NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 16 T 4.4150 8.0333 112.9306 60.9794 71.0462 175.3997 17 D 4.3828 8.0417 120.7992 55.3021 41.7130 175.3973 18 F 5.2969 8.6311 118.0161 55.5708 43.3679 174.0642 19 Q 4.7938 9.1735 119.9082 54.2645 31.9481 175.1827 20 T 4.5597 8.6331 120.3836 63.7901 69.4636 173.0728 21 Y 4.4880 9.2533 128.8796 56.0258 40.8180 173.8743 22 N 4.7136 8.4017 124.7265 52.0075 39.8648 174.4924 23 G 3.4380 7.9157 115.5943 43.2625 0.0000 172.4988 24 D 4.3643 8.0986 118.2533 54.2387 39.5789 176.5938 25 G 4.0846 9.6066 111.8628 45.6827 0.0000 170.0970 26 F 5.4765 7.0815 113.5666 55.2392 41.8107 173.0532 27 K 5.3712 9.1348 118.0902 55.7568 36.3660 174.8999 28 L 4.8559 8.7822 120.2118 55.2443 44.6294 173.5801 29 Q 4.9593 9.2646 119.4446 54.9031 30.5031 175.0182 30 I 4.7315 8.6581 124.8396 58.4354 40.7163 173.3839 31 P 3.8645 0.0000 0.0000 63.0192 31.2720 177.7682 32 S 4.1441 8.5191 120.8173 61.0384 62.9032 175.4994 33 K 4.4000 7.6239 117.1495 56.6652 32.5779 176.8517 34 W 4.8877 7.8810 118.8181 56.8066 29.8700 175.4070 35 N 5.3585 9.1588 119.8129 50.5588 41.6304 172.5474 36 P 3.9367 0.0000 0.0000 62.6407 32.4298 175.0994 37 N 4.8720 8.6048 120.2791 51.9958 40.8562 174.5262 38 K 4.1791 8.9063 125.0815 57.6759 32.7969 177.1030 39 E 3.9978 8.3349 120.1780 56.1051 29.6015 176.5204 40 V 4.1343 8.4574 126.7902 62.8688 32.1921 175.8026 41 E 4.5177 9.6356 122.3420 55.5064 32.2154 172.2398 42 Y 4.8521 7.7414 114.3276 55.6672 41.5362 172.9755 43 P 4.3609 0.0000 0.0000 64.2296 31.7475 176.7934 44 G 3.9538 8.9535 110.3617 45.8987 0.0000 172.5490 45 Q 4.3857 7.7406 120.9245 57.1501 29.1626 176.5261 46 V 4.6082 8.7961 117.0026 61.0511 33.9428 175.4580 47 L 4.7744 7.7623 122.1612 53.9129 45.8760 174.2318 48 R 5.1229 8.6336 125.6269 55.4940 33.3673 173.3222 49 F 5.4854 9.5666 125.2700 55.8736 43.0135 174.0228 50 E 4.3577 9.1347 118.8591 54.3577 33.5276 173.7966 51 D 4.2881 7.3624 121.3990 54.1474 41.5332 176.9238 52 N 4.1171 9.0804 124.5576 55.8468 39.0499 175.0384 53 F 4.5489 8.4909 114.8366 57.4847 40.2105 175.5859 54 D 4.2952 7.7739 119.3799 53.4252 42.0088 175.4437 55 A 4.0490 8.3998 129.9444 54.3408 18.6429 178.6313 56 T 3.9006 7.7412 111.6103 65.5566 68.8288 174.6160 57 S 5.1869 8.1399 118.7326 56.9308 63.7324 173.0345 58 N 4.9509 8.2138 121.3485 51.6266 40.9048 173.5202 59 V 5.3029 9.2780 118.9369 60.0414 35.0415 174.5229 60 I 5.1656 8.9012 116.5450 59.1127 41.3885 174.1957 61 V 4.7163 8.3942 122.1512 61.0148 34.6195 174.0778 62 A 5.1614 8.9456 128.7793 50.1298 22.5905 174.6873 63 I 4.8373 8.7062 122.5416 59.5992 40.4564 174.9470 64 T 4.8562 8.5163 116.1433 58.9656 72.5204 171.6462 65 P 4.8511 0.0000 0.0000 63.2288 32.2872 175.6939 66 T 4.8644 8.7720 117.3202 60.6659 70.8944 174.0925 67 D 4.6717 8.8214 125.1248 54.1662 40.3480 177.0170 68 K 4.1408 7.6440 119.7131 56.4778 32.5490 176.7310 69 K 4.4105 9.1835 119.9702 57.0041 33.9345 176.8593 70 S 4.5733 7.6587 111.4210 55.1645 65.8095 174.1866 71 I 3.6989 8.1307 124.6127 64.2321 37.4309 178.1705 72 T 4.3221 7.5017 111.3836 63.8010 68.3200 176.0798 73 D 4.3381 7.8051 121.2149 56.9884 40.7952 178.0399 74 F 4.3799 8.0239 117.1412 59.8953 39.5328 175.4312 75 G 4.1135 8.4782 103.8157 44.0065 0.0000 174.0830 76 S 4.4126 9.3996 118.2220 57.3692 65.2137 173.3926 77 P 4.0433 0.0000 0.0000 66.0482 31.0312 178.8308 78 E 4.0231 8.0393 116.6258 59.4076 29.2204 179.2455 79 Q 4.0645 7.9545 117.4623 58.6555 29.0909 178.1089 80 F 4.3243 8.6657 122.0814 61.3357 39.3574 176.9376 81 L 3.3445 7.8905 120.1088 57.9091 41.5871 179.0259 82 S 4.0553 7.6614 113.0866 61.3605 62.8868 176.0548 83 Q 4.2400 7.5907 119.9784 56.8065 29.0547 176.6168 84 V 3.9550 6.6996 114.4301 60.4545 32.4011 177.0044 85 D 4.3086 7.8894 119.8802 54.9884 39.5930 177.4238 86 Y 4.2603 7.5730 117.8901 59.7360 38.0463 177.5151 87 L 4.2192 7.3146 120.4232 57.1538 41.7317 177.2504 88 L 4.3058 7.4099 117.4387 52.9593 43.4538 175.4527 *107 A 3.9910 8.1000 120.9725 52.0005 19.2761 176.0969 108 V 3.9184 8.4154 123.2829 62.8132 32.1214 175.1622 109 A 4.5381 8.9050 129.5601 52.9102 20.6525 177.2886 110 I 4.6009 7.6274 115.1528 59.4119 41.1950 174.6992 111 A 5.0226 8.6662 127.6548 50.3554 21.3990 174.7254 112 N 4.7841 9.0890 121.0610 51.9668 40.7411 174.8859 113 V 4.0563 8.3610 124.9092 63.0757 31.6717 175.4261 114 L 4.3952 9.0942 129.1414 57.0359 42.2643 177.0565 115 E 4.9572 7.9663 116.3666 54.9935 34.2605 174.0908 116 T 5.2870 8.3246 110.7526 60.5593 72.6316 172.2341 117 S 4.8476 8.8893 115.6451 57.6515 66.4672 172.5263 118 T 5.7115 8.4749 111.6058 60.3466 72.0335 172.4688 119 A 4.9107 9.2075 123.0617 50.7819 23.6100 174.6035 120 E 5.2518 8.7301 119.1005 54.6202 32.6015 175.2006 121 V 4.3487 8.9040 126.2543 62.1976 34.4807 175.2632 122 G 4.0656 9.7899 115.4593 46.7987 0.0000 174.2386 123 G 3.9297 8.6013 104.9702 45.0633 0.0000 173.8596 124 K 4.6236 7.9535 119.3866 54.3567 34.8712 175.5020 125 Q 4.8444 8.5548 123.5577 55.6732 30.0510 174.8288 126 Y 4.6911 9.3277 120.7061 56.3772 41.6541 174.1431 127 Y 5.4822 8.5687 120.8967 56.5981 41.1946 174.3743 128 Y 5.2730 8.9415 119.7600 56.3323 42.1372 174.5499 129 L 5.4715 9.3089 123.1518 52.9533 46.4435 175.3891 130 S 5.3064 9.0432 117.4904 56.7371 65.6542 173.1131 131 I 5.0901 8.9872 123.6069 59.3885 41.6736 173.7656 132 L 5.0701 8.8525 128.1212 53.4495 44.2633 175.1090 133 T 5.1600 8.4965 116.3405 60.0260 71.8901 173.4221 134 R 4.8795 8.9980 122.2051 55.0667 33.8903 176.4761 135 T 4.4028 8.1683 112.5395 63.2550 70.1902 174.7386 *141 G 4.2970 7.0667 109.1635 45.0868 0.0000 171.8070 142 G 3.8855 8.5421 110.5642 44.4760 0.0000 172.4720 143 K 4.5610 8.4116 118.6999 54.7994 34.8139 175.6774 144 H 4.6627 8.9140 122.5630 54.5017 29.9013 173.9941 145 Q 5.1944 8.9374 123.1965 53.8033 32.4687 174.7116 146 L 5.2482 9.1452 124.2248 53.3275 45.5636 175.0604 147 V 4.9243 9.0589 126.3050 61.4018 34.3448 174.1646 148 T 5.0716 8.9944 124.0803 61.7766 71.6747 172.9800 149 A 5.0382 8.6862 126.2937 50.9777 23.1054 174.7813 150 T 4.4423 8.5681 113.8304 60.8041 71.6039 172.3496 151 V 5.0265 7.8484 124.1098 61.1836 34.2803 174.2637 152 N 4.8278 9.5815 124.3986 53.6745 42.2987 173.4120 153 D 4.5367 9.7019 122.5899 55.5517 39.8239 174.0065 154 G 4.0126 8.3453 101.9754 45.6262 0.0000 173.0574 155 K 4.9658 8.0560 118.1173 54.1127 36.4788 174.9006 156 L 5.0012 9.0550 126.4176 53.9929 44.0136 174.4781 157 Y 5.1040 9.1447 124.6394 56.3623 40.4068 174.7393 158 I 4.8149 8.6131 124.9563 59.4175 40.9619 173.8982 159 C 4.8519 8.6599 127.4814 57.1867 34.1018 172.3529 160 K 5.0847 8.8574 126.6091 54.5972 35.0318 174.6023 161 A 5.6008 8.9247 128.7162 50.5237 22.7091 174.6912 162 Q 5.6283 9.3807 116.1090 55.6752 32.6527 173.2251 163 A 5.0845 8.4121 120.2311 50.8324 23.2090 176.4514 164 G 4.1655 8.7069 109.3072 44.2445 0.0000 174.4576 165 D 4.6422 8.9049 118.2790 57.5864 40.7724 179.8044 166 K 4.2559 8.2637 116.4743 58.7070 32.1787 177.6865 167 R 5.0319 8.4250 116.4907 55.6471 30.8820 176.2269 168 W 4.6937 8.2560 130.5182 55.0731 29.8152 174.5156 169 F 4.8448 6.9429 116.3865 53.8970 40.7534 174.6006 170 K 3.8217 8.6100 123.0041 58.2363 32.0621 176.4606 171 G 4.0144 8.8581 114.2405 45.3252 0.0000 174.1758 172 A 4.4671 7.4916 119.4076 51.7380 20.2519 178.2419 173 K 3.5440 7.4246 117.0338 58.8930 31.9384 179.0552 174 K 3.8437 7.6239 118.6629 59.8686 32.0653 178.8473 175 F 4.4406 7.5518 117.8196 59.3885 38.9939 177.0542 176 V 4.2762 7.7517 117.5654 65.3065 32.0696 177.5930 177 E 4.0165 8.5144 118.5591 59.4947 29.4516 178.8905 178 N 4.1309 8.1202 117.0650 56.8720 38.7230 176.5307 179 T 4.3661 8.2918 116.5572 66.3075 68.9953 175.7356 180 A 4.2502 8.2288 122.2692 55.4530 18.3700 179.6470 181 T 4.2978 7.9010 106.6898 64.0910 69.0740 176.4530 182 S 4.2958 8.0000 116.3208 59.1578 63.3921 174.0848 183 F 4.4827 7.6229 125.8485 58.8119 39.6492 174.5814 184 S 4.7017 8.3042 121.1014 56.5525 67.5054 173.7390 185 L 4.3845 8.7474 123.1393 54.9662 42.2343 177.1731 186 A 4.2191 8.6597 122.8422 52.3251 19.5215 176.0332 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 16 T 8.03 4.41 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 17 D 8.04 4.38 0.00 2.81 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 18 F 8.63 5.30 0.00 3.00 2.89 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 19 Q 9.17 4.79 0.00 2.05 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 7.00 0.00 0.00 0.00 0.00 0.00 2.26 2.17 0.00 20 T 8.63 4.56 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 1.25 0.00 0.00 21 Y 9.25 4.49 0.00 2.90 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 22 N 8.40 4.71 0.00 2.42 2.58 0.00 0.00 6.93 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 23 G 7.92 3.44 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 0.00 24 D 8.10 4.36 0.00 2.72 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 25 G 9.61 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 0.00 0.00 0.00 26 F 7.08 5.48 0.00 2.70 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 27 K 9.13 5.37 0.00 1.92 1.82 0.00 1.46 0.00 0.00 1.70 0.00 0.00 2.82 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.31 1.24 7.81 28 L 8.78 4.86 0.00 1.91 2.06 1.05 1.29 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 29 Q 9.26 4.96 0.00 1.70 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.79 0.00 0.00 0.00 0.00 0.00 2.22 2.23 0.00 30 I 8.66 4.73 1.66 0.00 0.00 -0.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.57 0.53 0.00 0.00 31 P 0.00 3.86 0.00 0.49 0.66 0.00 3.01 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 0.49 1.58 0.00 32 S 8.52 4.14 0.00 3.78 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 33 K 7.62 4.40 0.00 1.78 1.97 0.00 1.67 0.00 0.00 1.73 0.00 0.00 2.95 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.43 1.41 7.81 34 W 7.88 4.89 0.00 3.47 3.41 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 35 N 9.16 5.36 0.00 2.55 2.61 0.00 0.00 6.95 8.55 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 36 P 0.00 3.94 0.00 1.77 1.21 0.00 3.59 0.00 0.00 3.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.82 0.00 37 N 8.60 4.87 0.00 2.58 2.63 0.00 0.00 7.20 6.36 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 38 K 8.91 4.18 0.00 1.77 1.84 0.00 1.80 0.00 0.00 1.71 0.00 0.00 2.87 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.44 1.43 7.81 39 E 8.33 4.00 0.00 2.06 1.88 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 2.32 2.31 0.00 40 V 8.46 4.13 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 0.79 0.00 0.00 1.01 0.00 0.00 41 E 9.64 4.52 0.00 1.94 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 0.00 2.14 2.10 0.00 42 Y 7.74 4.85 0.00 2.97 2.89 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 43 P 0.00 4.36 0.00 1.91 1.84 0.00 3.94 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 1.24 1.22 0.00 44 G 8.95 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 0.00 0.00 0.00 45 Q 7.74 4.39 0.00 2.34 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.88 6.63 0.00 0.00 0.00 0.00 0.00 2.47 2.54 0.00 46 V 8.80 4.61 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 0.86 0.00 0.00 1.24 0.00 0.00 47 L 7.76 4.77 0.00 1.89 1.53 0.48 0.89 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 48 R 8.63 5.12 0.00 1.96 1.94 0.00 3.27 0.00 0.00 3.49 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.73 0.00 49 F 9.57 5.49 0.00 3.22 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 50 E 9.13 4.36 0.00 1.76 1.80 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 2.21 2.07 0.00 51 D 7.36 4.29 0.00 2.25 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 52 N 9.08 4.12 0.00 2.48 2.24 0.00 0.00 7.08 7.02 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 53 F 8.49 4.55 0.00 3.13 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 54 D 7.77 4.30 0.00 2.74 2.55 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 55 A 8.40 4.05 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 56 T 7.74 3.90 4.39 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 1.22 0.00 0.00 57 S 8.14 5.19 0.00 3.75 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 58 N 8.21 4.95 0.00 2.86 2.79 0.00 0.00 5.67 7.68 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 59 V 9.28 5.30 2.43 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 1.16 0.00 0.00 1.06 0.00 0.00 60 I 8.90 5.17 1.76 0.00 0.00 0.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.59 0.99 0.00 0.00 61 V 8.39 4.72 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 0.34 0.00 0.00 0.76 0.00 0.00 62 A 8.95 5.16 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 63 I 8.71 4.84 1.82 0.00 0.00 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 1.25 0.51 0.00 0.00 64 T 8.52 4.86 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 65 P 0.00 4.85 0.00 1.96 2.02 0.00 3.63 0.00 0.00 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.07 0.00 66 T 8.77 4.86 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 1.31 0.00 0.00 67 D 8.82 4.67 0.00 2.79 2.75 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 68 K 7.64 4.14 0.00 1.67 1.69 0.00 0.61 0.00 0.00 0.96 0.00 0.00 2.50 0.00 0.00 2.72 0.00 0.00 0.00 0.00 1.19 1.06 7.81 69 K 9.18 4.41 0.00 1.73 1.81 0.00 1.68 0.00 0.00 1.63 0.00 0.00 2.92 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.35 1.46 7.81 70 S 7.66 4.57 0.00 3.72 3.56 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 71 I 8.13 3.70 1.39 0.00 0.00 -0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.69 0.05 -0.10 0.00 0.00 72 T 7.50 4.32 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 1.20 0.00 0.00 73 D 7.81 4.34 0.00 2.55 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 74 F 8.02 4.38 0.00 3.40 3.34 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 0.00 75 G 8.48 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 76 S 9.40 4.41 0.00 3.99 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 77 P 0.00 4.04 0.00 1.97 1.82 0.00 3.34 0.00 0.00 3.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.59 0.00 78 E 8.04 4.02 0.00 2.05 1.98 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 2.38 2.43 0.00 79 Q 7.95 4.06 0.00 2.42 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.07 6.94 0.00 0.00 0.00 0.00 0.00 2.44 2.41 0.00 80 F 8.67 4.32 0.00 3.18 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 81 L 7.89 3.34 0.00 1.72 1.69 0.72 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 82 S 7.66 4.06 0.00 4.06 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 83 Q 7.59 4.24 0.00 2.22 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 7.45 0.00 0.00 0.00 0.00 0.00 2.47 2.57 0.00 84 V 6.70 3.95 1.17 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 0.43 0.00 0.00 -0.11 0.00 0.00 85 D 7.89 4.31 0.00 2.81 2.79 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 86 Y 7.57 4.26 0.00 3.04 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 87 L 7.31 4.22 0.00 1.49 1.67 0.68 0.73 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 88 L 7.41 4.31 0.00 1.61 1.59 0.85 0.78 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 *107 A 8.10 3.99 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 0.00 108 V 8.42 3.92 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 0.80 0.00 0.00 0.91 0.00 0.00 109 A 8.90 4.54 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 0.00 110 I 7.63 4.60 1.84 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 1.26 0.65 0.89 0.00 0.00 111 A 8.67 5.02 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 0.00 112 N 9.09 4.78 0.00 2.58 2.72 0.00 0.00 6.27 7.33 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 0.00 113 V 8.36 4.06 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 0.76 0.00 0.00 0.90 0.00 0.00 114 L 9.09 4.40 0.00 1.55 1.72 0.93 0.80 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 0.00 115 E 7.97 4.96 0.00 1.93 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 0.00 2.31 2.38 0.00 116 T 8.32 5.29 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 0.00 117 S 8.89 4.85 0.00 3.90 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 0.00 118 T 8.47 5.71 4.61 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 1.25 0.00 0.00 119 A 9.21 4.91 1.38 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 0.00 120 E 8.73 5.25 0.00 2.01 1.85 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 2.23 2.45 0.00 121 V 8.90 4.35 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 0.81 0.00 0.00 122 G 9.79 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 0.00 123 G 8.60 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 0.00 0.00 0.00 0.00 124 K 7.95 4.62 0.00 1.81 1.51 0.00 1.67 0.00 0.00 1.65 0.00 0.00 2.86 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.55 1.50 7.81 125 Q 8.55 4.84 0.00 2.04 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.72 6.69 0.00 0.00 0.00 0.00 0.00 2.34 1.96 0.00 126 Y 9.33 4.69 0.00 2.92 2.45 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 0.00 127 Y 8.57 5.48 0.00 2.52 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 0.00 128 Y 8.94 5.27 0.00 2.98 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 0.00 129 L 9.31 5.47 0.00 1.61 1.51 1.07 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 130 S 9.04 5.31 0.00 3.91 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 0.00 131 I 8.99 5.09 1.82 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.74 0.88 0.00 0.00 132 L 8.85 5.07 0.00 1.61 1.42 0.59 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 133 T 8.50 5.16 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 1.22 0.00 0.00 134 R 9.00 4.88 0.00 1.66 1.78 0.00 3.09 0.00 0.00 3.20 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.49 0.00 135 T 8.17 4.40 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 1.19 0.00 0.00 *141 G 7.07 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 0.00 142 G 8.54 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 0.00 143 K 8.41 4.56 0.00 1.62 1.63 0.00 1.63 0.00 0.00 1.64 0.00 0.00 2.80 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.34 1.35 7.81 144 H 8.91 4.66 0.00 2.01 1.62 0.00 5.75 0.00 0.00 0.00 0.00 6.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 145 Q 8.94 5.19 0.00 1.88 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.76 0.00 0.00 0.00 0.00 0.00 2.20 2.17 0.00 146 L 9.15 5.25 0.00 1.73 1.55 1.04 0.89 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 0.00 147 V 9.06 4.92 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 1.06 0.00 0.00 0.88 0.00 0.00 148 T 8.99 5.07 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 1.24 0.00 0.00 149 A 8.69 5.04 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 150 T 8.57 4.44 3.29 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 1.02 0.00 0.00 151 V 7.85 5.03 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 0.90 0.00 0.00 1.04 0.00 0.00 152 N 9.58 4.83 0.00 2.75 2.65 0.00 0.00 6.60 8.10 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 0.00 153 D 9.70 4.54 0.00 2.85 2.79 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 0.00 154 G 8.35 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 0.00 0.00 0.00 155 K 8.06 4.97 0.00 1.80 1.17 0.00 1.55 0.00 0.00 1.58 0.00 0.00 2.97 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.25 1.34 7.81 156 L 9.06 5.00 0.00 1.86 1.59 0.97 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 157 Y 9.14 5.10 0.00 3.13 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 0.00 158 I 8.61 4.81 1.78 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.86 0.79 0.00 0.00 159 C 8.66 4.85 0.00 1.62 2.20 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 0.00 160 K 8.86 5.08 0.00 1.65 1.33 0.00 1.57 0.00 0.00 1.52 0.00 0.00 3.15 0.00 0.00 2.50 0.00 0.00 0.00 0.00 1.25 1.43 7.81 161 A 8.92 5.60 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 0.00 0.00 0.00 0.00 0.00 162 Q 9.38 5.63 0.00 2.12 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.63 0.00 0.00 0.00 0.00 0.00 2.38 2.37 0.00 163 A 8.41 5.08 1.52 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 0.00 0.00 0.00 164 G 8.71 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 0.00 0.00 0.00 0.00 165 D 8.90 4.64 0.00 2.82 2.89 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 0.00 166 K 8.26 4.26 0.00 1.86 2.00 0.00 1.74 0.00 0.00 1.76 0.00 0.00 3.03 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.51 1.54 7.81 167 R 8.42 5.03 0.00 1.97 2.10 0.00 3.41 0.00 0.00 3.32 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.76 0.00 168 W 8.26 4.69 0.00 3.36 2.96 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 0.00 169 F 6.94 4.84 0.00 3.21 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 0.00 170 K 8.61 3.82 0.00 1.68 1.82 0.00 1.52 0.00 0.00 1.64 0.00 0.00 2.83 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.41 1.50 7.81 171 G 8.86 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 0.00 0.00 0.00 172 A 7.49 4.47 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173 K 7.42 3.54 0.00 1.30 1.18 0.00 1.08 0.00 0.00 0.84 0.00 0.00 2.13 0.00 0.00 2.28 0.00 0.00 0.00 0.00 0.30 0.78 7.81 174 K 7.62 3.84 0.00 1.87 1.86 0.00 1.43 0.00 0.00 1.56 0.00 0.00 2.31 0.00 0.00 2.50 0.00 0.00 0.00 0.00 0.77 0.59 7.81 175 F 7.55 4.44 0.00 3.29 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 0.00 176 V 7.75 4.28 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 1.35 0.00 0.00 1.36 0.00 0.00 177 E 8.51 4.02 0.00 2.02 1.98 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 2.51 2.64 0.00 178 N 8.12 4.13 0.00 2.55 2.48 0.00 0.00 7.27 6.80 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 0.00 179 T 8.29 4.37 4.59 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 1.35 0.00 0.00 180 A 8.23 4.25 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 0.00 0.00 181 T 7.90 4.30 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 1.23 0.00 0.00 182 S 8.00 4.30 0.00 3.99 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 0.00 183 F 7.62 4.48 0.00 3.16 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 0.00 184 S 8.30 4.70 0.00 3.61 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 0.00 185 L 8.75 4.38 0.00 1.49 1.45 0.72 -0.14 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 0.00 186 A 8.66 4.22 1.06 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 * Residues marked with a * may have inaccurate shift predictions.