NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 19 V 3.9451 8.0431 120.3916 63.6746 32.3948 174.8456 20 G 3.6392 8.7229 117.0163 46.1883 0.0000 172.0401 21 G 3.9096 8.7158 111.0737 44.3319 0.0000 172.0932 22 T 3.9669 8.3479 115.4204 64.3521 69.0664 174.3913 23 R 4.3620 8.1718 124.7803 55.3006 32.1090 175.9619 24 S 4.5687 8.5725 118.2703 57.9184 63.3515 174.9552 25 A 3.7297 8.7960 129.5099 54.3242 18.0826 178.8427 26 F 4.9948 7.8072 112.0379 56.8736 39.5341 175.6439 27 S 4.8264 7.1566 115.4174 55.9984 65.9359 173.8546 28 N 4.1688 8.4277 119.3117 53.9959 39.1482 174.3726 29 I 4.1835 8.2678 124.4231 59.3593 39.3358 175.1547 30 Q 4.6037 8.5981 126.7841 55.6921 29.1315 177.6324 31 A 4.5067 9.2334 127.9256 55.0910 18.6712 178.3978 32 E 4.4523 8.3563 112.0648 58.2788 29.9977 176.4146 33 D 4.7970 8.1219 120.0929 54.6580 41.4465 176.3309 34 Y 4.0292 7.5367 116.3085 56.9420 38.9732 174.7272 35 D 4.8118 8.7805 121.6204 55.9984 42.2233 176.3284 36 S 4.8719 7.7619 111.5223 57.7785 66.5005 173.1053 37 S 4.8219 8.1800 112.7277 57.7687 65.3953 173.7003 38 Y 4.2690 8.4327 122.6351 56.1628 41.0737 174.5048 39 G 2.9140 7.1216 113.8239 44.7485 0.0000 171.1052 40 P 4.1470 0.0000 0.0000 64.8031 31.6839 177.2578 41 N 4.8350 7.9208 112.5736 52.5265 39.3516 174.6180 42 L 4.5544 7.6351 121.9407 55.4899 42.7721 176.2313 43 Q 4.8474 9.3719 123.9707 54.2624 33.1697 174.1338 44 I 4.9546 8.4880 122.7650 60.2547 38.6924 175.0840 45 F 5.0924 8.1988 120.3187 55.3039 41.6806 173.9482 46 S 4.7784 8.9094 116.0638 58.6085 63.8243 173.7624 47 L 4.8206 8.6651 123.2516 52.4407 43.3915 176.1707 48 P 4.2695 0.0000 0.0000 65.6993 31.3543 177.7137 49 G 3.7823 7.9022 103.8668 45.2721 0.0000 173.4708 50 G 3.9404 8.1766 107.0174 45.5233 0.0000 176.0749 51 G 3.8805 8.8084 108.0133 44.9076 0.0000 172.4222 52 S 5.1317 8.2378 113.0435 57.0881 67.5494 172.9701 53 A 4.8924 8.3150 122.1559 50.2788 23.1360 174.9336 54 I 4.7508 8.3316 112.6579 60.3153 40.1532 175.8268 55 G 4.3812 9.1837 109.4130 48.1063 0.0000 172.2445 56 Y 3.6678 7.7801 114.0358 58.9522 35.3487 170.6449 57 I 4.1000 7.2454 118.2885 60.5028 38.8209 175.1314 58 E 4.3334 6.4009 121.0810 53.6079 33.3896 174.6131 59 N 4.5265 8.5052 118.2376 55.8786 38.9877 175.1198 60 G 4.1175 9.1636 114.2771 45.3734 0.0000 173.1680 61 Y 5.1123 8.2258 117.9309 58.5891 39.4022 174.9651 62 S 5.3865 9.3266 115.2664 57.6170 67.0637 173.0291 63 T 4.9735 8.9625 110.5988 60.2502 72.2343 172.6726 64 T 5.0822 8.6485 120.3648 62.0284 72.0696 172.7203 65 Y 5.1206 9.3640 123.3783 56.1304 40.7913 175.2897 66 K 4.5615 9.6248 124.9377 56.2035 32.9085 177.0609 67 N 4.1645 8.8252 118.5167 54.4201 36.4142 174.5340 68 I 4.4081 8.2394 119.5958 60.0805 38.8720 175.4752 69 D 5.0160 8.9242 126.2219 53.1644 40.6636 176.3728 70 F 4.2499 9.5703 126.1183 56.8056 40.4657 177.5171 71 G 3.7796 8.4018 112.1016 47.3150 0.0000 174.6881 72 D 4.7481 9.7813 124.3642 52.0502 39.5193 174.7559 73 G 4.0491 7.3352 103.7943 44.8017 0.0000 173.4402 74 A 5.1619 9.0848 125.0095 50.0817 22.8239 176.3348 75 T 4.8022 8.9523 108.3377 60.0774 70.9703 173.1029 76 S 5.3188 8.1889 116.0536 57.1207 66.5235 172.7369 77 V 4.8941 8.9762 123.6194 60.1876 34.8410 174.4103 78 T 5.1630 8.9874 119.0780 61.7967 72.1718 172.7413 79 A 5.0303 9.0541 127.3388 50.0416 22.7604 174.9328 80 R 4.3960 8.0094 122.3769 55.0240 31.0503 175.6485 81 V 5.2269 8.7458 119.0009 59.7664 36.8672 174.4746 82 A 4.6831 8.4550 122.7648 50.7775 22.4645 175.1593 83 T 3.7769 8.2569 114.2969 61.6585 71.2669 173.7745 84 Q 4.2536 7.4790 122.0144 55.7636 29.8475 175.5622 85 N 5.0496 7.5082 114.2858 51.0351 42.9163 174.3780 86 A 4.3063 8.5905 124.3618 53.3914 19.2343 176.4105 87 T 4.6880 8.9553 115.6811 61.4958 72.0165 171.9240 88 T 5.0183 8.3547 111.3397 59.7842 72.7906 172.9577 89 I 4.6813 8.3620 123.6765 59.5893 40.2262 174.8830 90 Q 4.4742 8.7577 127.3514 55.4625 30.3368 175.3739 91 V 4.5966 8.7008 123.9792 61.4774 33.3081 174.7060 92 R 5.1507 9.0896 126.9236 54.1813 34.7317 174.3304 93 L 4.4863 8.8155 124.3281 55.6585 42.8460 176.3806 94 G 4.2501 10.5128 120.2267 45.3045 0.0000 173.2388 95 S 4.6933 7.2932 112.3788 55.5158 65.9716 173.0105 96 P 4.2248 0.0000 0.0000 64.8200 31.0849 177.6034 97 S 4.5814 7.6535 111.0769 57.7399 63.1624 174.3303 98 G 4.2845 7.6831 109.1998 45.2548 0.0000 173.6284 99 T 3.9820 8.4614 115.6403 64.1321 69.4743 173.5987 100 L 4.3705 8.4572 128.3929 54.7334 42.0356 176.1982 101 L 4.1895 9.2670 128.6109 56.9782 43.1011 177.1427 102 G 4.3603 7.2253 104.0004 46.4143 0.0000 172.1949 103 T 4.9689 8.4245 115.6146 61.6561 71.8352 173.9662 104 I 4.1781 8.6420 128.2236 60.5483 38.7501 174.4758 105 Y 4.4316 8.6769 125.4696 56.9634 38.9318 175.4558 106 V 4.1512 8.8240 126.4019 60.9216 32.9812 175.4556 107 G 4.1578 8.4849 115.3355 45.1825 0.0000 171.3096 108 S 4.3732 8.4980 115.1674 58.4393 62.7635 173.8356 109 T 4.2603 8.5251 116.1859 61.1917 68.7915 175.3718 110 G 4.0198 9.8188 112.7095 46.1206 0.0000 174.1444 111 S 4.4078 7.0020 110.7506 57.0486 64.9316 175.4665 112 F 4.2382 8.7180 124.8817 59.6390 38.7188 175.5988 113 D 4.8845 8.2011 119.2684 54.2007 41.3056 175.9160 114 T 4.5581 7.5196 117.1562 62.1857 69.7250 173.4016 115 Y 4.7469 8.6909 124.4738 56.5857 39.7609 175.5672 116 R 4.7663 8.9500 121.4963 54.6751 35.3667 173.5876 117 D 5.1089 8.5939 120.7330 53.4688 42.1740 176.5061 118 V 4.5998 8.7408 116.1089 59.6787 35.5647 174.8891 119 S 5.4271 8.6543 118.3139 57.1305 66.7951 172.8651 120 A 4.7779 8.7355 121.3606 51.0269 22.8197 175.9908 121 T 4.6851 8.5886 116.8001 63.5164 69.1310 174.2087 122 I 4.9226 8.5241 118.1329 58.7184 41.1971 175.0520 123 S 4.2180 8.7276 119.9507 58.6910 63.2665 173.9617 124 N 4.5216 8.8986 121.5396 54.8949 39.8446 173.3850 125 T 4.7374 8.7540 122.3975 61.6186 71.5896 173.1056 126 A 4.9051 8.0707 126.4370 51.3798 23.1038 176.7411 127 G 3.7378 9.1096 108.5198 44.6492 0.0000 172.0529 128 V 4.7178 8.1756 118.8123 61.9416 32.1661 176.1612 129 K 4.8064 9.3020 126.8962 54.7240 36.8522 175.0071 130 D 5.2618 8.6678 122.5167 53.7103 42.6970 175.3746 131 I 5.0675 9.0777 124.1003 59.4892 40.7347 174.6295 132 V 4.9879 8.9650 126.0930 61.1466 34.6349 173.9570 133 L 4.8197 8.9299 127.9645 53.1598 43.6517 175.4588 134 V 4.5557 8.1763 124.0260 61.0032 34.0666 174.1294 135 F 5.0998 9.0814 127.4898 56.4449 40.4466 176.6336 136 S 4.5087 8.5216 116.5555 58.5827 64.0789 173.5399 137 G 3.9846 7.6330 105.8651 45.1890 0.0000 171.1014 138 P 4.6150 0.0000 0.0000 62.4311 31.5693 176.8245 139 V 4.6420 8.0432 120.9562 61.0302 33.5949 171.9534 140 N 5.3015 9.2552 120.7917 51.6927 41.4755 173.9014 141 V 4.7198 8.6194 122.5087 61.6579 34.1983 175.1421 142 D 4.4602 9.4495 129.0667 56.0778 41.9818 175.7673 143 W 5.8891 7.3629 113.1049 55.9067 31.8045 172.1603 144 F 5.7924 9.1255 114.5693 56.0984 41.1887 173.5404 145 V 4.4395 8.7189 117.8313 60.8247 34.8351 172.6555 146 F 5.5155 8.8843 120.6708 56.1947 42.6971 174.3602 147 S 4.9833 8.9551 113.7673 57.4341 66.8872 173.1677 148 K 4.7920 8.7918 120.4818 55.4810 32.7564 177.1981 149 S 4.0382 8.8806 122.6644 58.7464 63.3655 175.0291 *150 G 3.7020 8.6298 112.7876 45.8267 0.0000 172.2560 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 19 V 8.04 3.95 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 0.96 0.00 0.00 0.92 0.00 0.00 20 G 8.72 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 0.00 0.00 0.00 21 G 8.72 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 22 T 8.35 3.97 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 1.26 0.00 0.00 23 R 8.17 4.36 0.00 1.71 1.79 0.00 3.13 0.00 0.00 3.12 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.57 0.00 24 S 8.57 4.57 0.00 3.93 3.71 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 25 A 8.80 3.73 -0.13 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 0.00 0.00 0.00 26 F 7.81 4.99 0.00 3.04 3.07 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 27 S 7.16 4.83 0.00 3.73 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 28 N 8.43 4.17 0.00 2.12 2.19 0.00 0.00 6.85 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 29 I 8.27 4.18 0.57 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 0.96 0.74 0.57 0.00 0.00 30 Q 8.60 4.60 0.00 2.21 2.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.90 0.00 0.00 0.00 0.00 0.00 2.43 2.33 0.00 31 A 9.23 4.51 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 32 E 8.36 4.45 0.00 2.12 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 0.00 2.30 2.27 0.00 33 D 8.12 4.80 0.00 3.06 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 34 Y 7.54 4.03 0.00 2.74 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 35 D 8.78 4.81 0.00 2.55 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 36 S 7.76 4.87 0.00 3.88 3.95 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 37 S 8.18 4.82 0.00 3.62 3.27 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 38 Y 8.43 4.27 0.00 3.10 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 G 7.12 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 0.00 0.00 0.00 40 P 0.00 4.15 0.00 1.98 2.03 0.00 2.96 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 1.73 0.00 41 N 7.92 4.83 0.00 2.92 2.91 0.00 0.00 6.96 7.56 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 42 L 7.64 4.55 0.00 1.69 1.59 0.81 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 43 Q 9.37 4.85 0.00 2.30 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.62 0.00 0.00 0.00 0.00 0.00 2.22 2.43 0.00 44 I 8.49 4.95 1.92 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 1.52 0.70 0.89 0.00 0.00 45 F 8.20 5.09 0.00 3.20 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 46 S 8.91 4.78 0.00 3.87 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 L 8.67 4.82 0.00 1.83 1.51 0.53 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 48 P 0.00 4.27 0.00 2.09 2.17 0.00 3.76 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.17 0.00 49 G 7.90 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 0.00 0.00 0.00 50 G 8.18 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 0.00 0.00 0.00 51 G 8.81 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 S 8.24 5.13 0.00 3.81 3.70 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 53 A 8.32 4.89 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 54 I 8.33 4.75 1.92 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 1.43 0.85 1.15 0.00 0.00 55 G 9.18 4.38 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 Y 7.78 3.67 0.00 3.27 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 57 I 7.25 4.10 1.72 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 1.03 0.56 0.00 0.00 58 E 6.40 4.33 0.00 1.16 1.49 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 1.67 1.95 0.00 59 N 8.51 4.53 0.00 2.78 2.76 0.00 0.00 7.16 7.98 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 60 G 9.16 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 Y 8.23 5.11 0.00 3.17 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 S 9.33 5.39 0.00 3.93 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 63 T 8.96 4.97 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 0.80 0.00 0.00 64 T 8.65 5.08 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 1.26 0.00 0.00 65 Y 9.36 5.12 0.00 3.17 3.10 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 66 K 9.62 4.56 0.00 1.75 1.79 0.00 1.88 0.00 0.00 1.74 0.00 0.00 3.08 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.53 1.46 7.81 67 N 8.83 4.16 0.00 2.95 2.88 0.00 0.00 7.04 6.92 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 68 I 8.24 4.41 2.11 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.22 0.48 0.00 0.00 69 D 8.92 5.02 0.00 2.64 2.57 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 70 F 9.57 4.25 0.00 3.16 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 71 G 8.40 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 0.00 0.00 0.00 72 D 9.78 4.75 0.00 2.83 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 73 G 7.34 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 74 A 9.08 5.16 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 75 T 8.95 4.80 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 1.27 0.00 0.00 76 S 8.19 5.32 0.00 3.96 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 77 V 8.98 4.89 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 0.76 0.00 0.00 0.55 0.00 0.00 78 T 8.99 5.16 4.38 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 0.00 0.00 0.00 1.33 0.00 0.00 79 A 9.05 5.03 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 80 R 8.01 4.40 0.00 0.67 0.66 0.00 2.90 0.00 0.00 2.93 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 1.36 0.00 81 V 8.75 5.23 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 0.67 0.00 0.00 0.90 0.00 0.00 82 A 8.45 4.68 0.30 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 83 T 8.26 3.78 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 1.11 0.00 0.00 84 Q 7.48 4.25 0.00 1.63 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.46 0.00 0.00 0.00 0.00 0.00 1.95 1.52 0.00 85 N 7.51 5.05 0.00 2.49 2.62 0.00 0.00 6.88 7.01 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 86 A 8.59 4.31 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 87 T 8.96 4.69 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 1.22 0.00 0.00 88 T 8.35 5.02 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 0.87 0.00 0.00 89 I 8.36 4.68 1.75 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 1.42 0.73 0.56 0.00 0.00 90 Q 8.76 4.47 0.00 1.87 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.77 0.00 0.00 0.00 0.00 0.00 2.27 2.18 0.00 91 V 8.70 4.60 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 1.21 0.00 0.00 0.90 0.00 0.00 92 R 9.09 5.15 0.00 1.69 1.74 0.00 3.21 0.00 0.00 3.21 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.48 0.00 93 L 8.82 4.49 0.00 1.69 1.50 0.88 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 94 G 10.51 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 0.00 0.00 0.00 0.00 95 S 7.29 4.69 0.00 3.95 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 96 P 0.00 4.22 0.00 2.04 2.16 0.00 3.64 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.09 0.00 97 S 7.65 4.58 0.00 3.88 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 G 7.68 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 99 T 8.46 3.98 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 1.18 0.00 0.00 100 L 8.46 4.37 0.00 1.62 1.58 0.97 1.01 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 0.00 101 L 9.27 4.19 0.00 1.74 1.68 0.79 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 102 G 7.23 4.36 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 0.00 103 T 8.42 4.97 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 0.57 0.00 0.00 104 I 8.64 4.18 1.77 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.68 0.89 0.00 0.00 105 Y 8.68 4.43 0.00 2.85 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 0.00 106 V 8.82 4.15 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 0.98 0.00 0.00 0.91 0.00 0.00 107 G 8.48 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 0.00 0.00 0.00 0.00 108 S 8.50 4.37 0.00 3.80 3.70 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 0.00 109 T 8.53 4.26 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 1.08 0.00 0.00 110 G 9.82 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 0.00 0.00 0.00 111 S 7.00 4.41 0.00 3.76 3.58 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 0.00 112 F 8.72 4.24 0.00 2.99 2.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 D 8.20 4.88 0.00 2.69 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 0.00 114 T 7.52 4.56 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 1.21 0.00 0.00 115 Y 8.69 4.75 0.00 2.80 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 0.00 116 R 8.95 4.77 0.00 1.60 1.72 0.00 3.27 0.00 0.00 3.18 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.70 0.00 117 D 8.59 5.11 0.00 2.58 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 0.00 118 V 8.74 4.60 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 0.74 0.00 0.00 0.91 0.00 0.00 119 S 8.65 5.43 0.00 3.74 3.84 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 0.00 120 A 8.74 4.78 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 0.00 121 T 8.59 4.69 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 1.30 0.00 0.00 122 I 8.52 4.92 1.94 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.06 1.07 0.00 0.00 123 S 8.73 4.22 0.00 3.74 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 0.00 124 N 8.90 4.52 0.00 2.86 2.72 0.00 0.00 6.88 7.22 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 0.00 125 T 8.75 4.74 3.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.07 0.00 0.00 126 A 8.07 4.91 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 0.00 127 G 9.11 3.74 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 0.00 128 V 8.18 4.72 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 0.87 0.00 0.00 0.98 0.00 0.00 129 K 9.30 4.81 0.00 1.69 1.58 0.00 1.66 0.00 0.00 1.62 0.00 0.00 2.73 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.46 1.24 7.81 130 D 8.67 5.26 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 0.00 131 I 9.08 5.07 2.24 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 1.30 1.23 0.00 0.00 132 V 8.96 4.99 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 1.06 0.00 0.00 0.96 0.00 0.00 133 L 8.93 4.82 0.00 1.42 0.91 0.38 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 134 V 8.18 4.56 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 1.03 0.00 0.00 0.86 0.00 0.00 135 F 9.08 5.10 0.00 3.08 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 0.00 136 S 8.52 4.51 0.00 3.91 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 0.00 137 G 7.63 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 0.00 138 P 0.00 4.62 0.00 2.13 1.96 0.00 3.78 0.00 0.00 2.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 1.97 0.00 139 V 8.04 4.64 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 0.61 0.00 0.00 1.00 0.00 0.00 140 N 9.26 5.30 0.00 2.69 3.09 0.00 0.00 6.44 7.43 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 0.00 141 V 8.62 4.72 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 1.05 0.00 0.00 1.03 0.00 0.00 142 D 9.45 4.46 0.00 2.31 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 0.00 0.00 0.00 0.00 143 W 7.36 5.89 0.00 3.41 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 0.00 144 F 9.13 5.79 0.00 3.01 3.02 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 0.00 145 V 8.72 4.44 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 0.88 0.00 0.00 0.88 0.00 0.00 146 F 8.88 5.52 0.00 2.64 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 0.00 147 S 8.96 4.98 0.00 4.01 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 0.00 148 K 8.79 4.79 0.00 1.76 1.88 0.00 1.79 0.00 0.00 1.76 0.00 0.00 2.66 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.73 1.65 7.81 149 S 8.88 4.04 0.00 3.80 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *150 G 8.63 3.70 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 * Residues marked with a * may have inaccurate shift predictions.