NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 A 4.0609 8.2649 123.5187 53.2857 21.0841 174.5167 4 F 3.7181 8.2458 120.7837 54.4684 35.3572 175.0297 5 E 4.3836 9.0326 133.9422 56.2038 31.2646 176.8520 6 A 4.2399 8.8503 120.5092 56.0134 18.0985 179.2676 7 H 4.1190 8.2795 116.1155 59.4860 29.8017 177.3020 8 D 4.2675 8.1586 120.7890 57.5416 40.6342 178.3761 9 Y 4.1146 7.7035 116.5561 60.8843 37.9120 177.9799 10 A 4.0623 8.1712 121.9340 54.7789 18.3749 179.5039 11 L 3.7537 7.9274 118.6624 58.3705 42.2160 178.8169 12 A 3.9293 8.2149 121.1114 55.2921 18.0894 179.2826 13 E 3.7408 8.2298 117.4789 59.6323 29.7847 179.3898 14 R 4.0881 7.8071 117.7379 59.1571 30.0595 179.1300 15 Q 3.9618 8.4721 118.2194 58.9793 28.6094 178.6899 16 A 4.0300 8.1845 121.8460 55.1899 18.1375 179.6534 17 Q 3.9654 8.1688 115.8594 58.9966 29.0515 178.6709 18 A 4.1640 7.8835 121.4719 55.0738 18.2842 179.2350 19 L 4.3080 7.9667 115.9083 56.4196 41.5833 179.2426 20 L 4.0654 7.6317 118.8019 57.1939 41.6367 177.7082 21 A 4.1561 7.7493 119.4566 53.2373 18.5323 176.7212 22 H 4.8376 7.9726 113.9646 52.6608 31.5241 172.3290 23 P 4.2196 0.0000 0.0000 66.0316 30.9410 178.3841 24 A 3.8689 8.1382 117.7314 54.2976 18.6542 178.4278 25 T 4.4384 8.2050 106.4725 61.4890 69.9798 176.0861 26 A 3.9920 7.4958 124.4458 55.7126 18.3351 179.5711 27 S 4.2117 8.2267 112.8261 61.8093 62.8348 176.6976 28 G 4.0324 8.3410 106.4642 48.3230 0.0000 174.8607 29 A 4.1932 7.8611 121.7731 54.7603 18.7352 179.4413 30 R 3.9976 8.2226 116.7906 59.4358 30.1594 179.6563 31 F 3.9936 7.9607 113.4255 58.6433 38.7780 176.9732 *33 L 3.7202 7.9455 121.2409 54.6226 43.7955 179.1788 34 G 2.7250 7.7320 105.1693 47.8158 0.0000 175.2123 35 Y 4.4009 7.7491 119.3982 60.6528 37.7724 178.7968 36 V 3.5126 7.7344 117.0255 66.3426 31.9922 176.8760 37 Y 4.5812 7.9569 116.5526 61.4958 37.4975 178.3392 38 A 4.3800 8.0779 119.9327 55.1936 18.5831 179.5074 39 F 3.6172 8.5797 116.3398 58.5323 40.7994 176.3555 *41 D 3.3700 7.8769 115.3666 53.5336 42.2193 176.8732 42 R 4.0909 7.3882 121.4710 55.3704 28.8011 176.6903 43 F 4.8405 7.9813 121.6486 59.5121 39.5939 177.1971 44 D 4.3844 8.0262 118.4107 57.3454 40.6527 178.4509 45 E 3.7221 7.9295 118.4111 59.0224 29.4635 178.8738 46 A 4.0349 7.7970 120.4687 55.2027 18.5160 179.5595 47 R 3.8618 8.1962 116.8051 59.6415 30.1949 178.4381 48 A 3.9647 7.8732 120.4027 55.2568 18.2108 179.5476 49 S 3.9506 7.8977 113.5076 62.0421 62.9405 177.2182 50 F 4.2573 7.7613 120.1297 60.4938 38.5335 177.5515 51 Q 3.9896 8.8055 119.4575 58.9817 28.6902 178.4553 52 A 3.9360 8.1285 121.9424 55.1008 18.4155 179.3929 53 L 3.8183 7.5148 117.5106 58.0901 41.5993 179.6919 54 Q 3.9609 8.0787 119.3399 59.2607 29.0083 178.3615 55 Q 3.9700 7.9221 118.8714 58.7856 28.5355 178.0848 56 Q 3.9317 8.0101 119.4496 59.4036 29.2136 178.2405 57 A 4.1849 8.2544 121.9157 55.2558 18.2348 179.4581 58 Q 4.1219 8.1190 114.8279 58.0725 28.8813 177.3514 59 K 4.5368 7.7070 119.8707 56.8552 33.3133 177.0436 60 S 4.5307 7.7140 113.8008 58.0327 64.4999 175.3531 61 G 3.8376 8.3362 108.2506 45.7982 0.0000 174.6293 62 D 4.5241 7.5457 119.1344 54.0086 39.9495 175.6039 63 H 4.3704 8.2614 123.5888 58.4659 28.9810 177.2261 64 T 3.9428 8.0247 117.0819 66.7795 68.4750 176.3990 65 A 4.1172 8.0570 122.5926 54.9163 18.2509 179.4452 66 E 3.8933 7.9641 118.5211 59.6779 29.7560 178.5491 67 H 4.2157 8.4150 115.3771 59.0218 28.2829 177.8096 68 R 3.7730 7.4278 119.0611 58.3504 30.1403 178.7632 69 A 4.2871 8.0521 120.8578 55.1591 18.5089 179.1142 70 L 3.8009 8.0042 119.0165 58.7913 41.8053 178.6015 71 H 4.1617 8.1963 116.9111 59.6468 29.8659 177.0019 72 Q 3.7938 7.5758 118.3930 58.2372 28.5808 178.4109 73 V 3.8325 7.4259 119.3436 65.7021 31.5146 179.1102 74 G 2.7981 7.3317 102.8939 44.9889 0.0000 175.2318 *76 V 3.8515 7.7232 121.9244 62.5262 33.5154 176.5826 77 E 3.7995 7.9364 119.1299 59.3698 29.5090 179.3392 78 R 2.5912 7.8625 115.9267 57.0010 29.8538 177.5476 *80 A 3.8333 8.0172 120.3643 50.2218 20.1962 178.5409 81 G 3.7566 7.7652 102.7176 46.3051 0.0000 175.1760 82 N 4.7221 7.8399 119.4744 51.5180 35.3895 175.6700 83 W 4.0592 7.9497 123.3588 59.3886 29.6684 177.9092 84 D 4.5772 8.3356 118.5812 57.4292 40.5092 178.2540 85 A 3.9526 8.1115 120.5507 55.0014 18.2329 179.4394 86 A 3.4806 7.8981 119.2047 55.1648 18.4473 179.3870 87 R 4.0396 8.4872 117.7113 60.0960 30.0947 178.4981 88 R 3.8683 8.1618 118.0063 59.4524 29.9223 178.2480 89 C 3.9364 7.8077 116.4845 62.9237 28.1434 176.2011 90 F 4.4590 7.9420 119.3185 60.4794 38.2449 177.8810 91 L 4.0376 8.3436 118.9740 57.6817 41.1114 179.0269 92 E 3.9426 8.1346 119.2507 59.4780 29.5188 178.5945 93 E 3.9804 8.5101 119.4513 59.1331 29.6075 178.6310 94 R 3.8647 8.1290 118.9232 59.5132 29.9049 178.4302 95 E 3.9318 7.7157 117.1064 59.0768 29.7359 178.4932 96 L 4.0522 7.5702 120.1257 58.4395 42.0331 178.8955 97 L 3.8559 8.1042 118.4344 57.9950 41.4240 179.5303 98 A 4.0453 8.0714 119.1956 54.0753 18.2489 178.6879 99 S 4.6356 7.6897 110.6243 57.2954 63.7460 173.6954 100 L 4.7917 7.1240 121.8217 52.0957 44.1039 174.3629 101 P 4.2205 0.0000 0.0000 62.3989 31.9228 175.9704 102 E 3.8791 8.7639 121.2610 57.2892 29.8602 177.1618 103 D 4.6547 8.3637 124.0370 50.7775 42.4119 173.4305 104 P 4.5145 0.0000 0.0000 65.3621 31.5467 177.7996 105 L 4.0370 7.9718 118.3070 58.1019 42.0658 178.6339 106 A 4.0543 8.1292 119.9908 54.5475 18.5112 179.3359 107 A 3.6605 7.9819 119.6343 55.2149 18.3447 179.6069 108 S 4.0866 8.4623 111.8713 61.6153 62.5272 176.3963 109 A 3.9867 7.7953 123.1117 55.0287 18.0663 178.9990 110 N 4.2229 8.2560 115.3905 56.8697 39.0363 176.8737 111 A 3.8705 7.9699 121.9986 55.3015 18.4964 178.6724 112 Y 3.9529 7.9968 118.0377 61.0499 38.6917 178.5994 113 E 3.5462 7.8220 118.6405 59.2037 29.4513 179.2613 114 V 3.5395 7.6033 118.1889 65.9339 31.4305 177.8372 115 A 3.5507 8.1492 120.5606 55.2899 18.0186 179.7422 116 T 3.8230 7.2935 115.4315 66.1763 68.4668 176.6706 117 V 3.9269 8.1978 120.2570 66.4447 31.5054 177.7289 118 A 4.1306 8.2107 120.1265 55.1498 18.2852 179.3697 119 L 3.8408 8.0787 118.7675 58.5837 42.0188 178.4226 120 H 3.5871 7.7175 116.6230 59.3811 29.6468 176.7684 121 F 4.4703 7.9129 116.8647 58.5965 38.9282 176.5270 122 G 3.9695 7.7754 106.4860 45.2772 0.0000 175.0345 123 D 4.6355 8.2364 120.4958 53.7031 38.6124 176.1312 124 L 4.1529 8.0041 124.0192 56.5940 42.0888 178.3634 125 A 4.1101 8.0070 121.1040 54.8641 18.4373 179.6792 126 G 3.5486 9.0023 105.7651 47.2361 0.0000 175.5545 127 A 3.7333 8.3184 124.0527 54.8397 18.4397 179.5009 128 R 3.8990 7.7029 117.0629 59.7533 30.1234 178.2753 129 Q 3.9695 7.8392 118.6814 59.3546 28.9350 178.3337 130 E 3.9406 8.0889 119.3110 59.4731 29.3284 178.5590 131 Y 4.3270 7.8471 116.8711 61.4361 37.8927 178.8648 132 E 3.9555 8.4122 119.3147 59.1743 29.5352 179.3341 133 K 4.0499 8.1616 119.8315 59.5046 32.2353 178.7299 134 S 4.1953 8.8535 114.1697 61.4221 62.3973 176.0160 135 L 3.8743 8.2231 123.0994 58.0739 41.9176 179.2242 136 V 3.5456 8.1516 112.8239 64.8321 31.5133 178.2641 137 Y 3.9657 8.3263 116.1230 60.5528 37.6662 177.8650 138 A 4.0520 8.3004 122.1140 55.6970 18.4961 179.8461 139 Q 4.0217 8.0345 115.8147 58.8155 28.5006 178.6296 140 Q 4.0344 7.7895 119.7806 58.5705 29.1841 177.1694 141 A 4.2605 8.1069 119.7505 51.6288 19.2828 176.5672 142 D 4.2203 7.4243 114.6258 55.3683 39.0913 173.9274 143 D 4.7482 7.8411 119.5924 52.6278 41.6523 176.2858 144 Q 4.0009 8.7854 127.0668 59.2057 28.7458 179.2233 145 V 3.6455 7.9301 118.3204 65.9266 31.6326 177.8008 146 A 3.9552 8.1281 120.1321 55.0573 18.2369 179.5632 147 I 3.5935 7.9422 118.1951 64.6068 37.2411 178.5460 148 A 3.8812 8.1938 121.8307 55.2525 17.9196 179.5502 149 C 4.2665 8.2551 115.1166 62.8077 28.1887 176.0758 150 A 4.1928 8.2293 122.5131 55.3804 17.9593 179.7467 151 F 4.1050 8.2321 116.2495 60.4821 38.8434 177.8988 152 R 4.4225 8.4113 118.6391 59.6255 29.9118 178.7956 153 G 2.9235 8.4029 105.7621 47.5214 0.0000 175.6233 154 L 3.8270 7.5169 121.3096 57.2102 41.5466 179.6649 155 G 2.8569 8.0336 105.6564 47.8388 0.0000 175.2810 156 D 4.7286 8.5534 122.3630 57.0706 40.8424 178.9285 157 L 4.0198 8.1925 120.6569 57.9918 42.0845 178.9193 158 A 4.7106 7.8258 122.2979 54.4411 18.3803 179.2982 159 Q 3.8486 8.0023 118.2142 59.5269 28.9084 178.6765 160 Q 4.0346 7.8000 117.7171 59.0189 29.1094 178.3394 161 E 4.0288 8.3601 118.7362 56.6377 29.8696 176.6822 162 K 3.9005 7.7040 116.7717 58.0125 29.6289 177.3768 163 N 4.8291 8.2077 117.9879 50.9015 38.9615 175.8898 164 L 3.9665 8.0979 124.6046 58.2827 40.7090 178.8696 165 L 4.2077 7.7165 118.9651 56.5647 42.0214 178.3886 166 E 3.6996 7.9591 118.7009 59.3091 29.7010 178.6459 167 A 3.3647 7.7273 120.5940 54.7273 18.1516 179.4631 168 Q 3.9491 7.3669 117.1608 59.3085 29.1849 178.4491 169 Q 3.9298 8.0206 118.7651 59.6629 28.7340 178.1346 170 H 4.2309 7.8975 118.3382 58.3663 28.6675 177.9124 171 W 4.6039 8.0840 120.7126 59.5965 28.8011 178.7618 172 L 4.0031 7.9640 118.9262 57.5611 41.0634 179.0751 173 R 3.6498 7.9701 118.5191 59.4803 29.8216 178.1784 174 A 3.7949 7.9644 120.1167 55.1307 18.1813 179.3058 175 R 3.9921 8.3898 116.2070 59.8762 30.3737 178.0941 176 D 4.5034 8.4331 118.6666 57.5178 40.4880 178.6763 177 I 3.9408 7.4941 121.4140 64.0006 37.0541 178.6098 178 F 4.6472 8.3168 117.7557 60.1260 38.4846 177.5195 179 A 4.1859 8.2409 121.0876 54.5551 18.1387 178.3802 180 E 4.5612 7.8402 114.9166 56.5899 29.3744 177.5275 181 L 4.7084 7.6405 116.5201 53.5702 43.2570 176.2558 182 E 3.8455 8.0271 116.6586 57.3707 27.8646 176.1235 183 D 4.6127 7.6250 120.0292 54.1210 38.1374 176.1950 184 S 4.2519 8.2639 120.6299 60.0154 63.1173 174.6567 185 E 4.3823 7.8913 121.2530 57.8386 30.0544 177.5197 186 A 3.6321 7.5475 120.8304 55.0838 18.0615 179.9236 187 V 3.6467 7.2961 109.5566 64.6026 31.6400 178.0716 188 N 4.4156 7.3117 116.3957 56.6583 39.0304 176.4095 189 E 4.0762 8.3445 120.3037 59.1969 29.5730 179.8655 190 L 3.7811 7.8184 118.1366 55.1782 42.0798 179.3454 *192 T 4.2386 7.9434 117.5635 63.7852 70.5582 176.7996 193 R 3.5844 7.2467 117.8507 59.1047 30.1234 178.0926 194 L 4.3047 7.3792 116.0920 58.1836 41.8376 178.8298 195 N 4.7161 7.2542 116.1697 51.2395 36.1069 174.6731 196 G 4.1570 7.5099 104.3421 45.5113 0.0000 172.0672 197 L 4.6214 7.8832 121.9052 52.7885 40.8030 175.9096 198 E 4.2432 8.3022 119.7249 57.8602 30.6441 177.5356 199 H 4.4792 7.8137 119.7261 55.8202 28.7049 172.9159 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 3 A 8.26 4.06 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 4 F 8.25 3.72 0.00 3.18 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 5 E 9.03 4.38 0.00 2.27 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 2.34 2.54 0.00 6 A 8.85 4.24 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 7 H 8.28 4.12 0.00 3.26 3.42 0.00 5.59 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8 D 8.16 4.27 0.00 2.45 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 9 Y 7.70 4.11 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 10 A 8.17 4.06 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 11 L 7.93 3.75 0.00 1.64 1.74 0.88 1.03 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 12 A 8.21 3.93 1.34 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 0.00 0.00 13 E 8.23 3.74 0.00 2.01 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 0.00 2.31 2.28 0.00 14 R 7.81 4.09 0.00 1.94 1.96 0.00 3.57 0.00 0.00 3.18 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.81 0.00 15 Q 8.47 3.96 0.00 2.23 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.80 0.00 0.00 0.00 0.00 0.00 2.36 2.49 0.00 16 A 8.18 4.03 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 17 Q 8.17 3.97 0.00 2.20 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.91 0.00 0.00 0.00 0.00 0.00 2.44 2.54 0.00 18 A 7.88 4.16 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 19 L 7.97 4.31 0.00 1.74 1.74 0.95 0.42 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 20 L 7.63 4.07 0.00 1.70 1.73 0.93 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 21 A 7.75 4.16 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 22 H 7.97 4.84 0.00 3.19 3.19 0.00 5.85 0.00 0.00 0.00 0.00 6.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 P 0.00 4.22 0.00 2.17 2.15 0.00 3.63 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 2.13 2.20 0.00 24 A 8.14 3.87 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 25 T 8.20 4.44 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 1.20 0.00 0.00 26 A 7.50 3.99 1.42 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 27 S 8.23 4.21 0.00 3.99 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 28 G 8.34 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 29 A 7.86 4.19 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 0.00 0.00 0.00 0.00 0.00 30 R 8.22 4.00 0.00 1.88 1.78 0.00 3.22 0.00 0.00 3.01 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.76 0.00 31 F 7.96 3.99 0.00 3.43 3.30 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 *33 L 7.95 3.72 0.00 1.76 1.29 0.90 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 34 G 7.73 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 0.00 0.00 0.00 35 Y 7.75 4.40 0.00 3.19 3.16 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 36 V 7.73 3.51 1.84 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 0.81 0.00 0.00 0.93 0.00 0.00 37 Y 7.96 4.58 0.00 3.04 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 38 A 8.08 4.38 1.72 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 0.00 0.00 39 F 8.58 3.62 0.00 2.85 2.69 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 *41 D 7.88 3.37 0.00 2.41 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 42 R 7.39 4.09 0.00 1.98 1.92 0.00 3.10 0.00 0.00 3.22 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.47 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0.00 0.00 0.00 0.00 0.00 0.00 120 H 7.72 3.59 0.00 1.90 2.51 0.00 5.80 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 0.00 121 F 7.91 4.47 0.00 3.09 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 0.00 122 G 7.78 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 0.00 123 D 8.24 4.64 0.00 2.81 2.60 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 0.00 124 L 8.00 4.15 0.00 1.73 1.71 0.92 0.69 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 0.00 125 A 8.01 4.11 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 0.00 126 G 9.00 3.55 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 0.00 0.00 0.00 127 A 8.32 3.73 1.39 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 0.00 0.00 128 R 7.70 3.90 0.00 1.97 1.97 0.00 3.12 0.00 0.00 3.11 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.68 0.00 129 Q 7.84 3.97 0.00 2.15 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.61 0.00 0.00 0.00 0.00 0.00 2.34 2.41 0.00 130 E 8.09 3.94 0.00 1.76 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 2.37 0.00 131 Y 7.85 4.33 0.00 3.06 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 0.00 132 E 8.41 3.96 0.00 2.31 1.99 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 2.30 2.30 0.00 133 K 8.16 4.05 0.00 1.92 2.08 0.00 1.75 0.00 0.00 1.61 0.00 0.00 2.82 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.56 1.81 7.81 134 S 8.85 4.20 0.00 4.15 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 0.00 135 L 8.22 3.87 0.00 1.66 1.76 0.64 0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 136 V 8.15 3.55 1.89 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 0.94 0.00 0.00 0.87 0.00 0.00 137 Y 8.33 3.97 0.00 3.02 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 0.00 138 A 8.30 4.05 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 0.00 139 Q 8.03 4.02 0.00 2.26 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.76 0.00 0.00 0.00 0.00 0.00 2.39 2.36 0.00 140 Q 7.79 4.03 0.00 2.10 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.90 0.00 0.00 0.00 0.00 0.00 2.29 2.39 0.00 141 A 8.11 4.26 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 0.00 142 D 7.42 4.22 0.00 2.90 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 0.00 143 D 7.84 4.75 0.00 2.70 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 0.00 144 Q 8.79 4.00 0.00 2.12 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.12 6.68 0.00 0.00 0.00 0.00 0.00 2.47 2.39 0.00 145 V 7.93 3.65 2.23 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 1.22 0.00 0.00 1.02 0.00 0.00 146 A 8.13 3.96 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 0.00 147 I 7.94 3.59 2.04 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 1.47 1.04 1.10 0.00 0.00 148 A 8.19 3.88 0.26 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 0.00 149 C 8.26 4.27 0.00 2.93 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 0.00 150 A 8.23 4.19 1.35 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 0.00 0.00 0.00 151 F 8.23 4.11 0.00 3.22 3.21 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 0.00 152 R 8.41 4.42 0.00 2.16 2.33 0.00 3.18 0.00 0.00 3.36 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 1.85 0.00 153 G 8.40 2.92 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 0.00 0.00 0.00 154 L 7.52 3.83 0.00 1.82 1.43 0.91 0.54 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 0.00 155 G 8.03 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 0.00 0.00 0.00 156 D 8.55 4.73 0.00 2.92 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 0.00 157 L 8.19 4.02 0.00 1.87 1.82 0.98 1.24 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 0.00 158 A 7.83 4.71 1.35 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 0.00 0.00 0.00 159 Q 8.00 3.85 0.00 2.10 2.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.75 0.00 0.00 0.00 0.00 0.00 2.43 2.49 0.00 160 Q 7.80 4.03 0.00 2.23 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.74 0.00 0.00 0.00 0.00 0.00 2.39 2.44 0.00 161 E 8.36 4.03 0.00 2.17 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 2.42 0.00 162 K 7.70 3.90 0.00 1.96 1.92 0.00 1.72 0.00 0.00 1.70 0.00 0.00 2.99 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.53 1.56 7.81 163 N 8.21 4.83 0.00 2.65 2.66 0.00 0.00 6.83 6.64 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 0.00 164 L 8.10 3.97 0.00 1.84 1.89 0.92 0.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 165 L 7.72 4.21 0.00 1.66 1.69 0.90 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 166 E 7.96 3.70 0.00 1.93 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 0.00 2.23 2.24 0.00 167 A 7.73 3.36 0.60 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 0.00 168 Q 7.37 3.95 0.00 2.41 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.76 0.00 0.00 0.00 0.00 0.00 2.37 2.43 0.00 169 Q 8.02 3.93 0.00 2.23 2.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.58 0.00 0.00 0.00 0.00 0.00 2.27 2.22 0.00 170 H 7.90 4.23 0.00 3.02 3.62 0.00 5.63 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 171 W 8.08 4.60 0.00 3.55 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 0.00 172 L 7.96 4.00 0.00 1.83 1.71 0.97 1.22 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 0.00 173 R 7.97 3.65 0.00 1.63 1.66 0.00 2.76 0.00 0.00 2.73 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.98 0.00 174 A 7.96 3.79 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 0.00 0.00 175 R 8.39 3.99 0.00 1.88 2.30 0.00 3.31 0.00 0.00 3.27 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.75 0.00 176 D 8.43 4.50 0.00 2.80 2.68 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 0.00 177 I 7.49 3.94 1.63 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 1.61 1.92 0.84 0.00 0.00 178 F 8.32 4.65 0.00 3.35 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 0.00 179 A 8.24 4.19 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 0.00 180 E 7.84 4.56 0.00 2.07 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 2.32 2.29 0.00 181 L 7.64 4.71 0.00 1.72 1.73 1.04 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 182 E 8.03 3.85 0.00 2.09 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 2.28 2.26 0.00 183 D 7.62 4.61 0.00 2.68 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 0.00 184 S 8.26 4.25 0.00 3.91 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 0.00 185 E 7.89 4.38 0.00 1.95 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 2.23 2.30 0.00 186 A 7.55 3.63 0.33 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 0.00 187 V 7.30 3.65 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 0.89 0.00 0.00 0.99 0.00 0.00 188 N 7.31 4.42 0.00 2.86 2.99 0.00 0.00 7.26 7.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 189 E 8.34 4.08 0.00 2.09 1.90 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 2.25 2.48 0.00 190 L 7.82 3.78 0.00 1.87 1.66 0.97 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 *192 T 7.94 4.24 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 1.15 0.00 0.00 193 R 7.25 3.58 0.00 1.00 0.66 0.00 2.51 0.00 0.00 2.25 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 1.30 0.00 194 L 7.38 4.30 0.00 1.65 1.81 0.99 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 195 N 7.25 4.72 0.00 2.71 2.79 0.00 0.00 6.94 7.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 196 G 7.51 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 0.00 197 L 7.88 4.62 0.00 1.68 1.64 1.09 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 0.00 0.00 0.00 0.00 0.00 0.00 198 E 8.30 4.24 0.00 2.09 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 2.31 2.39 0.00 199 H 7.81 4.48 0.00 3.19 3.25 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 * Residues marked with a * may have inaccurate shift predictions.