 D 4.9614 8.6612 117.5462 54.3121 42.4230 174.8385 20 M 4.3182 9.3763 124.9879 55.5417 32.1850 177.6222 21 G 3.4670 8.3275 109.1169 43.4451 0.0000 170.7797 22 P 4.1331 0.0000 0.0000 62.1461 32.1507 175.2750 23 A 4.9729 8.4018 122.1415 50.4284 21.1054 176.3365 24 Y 4.2897 8.8462 121.2504 60.6120 39.6652 176.8084 25 R 4.6041 7.7813 115.8333 55.0699 34.1873 173.9263 26 I 4.5212 8.4938 127.5454 61.5170 37.6657 175.6368 27 I 4.2376 9.3739 129.2887 63.5527 38.1885 176.0189 28 S 5.0741 7.8087 114.5186 56.9599 66.6925 172.5941 29 V 4.6861 8.7880 121.0785 60.9580 34.6555 173.9518 30 K 4.6341 9.2472 129.4358 54.7298 34.7548 174.4913 31 I 4.8322 8.3636 129.4952 59.8829 39.1469 174.8003 32 F 5.1621 9.3305 127.4761 56.3437 40.3728 175.3248 33 S 5.2775 8.8042 117.8933 56.8105 66.7338 175.0663 34 G 4.2973 9.2560 107.4413 46.7651 0.0000 174.9203 35 D 4.5657 9.5382 127.4532 56.6597 42.3858 175.6405 36 V 4.4828 7.0825 116.1795 60.6713 36.2005 174.6337 37 V 4.2914 8.6002 123.3184 62.3146 31.5357 176.0642 38 D 4.8659 9.3606 128.8419 57.1747 42.0362 176.3166 39 A 4.6987 7.6658 117.0809 51.5789 22.8183 175.2712 40 V 4.9409 8.5615 118.7532 61.5642 35.4842 173.5737 41 D 5.2819 9.4822 127.8275 52.7089 43.1355 175.4073 42 V 4.8632 8.7098 123.6008 61.4301 34.5072 174.0790 43 T 5.2619 8.7755 124.9502 61.9796 71.0513 173.5132 44 F 5.4012 8.8270 119.8563 56.3096 41.8171 173.1510 45 T 5.0484 8.7375 110.5036 61.1362 71.8020 173.6403 46 Y 4.6756 9.3717 121.9691 57.5488 41.6886 173.6217 47 Y 3.3468 9.0378 126.7247 58.8123 35.5844 172.0466 48 G 3.9703 8.5553 107.2539 44.9314 0.0000 174.1576 49 K 4.6296 8.0167 119.2797 54.8589 34.3659 174.9155 50 T 4.9157 8.2576 118.4674 62.1267 70.1383 173.9393 51 E 4.5766 8.9680 125.1209 54.6330 33.9407 174.7164 52 T 5.0351 8.2827 118.4060 61.8260 71.6415 173.5263 53 R 4.5617 9.1442 124.8295 54.4453 33.7728 173.9866 54 H 5.0062 8.2901 121.7336 54.2403 32.1744 173.1048 55 F 4.5896 8.6580 124.0114 57.0193 42.1403 175.9948 56 G 3.5461 8.9976 109.2245 44.5950 0.0000 171.0836 57 G 4.4473 8.4084 109.6407 43.8085 0.0000 173.2037 58 S 4.2816 8.4276 112.4445 58.0375 63.9748 174.2803 59 G 3.8188 7.7760 110.3866 45.2960 0.0000 173.6805 60 G 4.1194 8.7712 104.6441 45.6264 0.0000 172.4391 61 T 4.7331 8.7502 115.7064 60.8670 70.5262 172.9827 62 P 3.8715 0.0000 0.0000 62.7390 32.4571 175.4824 63 H 4.4279 8.6129 119.8585 53.9078 31.7886 171.8997 64 E 4.6502 8.5762 124.7441 54.7793 31.2394 175.2396 65 I 3.8904 8.8722 128.2104 59.5642 39.3653 174.5293 66 V 4.4061 8.1411 127.7226 61.1478 32.7686 174.8309 67 L 4.6540 8.5667 131.2580 54.3793 42.8783 177.9927 68 Q 4.2773 9.6120 125.8464 54.2319 29.5921 172.1129 *69 E 4.2477 8.4977 111.6144 58.8031 29.8919 173.5446 70 G 3.6745 8.5084 111.0778 44.9185 0.0000 172.3453 71 E 4.5244 7.3978 119.9722 54.4733 31.0943 174.7239 72 Y 5.0340 9.0503 122.6386 55.9973 43.0076 174.4530 73 L 4.7027 8.6434 121.3727 54.6322 42.9695 177.5763 74 V 4.5950 8.7218 116.8791 60.3288 33.6962 175.3548 75 G 4.8930 7.7629 104.8104 44.8145 0.0000 172.6197 76 M 5.0917 8.2792 124.3584 54.2136 36.0423 174.5005 77 K 4.2684 8.3615 127.5314 53.7266 37.0560 174.2516 78 G 3.3983 6.2389 105.7652 46.2996 0.0000 171.7873 79 E 5.2587 8.1411 117.6712 54.6309 34.2659 174.8875 80 F 5.4856 8.4700 117.5339 55.2818 41.8476 174.0247 81 G 4.2125 8.5743 106.7844 45.8818 0.0000 171.5750 82 N 5.0912 9.0081 119.1857 53.5697 39.2676 174.1297 83 Y 4.4769 9.1689 129.3991 56.6766 38.8044 174.8356 84 H 3.7276 9.3849 126.3853 57.2998 26.3426 175.8475 85 G 4.1011 8.3700 107.7556 45.1995 0.0000 174.9269 86 V 4.4920 7.7819 118.8680 60.7976 34.7145 174.7729 87 V 4.3342 8.5886 127.6487 63.1248 32.3680 174.9280 88 V 4.8613 8.8601 120.8252 59.0421 36.7517 175.2950 89 V 4.2842 8.9884 122.6133 63.6000 31.7779 176.6891 90 G 3.8482 9.2645 116.5712 47.0939 0.0000 172.9987 91 K 5.2587 7.8753 118.6240 54.7466 37.1030 175.3138 92 L 4.8845 9.0145 125.2979 53.7738 45.8410 174.9509 93 G 4.4260 9.2763 112.5338 44.5835 0.0000 171.0896 94 F 5.7142 9.0033 117.5853 55.5559 43.7786 174.1607 95 S 5.4420 9.2487 115.5860 57.0349 66.6995 173.4981 96 T 5.6758 9.4621 112.7559 59.2266 71.5786 174.6523 97 N 4.7200 8.9640 117.0539 54.0366 37.5748 175.5252 98 K 4.4799 7.5943 116.8986 57.2739 34.7339 176.1431 99 K 4.4542 8.2488 117.5525 55.0661 35.3515 174.0524 100 S 4.9699 8.1490 118.0466 56.7398 64.2466 172.9443 101 Y 4.7051 8.9423 124.4864 57.1466 41.4334 176.2081 102 G 2.6970 8.4419 111.6753 44.5916 0.0000 171.4954 103 P 4.1477 0.0000 0.0000 62.4539 32.3242 175.6823 104 F 4.8006 8.5847 118.4159 56.5993 41.1698 175.4729 105 G 4.6637 8.7068 111.3019 45.4771 0.0000 173.2354 106 N 4.8310 8.3609 116.3316 52.7156 39.7442 174.6161 107 T 4.4150 7.5830 116.6287 61.3808 69.6143 174.3366 108 G 3.8280 8.5280 115.9225 45.8203 0.0000 172.9296 109 G 3.6850 8.6670 113.1698 45.5591 0.0000 175.3492 110 T 4.0648 8.8387 124.2241 61.8444 69.1606 172.4778 111 P 4.9248 0.0000 0.0000 62.5292 32.4355 175.7568 112 F 5.1428 8.6343 116.9423 55.4853 41.7165 173.5227 113 S 4.6380 8.2689 113.6035 57.0388 66.1053 173.7729 114 L 4.7734 9.0642 125.2890 52.4312 42.7457 172.3226 115 P 4.7703 0.0000 0.0000 62.1132 32.7330 176.3444 116 I 4.3617 8.3716 124.2646 59.5549 37.5855 175.3838 117 A 4.1022 8.7382 130.9783 54.2683 18.7145 177.8176 118 A 4.4845 7.9073 117.2493 51.6488 22.0398 175.0716 119 G 3.9689 9.6843 108.2123 44.2060 0.0000 172.2309 120 K 4.8497 8.4447 115.7740 55.3596 36.3046 175.5107 121 I 4.5356 8.6479 123.8482 61.5044 37.4281 176.1519 122 S 4.6128 8.9574 120.2845 57.3718 64.8490 173.5329 123 G 4.0736 6.7341 107.3835 46.4451 0.0000 171.7410 124 F 5.9197 8.2334 117.2295 55.9370 43.8126 174.1116 125 F 4.8509 8.9825 115.2443 55.4055 41.8435 173.3568 126 G 3.2219 6.2112 105.2261 45.0304 0.0000 171.8282 127 R 5.1162 8.0159 120.9018 54.6120 34.7774 174.9099 128 G 4.6488 9.5915 109.1259 44.7696 0.0000 171.8091 129 G 4.6488 9.0913 111.0686 46.0846 0.0000 173.4957 130 D 4.2587 9.4267 125.5809 56.0870 41.5188 174.5417 131 F 5.7099 7.4682 115.7721 55.5051 42.3911 173.9462 132 I 4.6086 8.7183 122.8624 60.9329 36.4205 176.9471 133 D 4.5995 8.9314 127.8747 57.0703 42.0115 176.3767 134 A 5.0869 8.1526 117.8244 50.7227 23.2395 175.1608 135 I 4.9305 8.8857 120.3983 59.4274 42.0653 174.3344 136 G 3.6711 8.8821 115.0911 44.2458 0.0000 171.0437 137 V 5.0724 8.7204 118.6749 61.2660 35.0298 174.0002 138 Y 4.7166 8.9877 125.4159 57.8558 39.1525 174.4866 139 L 5.3211 8.9341 123.3980 53.0321 45.0868 175.5622 140 E 4.7934 8.8070 119.4340 53.7584 34.1056 173.8987 141 P 4.3740 0.0000 0.0000 62.9098 31.4518 176.6657 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 4 A 8.26 4.34 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 5 I 8.24 4.28 2.07 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.47 0.91 0.00 0.00 6 K 9.32 4.81 0.00 1.12 0.91 0.00 1.10 0.00 0.00 1.14 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.30 0.80 7.81 7 V 9.21 4.19 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 0.78 0.00 0.00 1.16 0.00 0.00 8 G 7.93 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 0.00 0.00 0.00 0.00 0.00 0.00 9 A 7.80 3.79 0.80 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 10 W 9.91 4.11 0.00 2.14 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 0.00 0.00 0.00 11 G 6.78 3.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 12 G 7.83 4.06 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 13 N 8.48 4.61 0.00 2.71 2.84 0.00 0.00 6.81 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 14 G 7.77 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 15 G 8.55 3.98 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 0.00 0.00 0.00 16 S 8.38 4.96 0.00 3.88 3.97 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 17 A 8.66 4.66 1.22 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 18 F 8.55 5.10 0.00 2.91 3.17 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 19 D 8.66 4.96 0.00 2.72 2.67 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 20 M 9.38 4.32 0.00 2.62 2.18 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.96 0.00 21 G 8.33 3.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.13 0.00 2.14 1.85 0.00 3.53 0.00 0.00 2.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.88 0.00 23 A 8.40 4.97 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 24 Y 8.85 4.29 0.00 2.80 3.18 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 25 R 7.78 4.60 0.00 1.78 1.80 0.00 3.11 0.00 0.00 3.13 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.61 0.00 26 I 8.49 4.52 1.94 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 1.40 0.99 1.02 0.00 0.00 27 I 9.37 4.24 1.95 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 1.33 0.74 0.92 0.00 0.00 28 S 7.81 5.07 0.00 3.85 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 29 V 8.79 4.69 1.79 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 0.60 0.00 0.00 0.77 0.00 0.00 30 K 9.25 4.63 0.00 1.69 1.59 0.00 1.62 0.00 0.00 1.24 0.00 0.00 2.72 0.00 0.00 2.77 0.00 0.00 0.00 0.00 0.68 1.07 7.81 31 I 8.36 4.83 1.76 0.00 0.00 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 1.47 0.51 1.09 0.00 0.00 32 F 9.33 5.16 0.00 2.96 3.18 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 33 S 8.80 5.28 0.00 4.00 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 34 G 9.26 4.30 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 0.00 35 D 9.54 4.57 0.00 2.34 2.50 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 36 V 7.08 4.48 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 0.23 0.00 0.00 0.07 0.00 0.00 37 V 8.60 4.29 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 1.10 0.00 0.00 1.07 0.00 0.00 38 D 9.36 4.87 0.00 3.08 2.87 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 39 A 7.67 4.70 1.22 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 40 V 8.56 4.94 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 0.85 0.00 0.00 1.02 0.00 0.00 41 D 9.48 5.28 0.00 2.68 2.58 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 42 V 8.71 4.86 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 1.37 0.00 0.00 0.81 0.00 0.00 43 T 8.78 5.26 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 1.22 0.00 0.00 44 F 8.83 5.40 0.00 3.28 3.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 T 8.74 5.05 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 1.29 0.00 0.00 46 Y 9.37 4.68 0.00 3.39 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 47 Y 9.04 3.35 0.00 2.79 2.87 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 48 G 8.56 3.97 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 0.00 0.00 0.00 49 K 8.02 4.63 0.00 2.16 1.88 0.00 1.71 0.00 0.00 1.71 0.00 0.00 3.11 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.41 1.45 7.81 50 T 8.26 4.92 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 51 E 8.97 4.58 0.00 1.16 1.29 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 2.01 2.18 0.00 52 T 8.28 5.04 4.16 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 0.00 0.00 0.00 1.22 0.00 0.00 53 R 9.14 4.56 0.00 1.36 1.11 0.00 3.41 0.00 0.00 3.14 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 2.03 0.00 54 H 8.29 5.01 0.00 2.98 2.98 0.00 5.86 0.00 0.00 0.00 0.00 6.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 F 8.66 4.59 0.00 2.38 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 56 G 9.00 3.55 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 0.00 0.00 0.00 57 G 8.41 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 0.00 0.00 0.00 0.00 58 S 8.43 4.28 0.00 3.85 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 59 G 7.78 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 60 G 8.77 4.12 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 0.00 0.00 0.00 61 T 8.75 4.73 4.31 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 0.00 0.00 0.00 1.09 0.00 0.00 62 P 0.00 3.87 0.00 1.51 0.74 0.00 3.59 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 1.75 1.87 0.00 63 H 8.61 4.43 0.00 1.61 2.16 0.00 5.60 0.00 0.00 0.00 0.00 6.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 E 8.58 4.65 0.00 1.80 1.72 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 2.11 2.19 0.00 65 I 8.87 3.89 1.54 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 0.13 0.41 0.28 0.00 0.00 66 V 8.14 4.41 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 0.88 0.00 0.00 67 L 8.57 4.65 0.00 1.54 1.53 0.96 0.79 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 68 Q 9.61 4.28 0.00 1.93 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.45 6.99 0.00 0.00 0.00 0.00 0.00 2.29 2.17 0.00 *69 E 8.50 4.25 0.00 1.98 1.78 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 2.23 1.88 0.00 70 G 8.51 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 0.00 0.00 0.00 71 E 7.40 4.52 0.00 1.86 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 2.24 2.37 0.00 72 Y 9.05 5.03 0.00 2.88 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 73 L 8.64 4.70 0.00 1.71 1.79 0.90 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 74 V 8.72 4.59 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 0.85 0.00 0.00 1.08 0.00 0.00 75 G 7.76 4.89 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 0.00 0.00 0.00 76 M 8.28 5.09 0.00 2.08 1.95 0.00 0.00 0.00 0.00 0.00 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 2.45 0.00 77 K 8.36 4.27 0.00 1.43 1.57 0.00 1.94 0.00 0.00 1.65 0.00 0.00 2.79 0.00 0.00 2.73 0.00 0.00 0.00 0.00 1.26 1.26 7.81 78 G 6.24 3.40 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 0.00 79 E 8.14 5.26 0.00 1.79 1.76 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 2.05 2.04 0.00 80 F 8.47 5.49 0.00 3.28 3.26 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 81 G 8.57 4.21 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 0.00 82 N 9.01 5.09 0.00 2.82 2.81 0.00 0.00 6.67 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 83 Y 9.17 4.48 0.00 2.94 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 84 H 9.38 3.73 0.00 3.02 3.22 0.00 5.73 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 G 8.37 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 0.00 0.00 0.00 86 V 7.78 4.49 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 1.21 0.00 0.00 1.03 0.00 0.00 87 V 8.59 4.33 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 1.12 0.00 0.00 1.03 0.00 0.00 88 V 8.86 4.86 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 1.00 0.00 0.00 0.98 0.00 0.00 89 V 8.99 4.28 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 1.27 0.00 0.00 1.15 0.00 0.00 90 G 9.26 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 91 K 7.88 5.26 0.00 1.55 1.52 0.00 1.55 0.00 0.00 1.64 0.00 0.00 2.85 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.44 1.54 7.81 92 L 9.01 4.88 0.00 1.76 1.57 1.16 0.59 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 93 G 9.28 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 0.00 0.00 0.00 0.00 94 F 9.00 5.71 0.00 3.19 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 95 S 9.25 5.44 0.00 3.91 3.97 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 96 T 9.46 5.68 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 1.46 0.00 0.00 97 N 8.96 4.72 0.00 2.92 3.08 0.00 0.00 5.78 7.13 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 98 K 7.59 4.48 0.00 1.87 1.87 0.00 1.74 0.00 0.00 1.64 0.00 0.00 2.90 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.38 1.49 7.81 99 K 8.25 4.45 0.00 1.70 1.51 0.00 1.48 0.00 0.00 1.18 0.00 0.00 2.31 0.00 0.00 2.62 0.00 0.00 0.00 0.00 0.77 1.16 7.81 100 S 8.15 4.97 0.00 3.78 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 0.00 101 Y 8.94 4.71 0.00 3.33 3.11 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 0.00 102 G 8.44 2.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 P 0.00 4.15 0.00 1.99 1.81 0.00 3.51 0.00 0.00 3.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.79 0.00 104 F 8.58 4.80 0.00 3.13 2.85 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 0.00 105 G 8.71 4.66 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 0.00 106 N 8.36 4.83 0.00 2.69 2.78 0.00 0.00 6.82 7.38 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 0.00 107 T 7.58 4.41 4.12 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 1.26 0.00 0.00 108 G 8.53 3.83 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 0.00 0.00 0.00 109 G 8.67 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 0.00 110 T 8.84 4.06 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 1.04 0.00 0.00 111 P 0.00 4.92 0.00 1.84 1.83 0.00 3.52 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 1.94 1.97 0.00 112 F 8.63 5.14 0.00 2.42 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 0.00 113 S 8.27 4.64 0.00 3.70 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 0.00 114 L 9.06 4.77 0.00 1.52 1.59 1.14 1.07 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 0.00 115 P 0.00 4.77 0.00 2.10 2.03 0.00 3.52 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 2.09 0.00 116 I 8.37 4.36 1.97 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.88 1.02 0.00 0.00 117 A 8.74 4.10 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 0.00 118 A 7.91 4.48 1.20 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 0.00 0.00 0.00 119 G 9.68 3.97 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 0.00 0.00 0.00 120 K 8.44 4.85 0.00 1.78 1.70 0.00 0.85 0.00 0.00 0.89 0.00 0.00 2.70 0.00 0.00 2.66 0.00 0.00 0.00 0.00 1.33 1.32 7.81 121 I 8.65 4.54 1.92 0.00 0.00 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.63 0.62 0.00 0.00 122 S 8.96 4.61 0.00 4.00 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 0.00 123 G 6.73 4.07 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 0.00 0.00 0.00 124 F 8.23 5.92 0.00 3.17 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 0.00 125 F 8.98 4.85 0.00 3.08 3.26 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 0.00 126 G 6.21 3.22 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 0.00 127 R 8.02 5.12 0.00 1.71 1.90 0.00 3.02 0.00 0.00 3.29 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.41 0.00 128 G 9.59 4.65 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 0.00 129 G 9.09 4.65 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 0.00 130 D 9.43 4.26 0.00 2.34 1.70 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 0.00 131 F 7.47 5.71 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 0.00 132 I 8.72 4.61 2.14 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 1.13 1.10 0.00 0.00 133 D 8.93 4.60 0.00 2.81 2.77 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 0.00 134 A 8.15 5.09 1.07 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 0.00 0.00 135 I 8.89 4.93 2.05 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.92 1.10 0.00 0.00 136 G 8.88 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 0.00 0.00 0.00 137 V 8.72 5.07 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 1.17 0.00 0.00 0.98 0.00 0.00 138 Y 8.99 4.72 0.00 3.06 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 0.00 139 L 8.93 5.32 0.00 1.50 1.56 0.99 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 140 E 8.81 4.79 0.00 1.99 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 2.16 2.21 0.00 141 P 0.00 4.37 0.00 2.16 1.97 0.00 3.60 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.07 0.00 * Residues marked with a * may have inaccurate shift predictions.