NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 7 D 4.6434 8.3493 120.5317 54.0562 42.9409 176.5720 8 P 4.3553 0.0000 0.0000 63.7541 32.7290 173.4714 9 I 4.7278 8.5115 122.5266 59.8789 39.8680 176.0331 10 T 4.4920 8.8341 124.8439 61.9520 70.5083 174.0440 11 I 4.3047 8.1991 127.3324 60.5956 37.9795 175.7914 12 L 4.4775 8.4639 127.8639 53.7952 42.7018 176.8850 13 D 4.5337 8.4889 120.7682 52.9639 40.5587 177.2210 14 S 4.0738 8.7854 114.8940 61.8655 62.2459 176.7405 15 S 4.1201 8.0526 117.1506 61.5480 62.5543 175.9129 16 D 4.2258 8.9496 120.8882 57.4779 40.9807 178.2074 17 S 4.0535 8.1856 115.7698 61.9441 62.8585 177.0153 18 L 4.1177 8.3359 121.6646 57.7770 41.1171 179.7080 19 S 4.1816 8.0783 114.4667 61.8220 63.2110 176.7491 20 R 3.8355 8.0852 120.8825 58.8348 29.6245 178.7791 21 L 4.3154 8.3013 120.8427 58.3846 41.9491 179.1907 22 S 4.3670 8.3181 113.1245 61.1713 62.8164 175.8448 23 S 4.4642 7.9091 115.6132 58.5266 63.4535 173.6292 24 E 4.8646 7.7067 122.0422 54.9681 31.8469 175.6443 25 S 4.2483 8.5201 112.9406 57.8448 65.0904 173.1862 26 V 5.0815 8.1266 120.9664 61.4356 33.5922 174.4914 27 G 3.8649 9.7067 114.0922 44.6064 0.0000 170.7935 28 R 4.7651 7.7668 118.2353 53.9139 33.2480 175.0408 29 L 4.6230 8.1277 126.2961 53.5000 44.1308 174.9895 30 V 4.6836 8.7156 126.5358 61.3120 33.5817 174.8820 31 V 5.1052 8.7751 120.6650 60.0961 36.0627 174.1244 32 H 5.2435 8.5210 115.7264 54.6180 31.6605 172.7166 33 R 4.6266 8.6692 121.4393 55.0425 31.7552 177.0498 34 K 3.8153 8.2070 128.0394 58.0747 30.9987 177.5832 35 D 4.6449 8.9231 128.2251 55.3746 41.5366 175.6521 36 D 4.5064 7.8624 120.5507 53.9530 41.7818 174.7327 37 L 5.3600 8.2724 125.3744 53.3653 44.9543 174.6997 38 D 4.8785 9.0075 119.8078 53.4791 45.5790 173.5428 39 I 5.4869 8.4395 120.2982 59.7284 41.0788 173.6225 40 F 5.1602 7.6670 122.3247 54.8323 41.2282 171.5822 41 P 5.0171 0.0000 0.0000 63.0379 32.4585 175.6045 42 V 4.8328 9.1938 114.1063 59.8695 36.6836 174.0374 43 N 5.4314 9.0772 120.6614 53.3643 39.1177 174.4825 44 F 5.4527 8.9903 117.7967 55.3724 41.8585 174.2350 45 V 4.2794 8.8259 111.2657 59.4064 35.9124 174.5445 46 L 4.7849 8.5623 125.8197 54.1705 43.2416 174.9326 47 D 4.9793 9.5278 126.8614 52.9005 43.2799 175.8342 48 Y 4.8303 8.7329 121.9932 58.1579 38.9140 176.7066 49 S 4.3153 8.1885 116.0020 60.0566 63.4643 173.9418 50 A 4.8684 7.5082 123.4673 50.9304 20.8750 176.0348 51 E 4.2098 8.7494 112.8074 58.6069 29.9716 176.7183 52 Q 4.7501 7.6354 115.9209 52.6652 32.7961 172.9178 53 P 4.6119 0.0000 0.0000 63.3804 32.6198 175.3682 54 R 4.7428 8.8533 120.1776 54.4623 34.5809 174.1373 55 V 4.7272 8.0950 122.3821 61.3404 34.1277 173.8795 56 Y 5.3017 8.8741 125.0189 56.3614 41.0974 174.6850 57 F 5.4534 8.7138 116.8576 55.9345 42.2660 172.9982 58 R 5.0843 8.7835 117.4597 54.5262 32.7107 176.1259 59 T 4.7295 8.9451 112.0799 61.6358 71.1673 173.4523 60 A 4.4121 9.6768 132.3780 54.0368 17.1147 177.8089 *63 T 4.2461 8.9330 112.5426 58.8928 71.4538 175.6615 64 K 3.7329 8.1816 118.3202 57.0554 30.0350 176.5179 65 L 3.7036 7.5767 117.3990 57.2659 41.5163 177.5886 66 F 4.8598 8.1048 123.2844 56.6265 40.1433 174.2565 67 S 4.7455 7.6741 122.1932 55.9607 64.8418 175.2365 68 V 3.6270 8.1577 117.8349 63.7041 31.3881 177.1338 69 N 4.5431 7.8336 115.4420 53.7081 37.9280 175.5496 70 L 4.0916 7.2292 119.3673 54.0794 42.2720 176.4358 71 N 4.3669 8.4047 121.2142 54.0330 39.3933 175.3596 72 S 4.4469 8.6070 117.9978 60.5728 64.4530 172.9807 73 D 5.0068 8.4466 121.9386 54.1125 41.5645 175.7747 74 V 4.8581 8.9843 118.2988 59.9184 36.9512 174.0962 75 L 5.3020 8.5190 120.8541 53.0627 45.3654 175.6239 76 F 5.0397 9.1103 123.1031 56.4172 42.7273 173.1795 77 E 4.9962 8.0462 126.0910 54.2759 33.1469 174.3128 78 V 4.7118 8.5929 125.3940 61.2219 35.2291 173.8211 79 D 4.4020 8.0237 124.5209 52.4502 43.2403 174.5670 80 R 4.2213 7.7102 115.4045 55.5965 34.7278 174.7589 81 F 5.0019 8.5743 125.1432 57.0552 42.7940 171.9654 82 D 4.5572 7.2845 122.5405 54.9190 47.3800 176.6231 *85 E 4.0528 8.2252 117.6576 56.6445 31.6517 175.0690 86 G 4.1546 8.0466 103.7075 46.1896 0.0000 172.1698 87 W 6.3000 8.6851 116.1395 55.4559 32.0210 174.1118 88 S 5.1855 9.7745 114.7453 57.0579 66.7046 172.8245 89 V 4.9769 9.3009 121.1845 61.2454 34.7911 174.1754 90 V 4.8092 8.9978 127.8302 61.1475 34.0810 173.9181 91 L 5.1564 9.3912 128.9471 53.3056 43.9695 175.5580 92 K 4.7878 8.5621 123.1017 55.5372 34.2811 176.4196 93 G 3.9144 8.1768 109.5770 46.1266 0.0000 170.8827 94 N 5.4920 8.4653 116.6610 51.2676 41.7795 173.6283 95 A 4.8645 8.8074 126.0508 50.3371 21.1926 175.6352 96 Y 5.0420 8.6771 119.1554 55.7804 42.6703 175.1602 97 V 4.0881 8.8605 123.1368 63.7637 31.7795 175.9619 98 V 3.6730 8.5596 128.3596 66.6268 31.2222 177.0019 99 R 4.1758 8.4850 122.2630 57.4751 28.5601 176.8767 100 D 4.3864 7.8325 119.9887 54.4253 41.5800 176.2684 101 T 3.8504 8.5408 125.1260 67.0608 68.5741 175.6504 102 E 3.9260 8.1931 120.2942 59.0254 29.6182 178.3656 103 E 3.8350 8.8743 119.5313 58.9991 29.8238 178.0953 104 A 3.7281 8.0308 120.4767 55.3771 18.0511 179.4292 105 R 3.7114 7.4242 115.1582 59.7265 30.5196 177.6627 106 H 4.0882 7.9840 117.7643 59.4507 29.7627 176.8313 107 A 2.9950 7.7658 122.4532 54.7361 17.6775 178.5033 108 D 4.5401 7.3545 114.2411 55.8476 41.3945 177.0936 109 T 4.3697 7.2480 108.1311 62.3140 69.5282 174.8959 110 L 4.1187 7.3926 120.8360 55.3358 42.0586 177.1116 111 G 3.8259 8.0162 106.3698 45.8666 0.0000 173.9102 112 L 4.1241 7.6506 118.1543 53.6488 42.3455 177.4197 113 K 4.0647 8.3841 121.5785 55.6948 32.4590 175.5254 114 P 4.1814 0.0000 0.0000 62.7421 31.8002 176.4557 115 W 4.9415 8.1653 121.8562 55.1437 31.2589 175.6920 116 L 4.1285 8.3707 118.9291 54.8332 41.1659 176.6606 117 P 4.5233 0.0000 0.0000 64.2387 31.3734 176.7157 118 T 4.3467 7.7601 108.5728 62.3575 70.1791 174.8265 119 L 4.1212 7.9161 121.8114 54.0987 41.4784 176.7253 120 K 4.2158 8.5360 125.5334 56.9282 32.8029 174.8388 121 Y 5.1874 7.5323 120.3184 56.4939 40.9348 172.9594 122 N 5.1103 9.0035 116.3444 51.2872 43.0014 174.3276 123 F 4.8256 8.7157 119.5330 57.3894 40.9297 174.5466 124 V 4.6184 8.6932 121.9569 61.0039 34.2783 174.0392 125 R 4.5496 9.0131 128.0064 54.5616 32.5096 174.5125 126 I 4.6121 8.5286 127.4037 59.7318 39.4599 174.4032 127 D 4.7531 8.8928 128.5663 53.3836 42.0114 175.8799 128 V 4.2450 7.9672 125.0869 62.5128 31.5554 175.6061 129 R 4.4177 9.1024 128.9919 58.0406 31.2940 176.1260 130 E 4.8528 7.8950 116.0618 54.7633 34.4367 174.4300 131 V 4.8659 8.3678 121.5545 61.3028 34.4882 174.7396 132 S 4.6778 9.5583 123.9553 56.7734 66.1509 173.2184 133 G 5.0810 8.6483 111.5126 43.8067 0.0000 171.9190 134 R 5.1227 9.2540 120.6295 54.0899 35.0624 173.9272 135 A 5.1943 8.7432 123.8412 50.1390 22.4709 175.0694 136 F 5.3598 9.4233 120.1772 55.6596 41.9629 175.9836 137 V 4.0680 8.6816 123.2634 63.0075 31.2515 175.0518 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 7 D 8.35 4.64 0.00 2.68 2.80 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 8 P 0.00 4.36 0.00 2.28 2.34 0.00 3.65 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.10 0.00 9 I 8.51 4.73 1.84 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 1.43 0.75 0.70 0.00 0.00 10 T 8.83 4.49 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 1.17 0.00 0.00 11 I 8.20 4.30 1.84 0.00 0.00 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 1.31 0.73 0.89 0.00 0.00 12 L 8.46 4.48 0.00 1.49 1.53 0.94 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 13 D 8.49 4.53 0.00 2.88 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 14 S 8.79 4.07 0.00 3.92 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 15 S 8.05 4.12 0.00 4.03 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 16 D 8.95 4.23 0.00 2.78 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 17 S 8.19 4.05 0.00 4.12 3.94 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 0.00 0.00 0.00 18 L 8.34 4.12 0.00 1.81 1.93 1.10 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 19 S 8.08 4.18 0.00 3.92 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 20 R 8.09 3.84 0.00 1.35 0.66 0.00 2.21 0.00 0.00 2.25 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 1.48 0.00 21 L 8.30 4.32 0.00 1.95 1.96 1.02 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 22 S 8.32 4.37 0.00 4.15 4.35 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 23 S 7.91 4.46 0.00 4.18 4.08 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 0.00 0.00 0.00 24 E 7.71 4.86 0.00 2.52 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 2.66 0.00 25 S 8.52 4.25 0.00 3.75 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 26 V 8.13 5.08 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 0.93 0.00 0.00 1.09 0.00 0.00 27 G 9.71 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 0.00 0.00 0.00 28 R 7.77 4.77 0.00 1.32 1.51 0.00 3.12 0.00 0.00 2.92 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 1.27 0.00 29 L 8.13 4.62 0.00 1.18 0.37 0.87 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 0.00 0.00 0.00 0.00 30 V 8.72 4.68 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 0.87 0.00 0.00 0.79 0.00 0.00 31 V 8.78 5.11 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 0.98 0.00 0.00 1.16 0.00 0.00 32 H 8.52 5.24 0.00 3.43 3.33 0.00 5.40 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 R 8.67 4.63 0.00 1.86 1.84 0.00 3.23 0.00 0.00 3.16 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.64 0.00 34 K 8.21 3.82 0.00 1.95 0.88 0.00 1.80 0.00 0.00 1.72 0.00 0.00 2.98 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.37 1.45 7.81 35 D 8.92 4.64 0.00 2.67 2.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 D 7.86 4.51 0.00 2.79 2.56 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.27 5.36 0.00 1.54 1.54 0.90 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 38 D 9.01 4.88 0.00 2.83 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 39 I 8.44 5.49 1.79 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 0.49 0.88 0.00 0.00 40 F 7.67 5.16 0.00 3.19 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 41 P 0.00 5.02 0.00 2.15 2.07 0.00 3.89 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.02 0.00 42 V 9.19 4.83 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 0.87 0.00 0.00 0.86 0.00 0.00 43 N 9.08 5.43 0.00 2.78 2.83 0.00 0.00 6.71 7.45 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 44 F 8.99 5.45 0.00 3.06 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 45 V 8.83 4.28 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 0.57 0.00 0.00 1.04 0.00 0.00 46 L 8.56 4.78 0.00 1.78 1.56 0.82 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 47 D 9.53 4.98 0.00 2.97 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 48 Y 8.73 4.83 0.00 3.09 2.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 S 8.19 4.32 0.00 3.94 3.94 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 0.00 0.00 0.00 50 A 7.51 4.87 1.27 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 0.00 0.00 0.00 51 E 8.75 4.21 0.00 1.99 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.34 0.00 52 Q 7.64 4.75 0.00 2.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 6.95 0.00 0.00 0.00 0.00 0.00 2.27 2.27 0.00 53 P 0.00 4.61 0.00 2.05 2.20 0.00 3.68 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.06 0.00 54 R 8.85 4.74 0.00 1.63 1.42 0.00 2.98 0.00 0.00 3.09 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.67 0.00 55 V 8.10 4.73 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 0.52 0.00 0.00 0.66 0.00 0.00 56 Y 8.87 5.30 0.00 2.93 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 57 F 8.71 5.45 0.00 3.39 3.23 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 58 R 8.78 5.08 0.00 0.82 0.92 0.00 2.21 0.00 0.00 2.25 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.04 0.00 59 T 8.95 4.73 4.48 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 1.65 0.00 0.00 60 A 9.68 4.41 1.14 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 0.00 0.00 *63 T 8.93 4.25 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 1.13 0.00 0.00 64 K 8.18 3.73 0.00 1.84 1.87 0.00 1.73 0.00 0.00 1.69 0.00 0.00 2.93 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.35 1.42 7.81 65 L 7.58 3.70 0.00 1.31 0.32 0.64 0.23 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 66 F 8.10 4.86 0.00 3.40 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 67 S 7.67 4.75 0.00 3.77 3.68 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 68 V 8.16 3.63 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 0.79 0.00 0.00 0.91 0.00 0.00 69 N 7.83 4.54 0.00 2.77 2.90 0.00 0.00 6.09 7.79 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 70 L 7.23 4.09 0.00 1.43 1.62 1.06 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 71 N 8.40 4.37 0.00 2.58 2.52 0.00 0.00 7.19 7.81 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 72 S 8.61 4.45 0.00 3.87 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 73 D 8.45 5.01 0.00 2.75 2.80 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 74 V 8.98 4.86 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.85 0.00 0.00 0.92 0.00 0.00 75 L 8.52 5.30 0.00 1.52 1.48 0.88 1.01 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 76 F 9.11 5.04 0.00 2.90 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 77 E 8.05 5.00 0.00 1.80 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 2.30 2.25 0.00 78 V 8.59 4.71 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 1.20 0.00 0.00 0.79 0.00 0.00 79 D 8.02 4.40 0.00 2.55 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 80 R 7.71 4.22 0.00 0.94 1.68 0.00 3.21 0.00 0.00 2.98 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 1.78 0.00 81 F 8.57 5.00 0.00 2.69 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 82 D 7.28 4.56 0.00 2.57 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *85 E 8.23 4.05 0.00 2.24 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 0.00 2.20 2.28 0.00 86 G 8.05 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 87 W 8.69 6.30 0.00 3.57 3.20 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 88 S 9.77 5.19 0.00 3.95 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 89 V 9.30 4.98 2.35 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 1.02 0.00 0.00 1.20 0.00 0.00 90 V 9.00 4.81 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 0.90 0.00 0.00 0.94 0.00 0.00 91 L 9.39 5.16 0.00 1.63 1.57 0.92 -0.23 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 92 K 8.56 4.79 0.00 1.73 1.72 0.00 1.87 0.00 0.00 1.66 0.00 0.00 2.84 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.39 1.39 7.81 93 G 8.18 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 0.00 0.00 0.00 94 N 8.47 5.49 0.00 2.67 2.33 0.00 0.00 7.20 7.69 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 95 A 8.81 4.86 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 96 Y 8.68 5.04 0.00 2.89 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 97 V 8.86 4.09 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 0.92 0.00 0.00 1.12 0.00 0.00 98 V 8.56 3.67 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 0.88 0.00 0.00 1.24 0.00 0.00 99 R 8.48 4.18 0.00 2.01 2.10 0.00 3.40 0.00 0.00 3.16 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.71 0.00 100 D 7.83 4.39 0.00 2.79 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 0.00 101 T 8.54 3.85 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 1.20 0.00 0.00 102 E 8.19 3.93 0.00 2.06 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 2.35 2.40 0.00 103 E 8.87 3.84 0.00 2.14 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 2.32 2.39 0.00 104 A 8.03 3.73 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 105 R 7.42 3.71 0.00 1.85 2.10 0.00 3.26 0.00 0.00 3.13 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.61 0.00 106 H 7.98 4.09 0.00 3.21 3.41 0.00 5.85 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 107 A 7.77 3.00 -0.37 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 0.00 108 D 7.35 4.54 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 0.00 109 T 7.25 4.37 4.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 110 L 7.39 4.12 0.00 1.58 1.66 0.64 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 111 G 8.02 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 0.00 112 L 7.65 4.12 0.00 1.59 1.49 1.11 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 113 K 8.38 4.06 0.00 1.78 1.83 0.00 1.65 0.00 0.00 1.75 0.00 0.00 3.07 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.48 1.54 7.81 114 P 0.00 4.18 0.00 2.07 2.01 0.00 3.68 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.11 0.00 115 W 8.17 4.94 0.00 3.19 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 0.00 116 L 8.37 4.13 0.00 1.72 1.64 0.91 1.02 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 0.00 117 P 0.00 4.52 0.00 2.08 2.16 0.00 3.69 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.13 0.00 118 T 7.76 4.35 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 0.00 119 L 7.92 4.12 0.00 1.99 1.90 0.67 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 120 K 8.54 4.22 0.00 1.73 1.75 0.00 1.78 0.00 0.00 1.76 0.00 0.00 3.02 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.43 1.35 7.81 121 Y 7.53 5.19 0.00 3.10 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 0.00 122 N 9.00 5.11 0.00 2.75 2.77 0.00 0.00 7.46 8.19 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 0.00 123 F 8.72 4.83 0.00 3.05 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 0.00 124 V 8.69 4.62 0.67 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 0.44 0.00 0.00 0.80 0.00 0.00 125 R 9.01 4.55 0.00 1.80 1.74 0.00 3.27 0.00 0.00 3.11 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.83 0.00 126 I 8.53 4.61 1.65 0.00 0.00 0.56 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 0.43 0.79 0.00 0.00 127 D 8.89 4.75 0.00 2.68 2.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 128 V 7.97 4.24 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.73 0.00 0.00 0.91 0.00 0.00 129 R 9.10 4.42 0.00 1.89 2.00 0.00 3.32 0.00 0.00 3.24 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.62 0.00 130 E 7.89 4.85 0.00 1.92 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 2.31 2.32 0.00 131 V 8.37 4.87 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 0.86 0.00 0.00 0.96 0.00 0.00 132 S 9.56 4.68 0.00 3.75 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 0.00 133 G 8.65 5.08 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 0.00 0.00 0.00 0.00 0.00 0.00 134 R 9.25 5.12 0.00 1.40 0.98 0.00 2.98 0.00 0.00 3.16 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.54 0.00 135 A 8.74 5.19 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 0.00 136 F 9.42 5.36 0.00 2.93 3.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 137 V 8.68 4.07 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 0.74 0.00 0.00 0.95 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.