NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.3325 8.2493 123.5834 51.1759 20.4378 177.2144 2 P 4.6332 0.0000 0.0000 61.1374 32.9574 175.3817 3 A 4.7825 9.1182 122.9994 50.6626 23.5885 176.1932 4 F 5.4611 8.7208 122.7550 56.9517 42.3300 173.7135 5 S 4.5291 8.5833 121.0778 56.9169 67.9700 173.4809 6 V 4.5909 7.6479 113.1766 59.8357 35.0676 175.2917 7 S 4.0552 9.1441 121.9477 60.5986 62.6302 171.9493 8 P 4.6926 0.0000 0.0000 63.5574 27.4509 173.1837 9 A 4.3336 7.5108 121.5493 52.8649 20.5591 177.3701 10 S 4.6798 7.5992 108.9395 56.7978 65.8804 173.2758 11 G 3.8676 8.4190 106.3949 46.4907 0.0000 173.5319 12 A 4.5889 7.5288 120.1521 50.9038 21.5075 177.2207 13 S 4.8070 8.8121 122.7642 58.4841 60.8035 174.7511 14 D 4.8999 8.4577 129.0136 55.8649 43.3709 174.5110 15 G 4.0292 7.9427 108.5001 46.0223 0.0000 172.9528 16 Q 4.2938 7.8893 121.2070 55.4684 30.4873 174.6549 17 S 5.2013 8.5931 121.7362 57.4933 64.3813 173.8151 18 V 4.4484 9.6639 124.3305 59.8867 34.8137 174.5919 19 S 4.9147 8.0921 117.4365 57.3769 63.6448 173.1956 20 V 4.5390 7.7790 120.7209 60.0685 33.6645 175.5030 21 S 5.0574 8.6597 118.9134 57.0008 67.4248 173.4286 22 V 4.9482 8.7689 120.8811 60.6683 34.9875 173.3239 23 A 4.7204 8.7984 123.4729 51.1064 22.6518 174.7564 24 A 3.8603 10.1175 120.4792 51.6191 15.6986 176.3013 25 A 4.4298 7.2176 135.0000 50.3453 25.9935 179.3226 26 G 4.6400 9.2470 106.2924 47.1676 0.0000 172.1604 27 E 4.2372 8.9330 118.3597 54.9344 29.0553 173.8887 28 T 4.6645 7.7292 117.9953 63.0098 70.9670 173.3889 29 Y 4.4779 7.5801 121.9760 56.3500 42.9339 173.4275 30 Y 4.9421 8.4334 115.9993 56.6536 42.0261 174.7886 31 I 5.9729 9.4008 119.9723 57.8632 42.5850 173.2843 32 A 5.1351 8.0392 132.3513 51.4022 20.3293 175.7350 33 Q 5.1889 8.1232 120.4474 55.5732 30.0631 175.6694 34 C 6.1061 9.0341 119.3079 54.2989 40.0523 172.8068 35 A 5.0505 8.5568 120.6855 50.5947 21.6680 173.5529 36 P 4.6142 0.0000 0.0000 63.9089 31.5453 175.9025 37 V 4.2848 9.7166 124.8081 61.2741 34.8269 175.2228 38 G 4.0152 9.5693 107.4799 46.2847 0.0000 175.1484 39 G 3.8814 8.3284 108.7323 44.8425 0.0000 173.0372 40 Q 4.6909 12.0000 118.1164 54.0455 32.9924 174.1390 41 D 5.0760 8.5696 119.0333 52.9185 43.0696 175.9250 42 A 4.8532 8.5376 127.4343 51.1041 19.8108 175.3063 43 C 6.0334 9.2940 119.2783 54.7784 42.3645 174.3057 44 N 4.6856 8.4164 119.6371 51.5744 38.9927 175.1364 45 P 4.7908 0.0000 0.0000 62.3377 31.7177 176.5073 46 A 4.5903 10.6000 128.4160 53.6539 18.5731 181.1423 47 T 3.0690 7.6799 114.3203 65.9028 67.9335 172.1247 48 A 4.9058 12.0000 122.8340 51.3969 18.9862 175.8699 49 T 4.6974 8.4246 121.2560 61.5254 69.3282 172.2079 50 S 5.1914 8.5015 113.4271 57.0023 66.5893 173.2748 51 F 5.0485 7.9013 114.8959 55.9675 41.5280 172.9832 52 T 5.2277 8.4395 109.0370 60.3041 71.4930 173.7710 53 T 4.6098 8.9795 115.1686 61.3177 71.3541 173.5515 54 D 4.9193 8.3953 121.3585 51.3546 41.5666 176.7989 55 A 3.9957 8.4987 121.7211 54.5793 18.3387 177.3707 56 S 4.4627 8.6694 108.2186 59.9182 65.0539 173.4212 57 G 3.7522 9.1482 105.8459 43.4229 0.0000 172.9079 58 A 4.3026 9.1328 119.5877 54.2779 16.9172 178.3004 59 A 3.8298 6.7536 115.9831 47.7160 20.8746 176.2331 60 S 4.7308 8.2846 115.0325 57.1351 66.8532 173.5835 61 F 4.9612 7.7618 117.5743 56.0999 41.6539 172.9091 62 S 5.2638 8.9014 113.6674 57.0028 65.3616 173.9473 63 F 4.9588 9.4362 125.0282 56.8332 42.9780 173.0671 63A T 5.3456 8.3488 116.2121 59.5513 70.1385 174.6967 64 V 4.5251 8.4469 126.1929 60.5056 34.0881 174.9667 65 R 5.1648 8.5619 117.8597 54.5753 33.5572 175.8971 66 K 3.3356 10.7800 125.0401 58.9174 33.3890 176.9348 67 S 5.6772 8.1239 112.4858 56.8893 66.1770 172.9077 68 Y 4.8886 7.7487 118.9855 55.8629 41.6327 172.8781 69 A 4.4287 8.7240 121.9240 51.2181 19.3536 178.0325 70 G 3.7129 11.3000 110.1326 46.3032 0.0000 172.5547 71 Q 5.2227 8.1702 119.9795 55.6717 32.2692 173.5654 72 T 5.3082 8.0775 116.9256 59.8594 69.8136 173.8002 73 P 4.2149 0.0000 0.0000 65.8905 31.4107 177.5070 74 S 4.1169 8.3353 112.8476 62.6836 61.9859 173.9127 75 G 3.4198 7.0887 105.9840 45.2040 0.0000 173.3734 76 T 4.2023 7.8680 117.3386 59.9821 67.7384 172.1310 77 P 4.4661 0.0000 0.0000 63.3814 31.5806 174.7354 78 V 4.2039 8.6940 117.2369 61.3553 32.8975 176.7689 79 G 4.1203 7.4878 106.8879 44.7605 0.0000 170.4470 80 S 4.6672 8.2222 114.7012 58.3585 63.9867 174.0869 81 V 4.1975 8.5298 121.5757 61.2053 34.5157 173.7019 82 D 4.9017 8.8062 128.6252 52.7135 41.5310 176.2585 83 C 4.3498 9.1805 124.2550 58.4486 40.1763 175.1452 84 A 4.0078 7.6192 122.2222 53.7707 18.6478 178.2289 85 T 4.3901 7.5411 107.4946 63.3892 69.6537 174.1468 86 D 4.4565 8.5799 120.1864 53.8850 41.0386 176.8537 87 A 4.3638 8.2757 124.7001 52.0321 17.3766 177.3833 88 C 4.8678 8.7871 118.3761 56.7937 40.9035 172.3491 89 N 4.5876 8.1268 116.7738 52.9312 40.3410 172.4777 90 L 4.9570 8.7796 120.6132 53.9432 45.0892 175.9101 91 G 4.6004 8.4799 113.7258 45.0263 0.0000 171.1531 92 A 5.5878 6.6581 118.5951 51.6226 22.6129 177.4861 93 G 4.6609 7.9159 105.9290 45.9124 0.0000 170.0823 94 N 4.8742 8.3707 120.8499 52.4009 38.4468 175.4216 95 S 4.4195 8.7858 110.4306 59.2640 64.1552 175.8170 96 G 3.8106 8.1637 110.3223 47.4490 0.0000 173.9108 97 L 4.7062 7.4090 119.6936 53.5892 43.5722 176.1404 98 N 4.1796 8.8246 119.8595 55.9022 39.1063 176.5355 99 L 3.8236 7.9817 117.1749 53.4578 40.9139 174.3127 100 G 4.1918 8.0550 107.8497 43.4850 0.0000 171.1350 101 H 5.9057 8.1604 113.3167 53.7283 31.6495 172.8426 102 V 4.4890 8.2372 114.5033 60.5266 34.0874 172.2818 103 A 5.2072 8.9532 129.7293 51.4143 20.2822 177.4476 104 L 4.1528 9.4039 118.3049 56.5624 40.4007 174.0175 105 T 4.4266 8.1762 119.9349 63.6481 68.9633 171.6815 106 F 3.9507 8.2732 124.9740 58.3045 41.5298 175.3008 *107 G 3.7389 8.6991 107.7654 45.9565 0.0000 172.2336 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 1 A 8.25 4.33 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 2 P 0.00 4.63 0.00 2.15 2.29 0.00 3.37 0.00 0.00 4.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.89 0.00 3 A 9.12 4.78 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 4 F 8.72 5.46 0.00 2.75 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 5 S 8.58 4.53 0.00 3.55 3.54 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 6 V 7.65 4.59 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 0.12 0.00 0.00 0.77 0.00 0.00 7 S 9.14 4.06 0.00 3.76 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 8 P 0.00 4.69 0.00 2.20 2.43 0.00 3.71 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.79 0.00 9 A 7.51 4.33 1.26 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 0.00 0.00 10 S 7.60 4.68 0.00 3.90 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 11 G 8.42 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 12 A 7.53 4.59 0.69 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 13 S 8.81 4.81 0.00 3.99 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 14 D 8.46 4.90 0.00 2.76 2.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 15 G 7.94 4.03 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 0.00 0.00 0.00 16 Q 7.89 4.29 0.00 2.19 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.71 6.83 0.00 0.00 0.00 0.00 0.00 2.32 2.32 0.00 17 S 8.59 5.20 0.00 3.79 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 18 V 9.66 4.45 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 0.83 0.00 0.00 0.93 0.00 0.00 19 S 8.09 4.91 0.00 3.94 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 20 V 7.78 4.54 1.18 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 0.69 0.00 0.00 -0.58 0.00 0.00 21 S 8.66 5.06 0.00 3.62 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 V 8.77 4.95 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 0.59 0.00 0.00 0.92 0.00 0.00 23 A 8.80 4.72 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 24 A 10.12 3.86 1.45 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 25 A 7.22 4.43 0.84 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 0.00 0.00 26 G 9.25 4.64 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 27 E 8.93 4.24 0.00 1.65 1.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.13 0.00 28 T 7.73 4.66 3.93 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 0.71 0.00 0.00 29 Y 7.58 4.48 0.00 1.47 2.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 Y 8.43 4.94 0.00 2.89 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 31 I 9.40 5.97 2.16 0.00 0.00 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 0.68 2.03 1.24 0.00 0.00 32 A 8.04 5.14 1.47 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 33 Q 8.12 5.19 0.00 2.31 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.61 0.00 0.00 0.00 0.00 0.00 2.40 2.00 0.00 34 C 9.03 6.11 0.00 2.92 3.08 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 35 A 8.56 5.05 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 0.00 0.00 0.00 0.00 0.00 0.00 36 P 0.00 4.61 0.00 2.09 2.14 0.00 3.88 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.98 0.00 37 V 9.72 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 0.94 0.00 0.00 0.99 0.00 0.00 38 G 9.57 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 39 G 8.33 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 40 Q 12.00 4.69 0.00 2.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.67 6.70 0.00 0.00 0.00 0.00 0.00 2.27 2.44 0.00 41 D 8.57 5.08 0.00 2.68 2.64 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 42 A 8.54 4.85 1.26 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 0.00 0.00 43 C 9.29 6.03 0.00 2.87 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 44 N 8.42 4.69 0.00 2.00 2.53 0.00 0.00 6.63 7.71 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 45 P 0.00 4.79 0.00 2.24 2.18 0.00 3.86 0.00 0.00 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.31 0.00 46 A 10.60 4.59 0.99 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 0.00 0.00 47 T 7.68 3.07 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 1.08 0.00 0.00 48 A 12.00 4.91 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 T 8.42 4.70 4.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 50 S 8.50 5.19 0.00 3.61 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 51 F 7.90 5.05 0.00 2.76 2.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 T 8.44 5.23 4.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 53 T 8.98 4.61 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 1.45 0.00 0.00 54 D 8.40 4.92 0.00 2.95 2.90 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 55 A 8.50 4.00 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 56 S 8.67 4.46 0.00 3.96 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 57 G 9.15 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 9.13 4.30 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 59 A 6.75 3.83 1.47 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 60 S 8.28 4.73 0.00 3.69 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 61 F 7.76 4.96 0.00 3.10 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 S 8.90 5.26 0.00 3.82 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 63 F 9.44 4.96 0.00 3.24 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 63A T 8.35 5.35 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 1.16 0.00 0.00 64 V 8.45 4.53 2.34 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 0.85 0.00 0.00 1.34 0.00 0.00 65 R 8.56 5.16 0.00 1.78 2.01 0.00 3.60 0.00 0.00 3.19 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.57 0.00 66 K 10.78 3.34 0.00 2.05 1.82 0.00 1.68 0.00 0.00 1.72 0.00 0.00 3.25 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.25 1.29 7.81 67 S 8.12 5.68 0.00 3.77 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 68 Y 7.75 4.89 0.00 3.11 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 69 A 8.72 4.43 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 0.00 0.00 0.00 0.00 0.00 70 G 11.30 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 0.00 0.00 0.00 71 Q 8.17 5.22 0.00 2.22 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.92 0.00 0.00 0.00 0.00 0.00 2.20 2.18 0.00 72 T 8.08 5.31 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 1.26 0.00 0.00 73 P 0.00 4.21 0.00 2.17 2.23 0.00 3.81 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.97 0.00 74 S 8.34 4.12 0.00 3.85 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 75 G 7.09 3.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 T 7.87 4.20 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 1.21 0.00 0.00 77 P 0.00 4.47 0.00 2.22 2.06 0.00 3.77 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.97 0.00 78 V 8.69 4.20 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 0.75 0.00 0.00 0.91 0.00 0.00 79 G 7.49 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 80 S 8.22 4.67 0.00 3.78 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 81 V 8.53 4.20 1.73 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 0.82 0.00 0.00 0.70 0.00 0.00 82 D 8.81 4.90 0.00 2.68 2.46 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 0.00 0.00 0.00 0.00 83 C 9.18 4.35 0.00 1.60 2.41 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 0.00 0.00 0.00 84 A 7.62 4.01 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 0.00 0.00 0.00 0.00 0.00 85 T 7.54 4.39 4.22 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 1.23 0.00 0.00 86 D 8.58 4.46 0.00 2.69 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 87 A 8.28 4.36 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 88 C 8.79 4.87 0.00 3.05 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 89 N 8.13 4.59 0.00 2.90 2.91 0.00 0.00 5.38 6.67 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 90 L 8.78 4.96 0.00 1.66 1.52 0.71 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 91 G 8.48 4.60 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 0.00 0.00 0.00 92 A 6.66 5.59 0.84 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 0.00 0.00 93 G 7.92 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 94 N 8.37 4.87 0.00 2.68 2.55 0.00 0.00 6.94 7.72 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 95 S 8.79 4.42 0.00 3.99 4.01 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 96 G 8.16 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 97 L 7.41 4.71 0.00 1.88 1.77 1.31 0.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 98 N 8.82 4.18 0.00 2.81 2.87 0.00 0.00 6.94 6.66 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 99 L 7.98 3.82 0.00 1.81 1.85 0.33 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 100 G 8.05 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 0.00 0.00 0.00 0.00 101 H 8.16 5.91 0.00 3.33 3.49 0.00 5.19 0.00 0.00 0.00 0.00 6.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 102 V 8.24 4.49 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 0.28 0.00 0.00 0.80 0.00 0.00 103 A 8.95 5.21 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 0.00 104 L 9.40 4.15 0.00 2.43 1.83 1.00 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 105 T 8.18 4.43 4.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 106 F 8.27 3.95 0.00 2.98 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 *107 G 8.70 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 * Residues marked with a * may have inaccurate shift predictions.