NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 10 F 4.8001 8.1676 115.8683 57.1645 40.2013 176.7694 11 H 4.0476 5.2900 117.3969 53.9271 29.2951 170.2284 12 E 4.3190 9.5582 122.7044 57.5194 29.9625 176.8000 13 M 4.5838 7.1047 114.5553 55.0037 32.3376 176.4056 14 R 4.5552 7.7298 116.6870 55.4631 32.3975 175.3866 15 E 4.1025 8.0678 117.4528 54.9123 30.2294 174.6374 16 P 3.8999 0.0000 0.0000 61.6537 32.3746 174.6582 17 R 4.1525 7.1003 112.0334 55.7658 32.9744 173.5824 18 I 4.3803 8.5028 121.4116 60.3251 38.3064 174.9474 19 E 4.4812 8.9488 129.6423 54.4588 31.2486 172.0669 20 K 4.5325 8.7344 132.4236 55.3874 34.1328 174.5398 21 V 4.5353 7.8248 119.5808 61.2583 34.7451 173.9478 22 V 4.5354 8.2865 128.9372 61.6885 33.1164 174.9322 23 V 5.1007 8.3612 122.4676 59.2912 33.5008 174.4988 24 H 5.1423 8.5301 124.8288 54.5954 33.5669 172.0588 25 M 4.0405 8.4169 124.8810 53.3880 33.0341 175.2990 26 G 4.1054 8.0153 112.2385 46.3149 0.0000 171.3003 27 I 4.1791 7.7316 126.6311 60.2722 39.6268 176.0056 28 G 4.0687 7.8647 110.6891 45.3363 0.0000 172.7249 29 H 4.7031 7.9187 118.0250 55.4543 29.8587 173.6339 *35 A 4.1860 7.0250 123.5151 51.9870 19.2628 176.5795 36 N 4.3450 8.8092 112.7556 56.5682 36.2753 176.6133 37 A 3.7893 8.0099 122.2944 54.5674 18.3452 178.9102 38 E 3.8937 8.7442 118.0991 59.9206 29.4477 178.9693 39 D 4.4455 7.5606 118.5945 57.7446 40.9502 179.6194 40 I 3.7604 7.7318 112.6254 63.9942 37.6931 178.0019 41 L 4.1631 7.7040 120.3544 57.4824 41.3354 179.6925 42 G 3.6127 8.3476 105.9218 47.7871 0.0000 175.6419 43 E 4.0398 7.8026 120.1331 59.0065 29.7197 178.8470 44 I 3.9168 8.2797 118.3803 63.2567 38.0277 176.5228 45 T 4.6127 7.8252 108.1131 63.9250 70.1267 174.7900 46 G 3.9601 7.3918 109.5099 44.1413 0.0000 173.2659 47 Q 4.5815 7.7865 114.8685 54.3973 31.4976 174.0420 48 M 3.8073 8.5556 118.7547 55.7658 32.4263 174.7967 49 P 4.8357 0.0000 0.0000 61.7517 33.5014 175.1175 50 V 4.4860 8.3078 119.8422 60.8557 34.5283 175.2881 51 R 4.3882 8.7355 125.5087 57.2077 31.2363 176.8064 52 T 4.5067 8.6544 117.4859 61.4498 70.2888 173.9937 53 K 5.2938 8.7762 124.6430 55.7078 33.2827 175.6201 54 A 4.8868 8.7411 122.7540 50.2393 22.1247 175.7796 55 K 4.4877 8.4370 117.5770 55.5732 34.8921 175.1049 56 R 4.1802 8.4246 122.4357 56.2964 29.6422 175.9559 57 T 4.6554 8.2422 117.1681 62.5374 70.0009 174.5603 58 V 4.5482 9.1487 125.5465 60.7284 35.0669 175.7926 59 G 3.8069 8.9006 112.7294 48.7405 0.0000 174.8783 60 E 4.2385 8.1313 118.3894 58.7851 28.0040 176.1700 61 F 4.1695 7.6108 112.4438 60.1892 38.7936 175.0255 62 D 4.9212 7.8842 119.4049 51.7216 40.2713 175.4662 63 I 3.8086 7.7224 114.9458 61.0344 39.5471 177.4299 64 R 3.8285 7.9531 121.3733 56.3508 29.4247 174.8122 65 E 3.9867 8.1897 128.7044 58.4100 30.3576 176.0689 66 G 3.8935 7.8829 108.1819 46.4153 0.0000 171.8676 67 D 4.5362 8.2369 120.8812 51.7966 42.2570 173.6843 68 P 4.5375 0.0000 0.0000 62.4672 31.6665 176.5689 69 I 4.6632 9.1667 125.2470 59.0527 40.0246 175.1158 70 G 4.4305 7.4467 109.0364 43.7949 0.0000 171.7655 71 A 5.7841 7.9403 121.1929 49.6760 23.4939 174.7610 72 K 5.0095 8.2443 116.5152 56.2110 36.7132 175.4032 73 V 4.6335 8.4758 120.3995 61.8151 34.9814 173.2834 74 T 4.6912 8.5527 118.9473 60.4089 69.8794 173.7758 75 L 4.7161 8.4132 127.1416 52.9684 43.9527 176.1074 76 R 4.7733 8.0359 120.8491 54.5598 34.0011 176.6795 77 D 4.2639 8.9027 120.2816 55.5592 39.2818 176.4112 78 E 3.9829 8.9496 123.6835 61.0133 27.9322 178.3702 79 M 4.0571 8.2481 117.7991 58.5081 31.8547 178.5313 80 A 4.3491 8.0089 120.6829 55.0649 18.7790 179.2446 81 E 3.9693 8.0849 116.7300 59.4201 29.5469 179.0110 82 E 4.0861 8.4758 119.2344 59.0283 29.9653 179.0681 83 F 4.4444 7.5707 120.5078 60.7193 39.9423 177.6687 84 L 4.2514 8.2735 118.3381 57.4592 41.0412 179.0960 85 Q 4.3303 8.1036 115.5912 56.4407 28.2913 175.9996 86 T 4.5516 7.7511 109.5613 62.8317 74.6920 174.6904 87 A 3.9311 7.5696 125.6460 54.3147 19.0576 179.2297 88 L 3.5521 7.9572 113.7243 57.3503 42.1176 178.1587 89 P 3.8627 0.0000 0.0000 65.8642 31.2598 177.2869 90 L 4.2997 8.3618 114.9116 54.9124 41.5168 176.2373 91 A 4.8614 8.5056 122.4138 50.4487 21.8394 175.0008 92 E 4.4334 8.1871 115.9863 58.5076 31.8770 176.5363 93 L 3.6970 6.7256 116.5533 52.2789 43.6902 175.7368 94 A 4.4970 8.5877 122.6115 52.5831 20.9756 174.4467 95 T 3.2060 8.6513 112.1532 62.5008 69.5701 173.9339 96 S 3.7982 8.6748 118.9835 60.5670 63.3850 173.3317 97 Q 4.5807 10.7000 119.3587 55.8363 28.5259 174.5677 98 F 5.0274 7.7349 114.0396 54.9485 41.4787 175.0819 99 D 4.6561 10.1878 122.9038 54.4064 41.6143 176.7361 100 D 4.6594 8.5759 120.9135 55.7469 41.2224 177.4464 101 T 4.5475 7.3369 113.4031 62.3181 68.8573 174.7818 102 G 3.9711 8.0440 109.3780 46.4253 0.0000 173.1412 103 N 5.3014 7.7990 115.9373 51.1764 41.9673 173.2209 104 F 4.7752 7.4690 109.1841 56.2125 41.1663 173.0098 105 S 5.0644 8.2244 117.7855 56.4665 64.9616 172.8564 106 F 4.9363 8.8062 120.7204 55.5250 41.5725 172.5502 107 G 4.2815 8.9429 102.2236 44.3478 0.0000 173.1834 *128 L 4.0157 8.5460 122.8929 55.1663 43.6273 176.4014 129 D 4.8264 8.5015 125.8370 52.7970 43.8830 176.1424 130 V 4.1786 7.9520 121.0617 61.8632 34.5354 173.9697 131 T 4.7088 8.6805 125.4639 61.6662 71.5408 174.1247 132 V 4.2423 7.7512 124.1446 61.0972 34.4268 173.6580 133 N 4.7069 8.6275 127.4238 52.3407 40.2019 173.5440 134 L 5.3211 8.1998 125.9490 53.1992 45.0792 175.8507 135 V 4.2819 7.9312 120.9850 61.2770 35.5098 171.7619 136 R 4.5850 8.3413 116.6909 54.9669 31.4830 177.3702 137 P 4.0774 0.0000 0.0000 65.4360 32.2911 177.8636 138 G 4.1049 7.6773 106.0016 45.9975 0.0000 175.1862 139 Y 4.2532 8.0536 122.0586 59.9309 39.0800 175.6083 140 R 4.0146 8.2684 119.4559 59.4409 29.8899 178.1275 141 V 3.5108 7.4381 116.9209 65.3843 31.1967 176.8474 142 A 5.0032 7.7340 119.3641 51.3035 19.3240 177.3405 143 K 4.2890 7.6195 115.3275 55.6680 33.5754 176.5488 144 R 4.3573 7.5300 115.5159 55.1177 30.9773 176.5259 145 D 4.4375 8.4548 117.5663 57.1556 41.2740 177.6753 146 K 4.0204 7.9410 118.4647 57.5197 32.6922 176.8751 147 A 3.9836 8.7529 123.6203 52.3786 16.2574 176.8076 148 S 4.4737 7.2022 114.0373 60.9336 63.7579 173.1803 149 R 4.4464 8.4392 117.5234 55.5644 33.8055 173.3853 150 S 4.6362 8.6008 118.5101 57.5335 63.5070 173.8089 151 I 3.9262 8.2285 127.4547 60.3127 37.7635 174.3520 152 P 4.3626 0.0000 0.0000 62.8375 32.1560 177.2323 153 T 3.9394 8.7846 112.0828 64.9654 68.6992 176.4589 154 K 3.9642 8.1066 120.2344 59.5060 32.1296 177.1955 155 H 4.5199 7.9765 115.2971 56.6218 29.9090 175.1122 156 R 4.2479 7.5373 117.4659 56.5150 30.9321 175.1674 157 L 4.5453 8.1679 120.5644 53.7708 43.3823 175.6414 158 N 4.8760 8.2324 122.9442 51.6618 41.0531 174.5038 159 P 4.3489 0.0000 0.0000 66.0820 31.4212 178.5619 160 A 3.8800 7.9590 118.7995 55.3292 18.3162 179.0611 161 D 4.4356 8.1906 115.9368 56.6571 40.9636 178.9772 162 A 4.1667 7.5789 121.8576 54.8364 19.0581 179.2721 163 V 3.1647 7.5893 116.4951 66.2577 31.3501 177.6852 164 A 3.8999 7.8730 120.0127 55.2873 17.9792 178.9539 165 F 4.1446 7.6193 117.1306 61.7670 39.6946 177.4366 166 I 3.5347 7.8052 118.6913 64.4261 36.8241 177.9088 167 E 4.5679 8.2712 120.3336 58.4678 29.3470 177.4344 168 S 4.5621 7.9211 111.9104 57.8766 64.8421 175.0768 169 T 4.7584 7.8890 112.6012 62.6697 70.7633 173.1904 170 Y 3.4192 7.8699 116.8039 57.7946 35.1406 169.0274 171 D 4.4271 6.9025 117.2025 54.1003 43.7822 175.3726 172 V 4.7249 7.9427 117.0597 61.2335 35.6850 177.9604 173 E 4.3212 8.8741 121.0276 56.5017 28.6445 177.3600 174 V 3.9482 7.7692 116.5061 63.7291 31.7615 175.0943 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 10 F 8.17 4.80 0.00 3.36 3.39 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 11 H 5.29 4.05 0.00 3.11 2.36 0.00 5.60 0.00 0.00 0.00 0.00 6.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 12 E 9.56 4.32 0.00 1.64 1.87 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 2.06 2.17 0.00 13 M 7.10 4.58 0.00 2.21 2.02 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.54 0.00 14 R 7.73 4.56 0.00 1.78 1.97 0.00 3.43 0.00 0.00 3.40 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.72 0.00 15 E 8.07 4.10 0.00 2.16 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 0.00 2.32 2.29 0.00 16 P 0.00 3.90 0.00 1.07 1.58 0.00 3.65 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 2.12 1.99 0.00 17 R 7.10 4.15 0.00 1.86 1.82 0.00 2.73 0.00 0.00 3.12 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.41 0.00 18 I 8.50 4.38 1.98 0.00 0.00 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 1.44 0.93 0.97 0.00 0.00 19 E 8.95 4.48 0.00 1.80 1.68 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 2.17 2.19 0.00 20 K 8.73 4.53 0.00 2.08 1.95 0.00 1.62 0.00 0.00 1.69 0.00 0.00 3.05 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.34 1.30 7.81 21 V 7.82 4.54 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 0.96 0.00 0.00 0.95 0.00 0.00 22 V 8.29 4.54 1.96 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 0.89 0.00 0.00 0.84 0.00 0.00 23 V 8.36 5.10 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 0.03 0.00 0.00 0.71 0.00 0.00 24 H 8.53 5.14 0.00 3.18 2.98 0.00 5.63 0.00 0.00 0.00 0.00 6.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 M 8.42 4.04 0.00 1.93 1.89 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.45 2.40 0.00 26 G 8.02 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 0.00 0.00 0.00 27 I 7.73 4.18 1.77 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.73 0.74 0.00 0.00 28 G 7.86 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 29 H 7.92 4.70 0.00 3.18 3.34 0.00 5.76 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 *35 A 7.03 4.19 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 36 N 8.81 4.35 0.00 2.92 3.14 0.00 0.00 5.87 7.46 0.00 0.00 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 A 8.01 3.79 1.31 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 0.00 0.00 0.00 38 E 8.74 3.89 0.00 1.96 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 2.50 0.00 39 D 7.56 4.45 0.00 2.69 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 40 I 7.73 3.76 1.88 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 1.82 1.06 0.91 0.00 0.00 41 L 7.70 4.16 0.00 1.93 1.73 0.93 0.79 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 42 G 8.35 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 43 E 7.80 4.04 0.00 1.92 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 2.35 2.50 0.00 44 I 8.28 3.92 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 2.02 0.84 1.10 0.00 0.00 45 T 7.83 4.61 4.13 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 0.00 0.00 0.99 0.00 0.00 46 G 7.39 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 0.00 0.00 0.00 47 Q 7.79 4.58 0.00 2.15 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.51 6.62 0.00 0.00 0.00 0.00 0.00 2.22 2.28 0.00 48 M 8.56 3.81 0.00 2.01 2.07 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.60 0.00 49 P 0.00 4.84 0.00 1.91 1.96 0.00 3.60 0.00 0.00 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 2.05 0.00 50 V 8.31 4.49 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 1.05 0.00 0.00 0.91 0.00 0.00 51 R 8.74 4.39 0.00 1.72 1.84 0.00 3.35 0.00 0.00 3.21 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.61 0.00 52 T 8.65 4.51 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 1.21 0.00 0.00 53 K 8.78 5.29 0.00 1.63 1.74 0.00 1.73 0.00 0.00 2.36 0.00 0.00 2.81 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.43 1.28 7.81 54 A 8.74 4.89 1.23 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 55 K 8.44 4.49 0.00 1.72 1.70 0.00 1.83 0.00 0.00 1.70 0.00 0.00 2.92 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.33 1.41 7.81 56 R 8.42 4.18 0.00 1.99 2.00 0.00 3.20 0.00 0.00 3.23 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.64 0.00 57 T 8.24 4.66 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 1.24 0.00 0.00 58 V 9.15 4.55 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 0.98 0.00 0.00 0.94 0.00 0.00 59 G 8.90 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 60 E 8.13 4.24 0.00 2.14 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 0.00 2.31 2.34 0.00 61 F 7.61 4.17 0.00 3.04 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 62 D 7.88 4.92 0.00 2.96 2.54 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 0.00 0.00 0.00 0.00 63 I 7.72 3.81 1.93 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.86 1.06 0.00 0.00 64 R 7.95 3.83 0.00 1.77 2.07 0.00 3.20 0.00 0.00 3.11 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.57 0.00 65 E 8.19 3.99 0.00 1.97 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 2.29 2.30 0.00 66 G 7.88 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 0.00 0.00 0.00 67 D 8.24 4.54 0.00 2.64 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 68 P 0.00 4.54 0.00 1.94 2.02 0.00 3.62 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 2.01 2.10 0.00 69 I 9.17 4.66 1.96 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 1.13 0.92 0.00 0.00 70 G 7.45 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 71 A 7.94 5.78 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 72 K 8.24 5.01 0.00 1.76 1.88 0.00 1.43 0.00 0.00 1.69 0.00 0.00 2.76 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.36 1.39 7.81 73 V 8.48 4.63 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 0.91 0.00 0.00 0.86 0.00 0.00 74 T 8.55 4.69 4.19 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 1.15 0.00 0.00 75 L 8.41 4.72 0.00 1.48 1.52 0.45 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 76 R 8.04 4.77 0.00 1.62 1.77 0.00 3.33 0.00 0.00 3.22 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.59 0.00 77 D 8.90 4.26 0.00 2.88 2.29 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 78 E 8.95 3.98 0.00 2.02 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 2.42 2.42 0.00 79 M 8.25 4.06 0.00 2.01 2.31 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.69 2.58 0.00 80 A 8.01 4.35 1.40 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 81 E 8.08 3.97 0.00 2.16 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 2.44 2.62 0.00 82 E 8.48 4.09 0.00 2.02 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 2.36 2.54 0.00 83 F 7.57 4.44 0.00 3.38 3.24 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 84 L 8.27 4.25 0.00 2.01 1.81 1.09 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 85 Q 8.10 4.33 0.00 1.91 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.23 6.71 0.00 0.00 0.00 0.00 0.00 2.19 2.43 0.00 86 T 7.75 4.55 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 1.14 0.00 0.00 87 A 7.57 3.93 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 88 L 7.96 3.55 0.00 1.74 1.68 0.96 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 0.00 0.00 0.00 0.00 0.00 0.00 89 P 0.00 3.86 0.00 2.14 2.13 0.00 3.68 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.13 0.00 90 L 8.36 4.30 0.00 1.78 1.74 0.90 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 91 A 8.51 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 92 E 8.19 4.43 0.00 1.93 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 2.19 2.29 0.00 93 L 6.73 3.70 0.00 1.71 1.86 1.02 0.77 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 94 A 8.59 4.50 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 95 T 8.65 3.21 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 1.12 0.00 0.00 96 S 8.67 3.80 0.00 4.23 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 0.00 97 Q 10.70 4.58 0.00 2.22 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.12 6.76 0.00 0.00 0.00 0.00 0.00 2.39 2.40 0.00 98 F 7.73 5.03 0.00 3.05 3.05 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 99 D 10.19 4.66 0.00 2.95 2.82 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 0.00 100 D 8.58 4.66 0.00 2.73 2.74 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 0.00 101 T 7.34 4.55 4.34 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 1.25 0.00 0.00 102 G 8.04 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 0.00 103 N 7.80 5.30 0.00 2.97 2.77 0.00 0.00 6.58 8.13 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 0.00 104 F 7.47 4.78 0.00 2.48 1.54 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 0.00 0.00 0.00 0.00 105 S 8.22 5.06 0.00 3.77 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 0.00 106 F 8.81 4.94 0.00 3.17 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 0.00 107 G 8.94 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 0.00 0.00 0.00 0.00 *128 L 8.55 4.02 0.00 1.75 1.60 0.94 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 129 D 8.50 4.83 0.00 2.74 2.44 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 0.00 130 V 7.95 4.18 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 0.00 0.00 0.93 0.00 0.00 0.95 0.00 0.00 131 T 8.68 4.71 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 1.04 0.00 0.00 132 V 7.75 4.24 1.23 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 1.06 0.00 0.00 0.77 0.00 0.00 133 N 8.63 4.71 0.00 2.80 2.90 0.00 0.00 6.57 5.94 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 0.00 134 L 8.20 5.32 0.00 1.75 1.52 1.36 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 135 V 7.93 4.28 1.59 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 0.23 0.00 0.00 0.76 0.00 0.00 136 R 8.34 4.58 0.00 1.80 1.96 0.00 3.02 0.00 0.00 2.95 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.45 0.00 137 P 0.00 4.08 0.00 2.26 2.12 0.00 3.62 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 1.90 2.11 0.00 138 G 7.68 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 0.00 139 Y 8.05 4.25 0.00 3.17 2.99 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 0.00 0.00 0.00 140 R 8.27 4.01 0.00 1.94 1.95 0.00 3.25 0.00 0.00 3.27 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.70 0.00 141 V 7.44 3.51 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 0.91 0.00 0.00 0.95 0.00 0.00 142 A 7.73 5.00 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 143 K 7.62 4.29 0.00 1.65 1.78 0.00 1.71 0.00 0.00 1.64 0.00 0.00 2.98 0.00 0.00 3.25 0.00 0.00 0.00 0.00 0.89 1.52 7.81 144 R 7.53 4.36 0.00 1.89 1.92 0.00 3.07 0.00 0.00 3.20 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.60 0.00 145 D 8.45 4.44 0.00 2.68 2.74 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 0.00 146 K 7.94 4.02 0.00 1.80 1.71 0.00 1.78 0.00 0.00 1.81 0.00 0.00 2.87 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.51 1.42 7.81 147 A 8.75 3.98 1.28 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 0.00 148 S 7.20 4.47 0.00 3.77 4.09 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 0.00 149 R 8.44 4.45 0.00 1.83 1.71 0.00 3.07 0.00 0.00 3.08 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.48 0.00 150 S 8.60 4.64 0.00 3.90 3.72 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 0.00 151 I 8.23 3.93 1.97 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 1.37 1.10 1.04 0.00 0.00 152 P 0.00 4.36 0.00 2.21 2.00 0.00 3.66 0.00 0.00 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.10 0.00 153 T 8.78 3.94 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 1.23 0.00 0.00 154 K 8.11 3.96 0.00 1.79 1.95 0.00 1.65 0.00 0.00 1.66 0.00 0.00 3.06 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.47 1.51 7.81 155 H 7.98 4.52 0.00 3.12 3.36 0.00 5.95 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 156 R 7.54 4.25 0.00 2.10 1.90 0.00 3.42 0.00 0.00 3.24 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.75 0.00 157 L 8.17 4.55 0.00 1.67 1.74 0.90 0.56 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 0.00 158 N 8.23 4.88 0.00 3.19 2.73 0.00 0.00 6.59 7.91 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 0.00 159 P 0.00 4.35 0.00 2.16 2.19 0.00 3.63 0.00 0.00 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.48 0.00 160 A 7.96 3.88 1.28 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 0.00 161 D 8.19 4.44 0.00 2.71 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 0.00 162 A 7.58 4.17 1.59 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 0.00 0.00 163 V 7.59 3.16 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 0.59 0.00 0.00 0.22 0.00 0.00 164 A 7.87 3.90 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 0.00 165 F 7.62 4.14 0.00 3.13 3.36 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 0.00 166 I 7.81 3.53 1.85 0.00 0.00 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.87 0.89 0.00 0.00 167 E 8.27 4.57 0.00 1.85 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 2.27 2.18 0.00 168 S 7.92 4.56 0.00 3.87 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 0.00 169 T 7.89 4.76 4.19 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 1.16 0.00 0.00 170 Y 7.87 3.42 0.00 3.03 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 0.00 171 D 6.90 4.43 0.00 2.89 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 0.00 172 V 7.94 4.72 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 0.82 0.00 0.00 0.89 0.00 0.00 173 E 8.87 4.32 0.00 1.97 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 2.41 2.20 0.00 174 V 7.77 3.95 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 0.98 0.00 0.00 0.89 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.