NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 97 S 4.5145 8.1927 115.4225 57.9164 64.8654 174.1940 98 Y 3.9910 8.6149 121.1686 60.7099 38.4278 176.5707 99 D 4.2926 8.6120 121.3215 57.5972 41.3010 178.5059 100 T 3.9629 7.7220 116.2415 66.4954 68.4418 177.0101 101 V 3.5603 7.6456 119.7915 66.1585 31.7390 177.5929 102 M 3.9952 7.7188 117.5211 58.7066 31.9843 177.9672 103 D 4.6635 8.3575 120.4967 56.8731 40.9585 178.8158 104 K 3.9562 8.0663 119.0006 59.4245 31.9121 178.6956 105 Y 3.7966 7.9281 119.6825 60.5929 38.6340 178.3847 106 W 3.3837 7.5141 119.5338 59.1921 28.7997 178.6081 107 L 3.9369 7.9727 119.5419 57.6179 40.9711 179.4412 108 S 3.9312 8.0628 113.2661 61.5283 62.3988 176.0293 109 Q 3.6858 7.5706 120.8634 59.0253 28.3096 178.5459 110 Y 3.9053 8.1330 120.5299 60.6476 38.8837 178.2480 111 V 3.3417 7.9067 119.0942 66.0496 31.1063 177.8178 112 I 3.5218 7.6852 119.3246 64.4592 36.7017 178.3319 113 A 3.8896 7.5848 120.2721 55.0333 18.2642 179.3726 114 R 3.7335 7.6058 116.6408 58.9772 30.1971 177.7747 115 E 4.3172 8.4443 116.1994 56.5846 30.1870 176.4332 116 T 4.6766 7.0221 115.7418 62.8369 70.0144 173.6902 117 Y 4.6838 8.6783 126.6033 55.9497 41.7189 174.2343 118 D 4.5548 8.0123 126.8890 53.1591 43.5469 175.0612 119 W 4.0122 9.0499 135.0000 60.7732 30.6027 176.5742 120 Y 4.3971 8.2502 112.7007 58.2761 37.3716 175.9036 121 T 4.4896 8.0465 115.8524 61.8847 70.7471 175.2698 122 L 3.5648 6.9652 123.1414 58.8456 41.8356 178.6822 123 Q 3.7659 7.5140 118.3344 58.8628 29.0316 178.3325 124 K 3.9258 7.7815 120.3186 59.4383 32.3081 178.4983 125 D 4.2404 8.2199 119.3610 57.5402 40.7715 177.9494 126 Y 4.3171 8.2567 121.7816 60.1396 38.6638 177.8796 127 E 4.0735 8.2256 119.9938 58.9765 29.7515 178.8943 128 T 3.8105 7.9003 116.1061 66.5864 68.3633 176.6458 129 V 3.3940 7.6169 119.1903 65.8006 31.4505 177.8267 130 G 3.7092 7.6791 105.1838 48.3627 0.0000 175.6586 131 M 4.1147 7.8214 120.0833 57.2487 32.1828 177.9103 132 L 4.4560 8.0063 117.7090 54.0398 41.9755 176.1195 133 S 4.9413 7.0701 113.2564 55.8198 66.2843 173.6780 134 S 4.2793 8.3102 116.3316 57.7070 63.5221 173.9388 135 P 4.2081 0.0000 0.0000 65.5997 31.1160 178.9989 136 S 4.1198 8.0377 112.6059 61.8247 62.8061 176.3699 137 E 4.1616 8.1835 122.1096 58.5875 29.0856 179.4182 138 G 3.6991 8.4092 106.4984 47.8382 0.0000 175.7195 139 Q 4.0171 8.3204 120.6207 58.9517 28.4370 178.3194 140 S 4.1070 7.7526 113.8869 61.2387 62.5158 175.2778 141 Y 4.2557 8.4663 122.1526 60.7859 38.5154 177.8329 142 A 4.0695 8.4602 122.1790 55.0065 18.2699 179.4609 143 S 4.0596 8.2323 113.2528 61.5968 62.7973 176.2475 144 Q 4.0242 7.7586 119.5804 57.1051 28.3552 176.9099 145 F 4.5088 7.8206 118.5075 57.1324 39.6247 174.4675 146 Q 4.5089 7.5052 122.3388 55.0443 31.4149 176.1651 147 G 3.8144 8.3673 107.4225 45.1504 0.0000 172.0626 148 D 4.5845 8.5503 117.9848 55.9341 42.5164 179.3968 149 K 4.3244 7.9613 118.0228 54.2983 31.8225 180.6258 150 A 4.0928 7.4272 121.8167 53.5926 19.8793 179.1522 151 L 3.2079 7.9781 124.1023 57.7979 41.8752 179.9486 152 D 5.6136 8.3406 119.7311 56.0792 38.9970 178.6875 153 K 3.9775 7.9703 118.4449 59.5954 32.2832 178.7079 154 Q 4.0514 7.6553 116.6666 59.3512 28.9662 178.4353 155 Y 4.4340 8.4685 117.6597 61.2841 38.3538 176.2744 156 G 3.2728 8.2859 108.1807 47.0440 0.0000 174.7650 157 S 4.5405 7.9929 118.8624 59.0076 63.8010 174.9056 158 N 4.4797 8.3109 119.7346 55.6266 38.5912 175.1011 159 V 4.7602 7.5930 115.9718 61.4105 33.6541 175.2109 160 R 5.0788 9.1012 125.9805 55.1914 34.2405 173.8013 161 T 5.3138 9.2929 122.5189 62.1011 71.7079 172.9849 162 S 4.9874 9.3228 122.5564 56.9594 65.4960 173.2657 163 V 4.9181 8.3436 121.6882 61.7379 33.6071 175.1113 164 T 4.6049 9.0252 123.6257 61.5607 71.5309 173.3205 165 I 4.1602 8.5210 128.3783 61.7602 37.0725 176.1008 166 V 4.2647 8.7559 127.9386 64.6663 32.6924 176.1243 167 S 4.7775 7.6238 111.6223 57.5167 65.8946 174.0447 168 I 5.0713 8.3876 121.6723 59.6839 40.6882 174.9342 169 V 4.3273 9.2292 127.1557 60.5450 33.2250 173.3972 170 P 4.9345 0.0000 0.0000 62.3456 32.0037 176.3443 171 N 4.8340 8.4590 115.8188 51.9298 38.1200 175.4536 172 G 4.0485 8.5452 106.1867 46.4398 0.0000 173.9044 173 K 4.5016 9.8335 117.4379 55.9774 33.5977 177.5505 174 G 3.5202 8.4595 105.6225 46.0563 0.0000 173.3343 175 I 5.1631 7.5873 119.8395 59.2314 41.0973 174.6335 176 G 4.5776 9.6630 112.9440 44.8893 0.0000 171.2763 177 T 5.1780 8.9566 121.1020 61.8003 71.2219 173.9078 178 V 4.8410 9.0308 125.8171 61.3590 34.5667 174.2656 179 R 5.2784 9.2710 128.6039 55.3878 31.8826 175.8081 180 F 5.5182 9.0933 116.7074 55.9939 41.9688 172.5208 181 A 5.1016 9.4285 121.8648 50.1762 21.7797 175.4677 182 K 5.1221 9.6312 121.8874 55.0867 35.1414 175.6968 183 T 5.1337 9.0171 120.4745 62.2722 72.1540 172.8609 184 T 5.2224 8.9746 123.7670 61.8031 71.3694 173.8793 185 K 4.8800 9.2649 124.4580 55.3599 36.8328 177.1034 186 R 4.7214 8.1290 118.2956 56.9192 31.5568 176.8325 *191 G 3.7609 7.6266 103.8338 45.6564 0.0000 171.7852 192 D 4.4693 8.5887 117.1006 53.7507 41.5343 178.2762 193 G 3.8398 7.9522 107.6210 44.4862 0.0000 171.4453 194 E 4.6931 8.8431 118.1881 54.8720 31.9448 175.5275 195 T 5.0551 8.5606 121.3845 62.2512 70.2149 173.9667 196 T 4.6044 9.2000 121.0580 60.5214 71.0567 172.0455 197 H 5.1900 8.1398 123.0733 54.1718 31.2475 173.7556 198 W 5.2250 8.4751 120.2376 55.6161 34.5819 173.6609 199 I 5.2435 9.1417 121.4003 59.7877 40.1695 174.4719 200 A 5.1033 9.5872 129.8600 50.7604 21.5345 175.4122 201 T 4.9323 9.1084 120.2476 62.0062 70.8837 173.6566 202 I 5.0406 9.3320 128.1658 59.4277 40.4101 174.8311 203 G 4.4922 9.5065 114.9028 44.2570 0.0000 172.2672 204 Y 5.2742 8.7021 122.9512 56.0143 42.0614 173.5129 205 Q 4.3977 8.5591 117.2325 55.3920 32.7320 172.5554 206 Y 4.8660 8.5801 116.9394 56.3277 40.5321 174.9274 207 V 4.3279 8.8660 124.9940 60.7200 34.2937 173.4700 208 N 4.0481 8.8397 126.1981 52.8897 38.5490 173.0685 209 P 4.3205 0.0000 0.0000 65.4164 31.6005 178.7346 210 S 4.3370 8.3120 111.1630 59.8466 63.0045 174.6334 211 L 4.4025 7.7336 120.5008 54.8014 41.6898 175.6375 212 M 4.5651 7.5249 116.8998 53.0564 33.7608 175.9926 213 S 4.4649 8.0938 113.7939 57.7427 65.2579 174.6553 214 E 3.9593 8.5443 122.9288 59.3738 29.8668 178.5997 215 S 4.2547 8.0674 113.7723 61.4307 63.2154 176.2239 216 A 4.0530 8.2591 124.4088 54.8109 17.5644 179.5098 217 R 4.2422 7.9562 115.8569 58.4661 29.9202 178.8925 218 L 4.2843 7.6854 118.4112 56.9155 41.6630 178.2350 219 T 4.6381 7.6951 107.3064 61.4899 71.4198 174.5636 220 N 4.7822 7.5861 120.6767 50.7638 39.1561 172.4581 221 P 4.3453 0.0000 0.0000 65.0176 31.7497 177.9886 222 L 4.4797 7.6990 115.4233 53.7837 42.5254 176.3824 223 G 4.2421 7.9800 106.6197 46.6158 0.0000 173.4506 224 F 3.7116 8.0282 121.2376 57.9751 39.9040 173.8183 225 N 4.6432 7.8632 125.8934 51.9454 42.5416 172.9657 226 V 4.1188 8.5327 127.6936 62.2729 32.0025 176.3411 227 T 4.3248 8.6394 119.5466 63.2940 70.0041 175.3323 228 S 5.5677 7.6289 115.2488 57.6881 66.3690 172.6836 229 Y 5.0031 8.8569 123.0637 55.9756 41.7692 174.3455 230 R 4.5366 8.2062 125.2758 54.6377 33.9354 173.5259 231 V 4.8492 8.3822 125.4637 61.2679 33.9287 174.1215 232 D 5.2785 9.5275 126.9425 51.8553 45.0736 173.7337 233 P 4.3367 0.0000 0.0000 62.2113 32.6738 176.6995 234 E 4.0114 8.2571 123.5250 56.5454 29.0443 177.8227 *235 M 4.2561 8.3310 121.6064 54.5487 32.1894 173.5346 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 97 S 8.19 4.51 0.00 4.10 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 0.00 98 Y 8.61 3.99 0.00 3.13 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 99 D 8.61 4.29 0.00 2.90 2.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 100 T 7.72 3.96 4.44 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 1.26 0.00 0.00 101 V 7.65 3.56 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.00 0.00 0.94 0.00 0.00 102 M 7.72 4.00 0.00 2.22 1.67 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.91 2.62 0.00 103 D 8.36 4.66 0.00 3.02 2.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 104 K 8.07 3.96 0.00 1.98 1.85 0.00 1.69 0.00 0.00 1.59 0.00 0.00 3.16 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.49 1.73 7.81 105 Y 7.93 3.80 0.00 2.81 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 0.00 106 W 7.51 3.38 0.00 2.32 1.74 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 0.00 107 L 7.97 3.94 0.00 1.72 1.69 0.82 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 108 S 8.06 3.93 0.00 3.84 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 0.00 109 Q 7.57 3.69 0.00 1.90 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.23 6.58 0.00 0.00 0.00 0.00 0.00 1.16 1.33 0.00 110 Y 8.13 3.91 0.00 3.27 3.14 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 0.00 111 V 7.91 3.34 1.91 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 0.23 0.00 0.00 0.99 0.00 0.00 112 I 7.69 3.52 1.81 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 1.38 0.88 0.83 0.00 0.00 113 A 7.58 3.89 1.12 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 0.00 114 R 7.61 3.73 0.00 0.74 1.35 0.00 2.38 0.00 0.00 2.25 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 1.51 0.00 115 E 8.44 4.32 0.00 1.87 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 2.22 1.96 0.00 116 T 7.02 4.68 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 1.30 0.00 0.00 117 Y 8.68 4.68 0.00 3.36 3.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 D 8.01 4.55 0.00 2.73 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 0.00 119 W 9.05 4.01 0.00 3.46 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 0.00 120 Y 8.25 4.40 0.00 3.01 2.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 121 T 8.05 4.49 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 1.27 0.00 0.00 122 L 6.97 3.56 0.00 1.46 1.07 0.56 0.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 123 Q 7.51 3.77 0.00 1.87 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.69 0.00 0.00 0.00 0.00 0.00 2.34 2.21 0.00 124 K 7.78 3.93 0.00 1.81 1.84 0.00 1.75 0.00 0.00 1.79 0.00 0.00 2.93 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.47 1.50 7.81 125 D 8.22 4.24 0.00 2.68 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 0.00 126 Y 8.26 4.32 0.00 2.87 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 0.00 127 E 8.23 4.07 0.00 2.40 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 0.00 2.31 2.39 0.00 128 T 7.90 3.81 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 1.20 0.00 0.00 129 V 7.62 3.39 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 -0.20 0.00 0.00 0.19 0.00 0.00 130 G 7.68 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 0.00 131 M 7.82 4.11 0.00 2.01 2.14 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.79 2.56 0.00 132 L 8.01 4.46 0.00 1.99 1.91 1.28 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 133 S 7.07 4.94 0.00 3.89 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 0.00 134 S 8.31 4.28 0.00 3.98 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 0.00 135 P 0.00 4.21 0.00 2.17 2.13 0.00 3.58 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 2.09 2.11 0.00 136 S 8.04 4.12 0.00 4.05 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 0.00 137 E 8.18 4.16 0.00 2.02 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 2.44 2.49 0.00 138 G 8.41 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 0.00 139 Q 8.32 4.02 0.00 2.31 2.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.72 0.00 0.00 0.00 0.00 0.00 2.56 2.41 0.00 140 S 7.75 4.11 0.00 4.05 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 0.00 141 Y 8.47 4.26 0.00 3.00 3.13 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 0.00 142 A 8.46 4.07 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 0.00 0.00 0.00 0.00 0.00 143 S 8.23 4.06 0.00 4.05 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 0.00 144 Q 7.76 4.02 0.00 1.81 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.79 0.00 0.00 0.00 0.00 0.00 1.98 1.16 0.00 145 F 7.82 4.51 0.00 3.07 2.98 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 0.00 146 Q 7.51 4.51 0.00 2.18 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.61 0.00 0.00 0.00 0.00 0.00 2.29 2.31 0.00 147 G 8.37 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 0.00 148 D 8.55 4.58 0.00 2.66 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 0.00 149 K 7.96 4.32 0.00 1.82 1.66 0.00 1.90 0.00 0.00 1.71 0.00 0.00 2.97 0.00 0.00 2.61 0.00 0.00 0.00 0.00 1.35 1.00 7.81 150 A 7.43 4.09 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 151 L 7.98 3.21 0.00 1.37 1.11 0.57 0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 152 D 8.34 5.61 0.00 3.52 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 0.00 153 K 7.97 3.98 0.00 1.90 1.89 0.00 1.79 0.00 0.00 1.76 0.00 0.00 3.07 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.48 1.61 7.81 154 Q 7.66 4.05 0.00 1.66 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.97 0.00 0.00 0.00 0.00 0.00 2.31 2.24 0.00 155 Y 8.47 4.43 0.00 2.74 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 0.00 156 G 8.29 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 0.00 0.00 0.00 157 S 7.99 4.54 0.00 3.81 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 0.00 158 N 8.31 4.48 0.00 2.99 2.85 0.00 0.00 6.48 7.66 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 0.00 159 V 7.59 4.76 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 0.48 0.00 0.00 0.61 0.00 0.00 160 R 9.10 5.08 0.00 1.98 1.77 0.00 3.19 0.00 0.00 3.24 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.89 0.00 161 T 9.29 5.31 4.44 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 1.33 0.00 0.00 162 S 9.32 4.99 0.00 3.90 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 0.00 163 V 8.34 4.92 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 0.84 0.00 0.00 0.99 0.00 0.00 164 T 9.03 4.60 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 1.27 0.00 0.00 165 I 8.52 4.16 1.89 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 1.22 0.70 0.94 0.00 0.00 166 V 8.76 4.26 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 0.82 0.00 0.00 1.11 0.00 0.00 167 S 7.62 4.78 0.00 3.93 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 0.00 168 I 8.39 5.07 1.90 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 1.28 0.70 1.00 0.00 0.00 169 V 9.23 4.33 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 1.11 0.00 0.00 0.98 0.00 0.00 170 P 0.00 4.93 0.00 2.21 2.16 0.00 3.74 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.15 0.00 171 N 8.46 4.83 0.00 2.82 2.94 0.00 0.00 6.92 7.97 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 0.00 172 G 8.55 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 0.00 173 K 9.83 4.50 0.00 1.82 1.72 0.00 1.92 0.00 0.00 1.71 0.00 0.00 2.94 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.36 1.36 7.81 174 G 8.46 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 0.00 0.00 0.00 0.00 175 I 7.59 5.16 1.90 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 1.28 1.21 0.97 0.00 0.00 176 G 9.66 4.58 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 0.00 0.00 0.00 177 T 8.96 5.18 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 1.28 0.00 0.00 178 V 9.03 4.84 2.24 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 1.08 0.00 0.00 1.01 0.00 0.00 179 R 9.27 5.28 0.00 1.86 1.90 0.00 3.25 0.00 0.00 3.25 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.65 0.00 180 F 9.09 5.52 0.00 3.33 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 0.00 181 A 9.43 5.10 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 0.00 0.00 0.00 0.00 0.00 0.00 182 K 9.63 5.12 0.00 2.11 1.92 0.00 1.32 0.00 0.00 1.66 0.00 0.00 2.98 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.54 1.72 7.81 183 T 9.02 5.13 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 1.25 0.00 0.00 184 T 8.97 5.22 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 1.14 0.00 0.00 185 K 9.26 4.88 0.00 1.64 1.66 0.00 1.66 0.00 0.00 1.67 0.00 0.00 3.05 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.36 1.43 7.81 186 R 8.13 4.72 0.00 1.77 1.94 0.00 3.27 0.00 0.00 3.86 7.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.51 0.00 *191 G 7.63 3.76 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 0.00 0.00 0.00 192 D 8.59 4.47 0.00 2.68 2.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 193 G 7.95 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 0.00 0.00 0.00 194 E 8.84 4.69 0.00 1.89 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 2.23 2.26 0.00 195 T 8.56 5.06 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 196 T 9.20 4.60 4.32 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 1.74 0.00 0.00 197 H 8.14 5.19 0.00 2.81 3.00 0.00 5.75 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 198 W 8.48 5.22 0.00 1.96 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 0.00 199 I 9.14 5.24 1.95 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.94 0.99 0.00 0.00 200 A 9.59 5.10 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 0.00 201 T 9.11 4.93 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 0.00 202 I 9.33 5.04 2.03 0.00 0.00 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.90 1.02 0.00 0.00 203 G 9.51 4.49 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 0.00 0.00 0.00 204 Y 8.70 5.27 0.00 2.43 2.67 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 0.00 205 Q 8.56 4.40 0.00 2.02 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.81 0.00 0.00 0.00 0.00 0.00 2.19 2.21 0.00 206 Y 8.58 4.87 0.00 3.01 3.03 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 0.00 207 V 8.87 4.33 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 0.89 0.00 0.00 0.86 0.00 0.00 208 N 8.84 4.05 0.00 2.84 2.76 0.00 0.00 7.20 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 0.00 209 P 0.00 4.32 0.00 2.23 2.26 0.00 3.66 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.18 0.00 210 S 8.31 4.34 0.00 3.99 3.99 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 0.00 211 L 7.73 4.40 0.00 1.83 1.72 0.91 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 212 M 7.52 4.57 0.00 2.12 2.06 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 2.48 2.52 0.00 213 S 8.09 4.46 0.00 4.07 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 0.00 214 E 8.54 3.96 0.00 1.99 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 2.30 2.37 0.00 215 S 8.07 4.25 0.00 4.09 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 0.00 216 A 8.26 4.05 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 0.00 217 R 7.96 4.24 0.00 2.09 2.01 0.00 3.14 0.00 0.00 3.36 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.84 0.00 218 L 7.69 4.28 0.00 1.86 1.77 0.94 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 219 T 7.70 4.64 4.32 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 1.26 0.00 0.00 220 N 7.59 4.78 0.00 2.87 2.61 0.00 0.00 6.75 7.59 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 0.00 221 P 0.00 4.35 0.00 2.32 2.37 0.00 3.86 0.00 0.00 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 2.33 0.00 222 L 7.70 4.48 0.00 1.72 1.80 1.09 0.95 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 0.00 223 G 7.98 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 0.00 0.00 0.00 0.00 224 F 8.03 3.71 0.00 2.06 2.48 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 0.00 225 N 7.86 4.64 0.00 2.51 2.41 0.00 0.00 6.48 7.59 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 0.00 226 V 8.53 4.12 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 0.70 0.00 0.00 -0.41 0.00 0.00 227 T 8.64 4.32 4.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 228 S 7.63 5.57 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 0.00 229 Y 8.86 5.00 0.00 2.99 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 0.00 230 R 8.21 4.54 0.00 1.92 1.68 0.00 3.09 0.00 0.00 3.10 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.56 0.00 231 V 8.38 4.85 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 0.96 0.00 0.00 0.79 0.00 0.00 232 D 9.53 5.28 0.00 2.62 2.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 233 P 0.00 4.34 0.00 1.84 1.64 0.00 3.74 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.42 0.00 234 E 8.26 4.01 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 2.16 2.11 0.00 *235 M 8.33 4.26 0.00 1.78 1.88 0.00 0.00 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.42 2.60 0.00 * Residues marked with a * may have inaccurate shift predictions.