NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 15 A 4.4371 8.1185 122.4692 51.4753 20.8639 175.3825 15B A 4.3226 8.4152 121.2466 51.5599 19.2097 175.7525 16 I 4.1111 9.5785 125.3592 60.5619 38.3139 174.0718 17 I 4.6526 8.0791 127.6245 58.8702 40.5707 175.8464 18 G 3.5417 8.3694 114.8319 47.3318 0.0000 174.5347 19 G 4.6429 9.3222 112.1388 46.3775 0.0000 172.8682 *31 N 4.8119 8.0096 115.9578 52.2748 40.2620 172.3285 32 P 4.9008 0.0000 0.0000 63.0909 32.5491 174.8935 33 Y 5.2836 8.4453 118.5618 54.4647 41.8125 173.5293 34 Y 5.4194 8.5185 116.9927 56.4998 42.0813 175.3296 35 F 4.8140 8.7147 117.1070 55.9850 41.2908 174.7137 36 G 3.8920 9.1374 113.7359 46.9043 0.0000 174.7188 *39 N 4.4654 8.7987 121.7161 52.5198 40.2713 172.3172 40 Y 4.7975 7.5303 114.4640 56.6762 42.0489 174.2741 41 R 4.8273 8.2602 120.0793 54.9199 33.6612 174.7524 42 C 5.0107 8.3219 121.9516 55.3387 44.6721 172.4133 43 S 5.3490 8.9823 115.5244 56.6697 65.1758 174.5250 44 I 3.0782 8.8610 125.8023 62.6583 37.0361 175.4346 44A G 3.8063 9.4197 115.7687 48.1992 0.0000 172.9999 45 F 5.2283 8.3433 114.9931 54.7624 44.6045 174.7343 46 S 4.8544 9.0550 118.7761 59.4653 63.9683 173.7738 47 V 5.0134 9.1208 116.3855 59.8656 36.5182 174.4457 48 R 5.1037 9.0330 120.3077 54.5967 34.3504 175.2447 48A Q 4.3140 8.6235 122.1642 54.5258 31.8267 177.0938 48B G 4.1484 8.9411 119.3276 46.9279 0.0000 173.8096 48C S 4.5067 9.2195 120.8743 58.6564 64.0547 174.9048 49 Q 4.4795 8.3914 121.5420 54.8261 29.0575 180.0546 50 T 5.1618 7.9132 108.6562 60.6359 72.6377 173.6761 51 G 4.7422 8.4636 107.4818 46.8815 0.0000 171.8574 52 F 5.7589 8.1993 114.6153 55.1235 41.8226 174.3829 53 A 4.8062 9.6279 123.5845 53.0389 20.0543 176.5331 54 T 4.9957 8.6900 113.5451 61.3877 71.7967 172.2630 55 A 4.7060 8.7324 125.0211 51.4940 19.3155 178.9738 56 G 3.8127 8.8749 111.2414 48.8469 0.0000 175.2088 57 H 3.7299 8.1212 114.2550 57.0871 28.4770 175.8331 58 C 4.3993 7.6925 117.1565 57.6016 40.2972 173.9903 59 G 4.2754 6.5898 113.8238 45.1060 0.0000 172.6554 59A S 4.7811 7.5487 116.0415 56.2948 64.6824 173.6465 59B T 3.9677 8.2950 117.2984 65.8786 68.6465 175.3067 60 G 4.0290 9.1840 115.0184 45.0198 0.0000 173.2407 61 T 4.2459 7.7843 120.4254 64.2689 69.6821 174.6157 62 R 4.4577 8.5451 126.6848 56.7165 30.8713 173.1753 59A V 4.4311 7.2687 119.5415 60.1948 33.7824 175.3465 59B S 4.0877 8.4550 119.3984 62.3786 62.6465 175.2067 60 S 4.5390 9.1640 121.9184 58.2198 62.4890 172.9407 61 P 4.3159 0.0000 0.0000 65.7689 31.9821 177.2157 62 S 4.5877 8.6251 121.8848 59.0165 63.7713 171.4753 *85 G 3.6531 8.3313 113.7612 46.1235 0.0000 171.0512 *87 T 4.8188 8.0156 114.1389 63.0744 70.2894 174.1214 88 V 3.6698 8.4540 124.6083 63.0607 31.2350 175.5255 88A A 3.8694 7.7661 131.2049 53.8892 19.1487 177.4220 89 G 4.3426 6.9454 100.3671 45.6243 0.0000 172.6635 90 S 5.1625 8.6239 115.7404 57.3865 65.8069 173.0835 91 Y 4.4992 9.8428 129.1679 55.8229 40.7662 173.9674 *94 F 5.4661 8.7506 127.7312 57.4505 40.9487 173.9684 95 P 3.6275 0.0000 0.0000 62.1355 32.5095 175.6072 *100 G 4.0288 8.1573 102.6341 45.1703 0.0000 173.9736 101 R 4.5507 7.0823 117.8295 53.7967 33.7596 175.1854 102 D 5.4993 8.1603 113.9547 53.3484 41.5089 173.5235 103 M 5.2150 8.9957 119.1738 53.7607 35.7625 175.8407 104 G 4.3924 8.9631 106.8116 45.9874 0.0000 171.6329 105 W 5.6324 8.4307 115.9989 54.8423 32.1197 173.8646 106 V 3.9559 7.9669 121.3657 60.7883 33.0067 174.2817 107 R 4.4419 8.0419 129.2204 55.4491 31.3448 175.7372 108 I 4.6823 8.3276 120.7798 59.7161 40.8130 174.1069 109 T 4.6243 8.0644 111.6121 59.4567 71.0479 175.0374 110 S 4.2411 8.5300 115.0642 60.4744 62.9880 175.3586 111 A 4.1474 7.6108 123.3999 54.2490 18.2770 176.7017 112 D 5.2720 7.8388 114.0228 52.7271 45.1340 175.6345 113 T 4.6290 8.6525 116.9673 61.6643 71.6180 174.1845 114 V 4.0324 8.4005 120.6959 61.6176 32.7827 175.6273 *119 T 4.7212 8.5959 114.2294 60.6145 70.3334 171.0287 120 P 5.0253 0.0000 0.0000 63.1022 32.4342 175.1732 120A L 5.2989 7.9051 119.1894 53.9743 45.2516 175.7526 120B V 4.8411 8.4466 120.9286 60.8335 34.7942 174.1844 120C N 4.4738 9.2077 127.4517 53.7523 39.0335 174.7774 120D R 3.5692 8.7860 125.9290 56.0877 30.5560 176.2965 120E Y 3.5899 8.3700 114.4643 59.5391 35.9724 170.2164 120F N 4.8334 7.8528 114.3902 52.6537 37.6225 175.4729 120G G 3.9628 9.1623 107.8477 45.6805 0.0000 173.6449 120H G 4.2758 7.5820 105.3874 45.0890 0.0000 171.3841 120I T 5.1931 8.2598 108.6717 58.8935 72.6429 173.1761 120J V 4.4306 8.5881 121.3080 61.3450 34.6445 174.2406 120K T 4.7801 8.4308 123.7805 62.6488 69.7484 174.4011 121 V 4.2791 9.1864 127.8249 62.9158 32.2234 176.1675 122 T 4.3879 8.7266 117.7903 61.3357 70.4160 174.2616 123 G 3.9722 7.0224 109.1723 46.1711 0.0000 172.5040 124 S 5.0674 8.2082 111.1846 56.3479 63.3364 174.2094 125 Q 3.7709 8.8596 123.5088 57.3304 29.1586 174.3583 120I E 5.1931 8.5298 115.2717 53.6935 32.7429 175.0761 120J A 4.6306 8.7981 125.9081 51.6450 20.8445 175.7406 120K A 4.7501 8.5208 133.9805 53.3488 19.0484 177.5011 121 T 4.5091 9.3064 122.2249 62.5158 69.1234 174.5675 122 G 3.9979 8.9066 112.9903 44.6357 0.0000 174.4616 123 S 4.4822 7.0024 116.0723 59.3711 66.7309 172.2040 124 S 5.0674 8.2082 111.1846 56.3479 63.3364 174.2094 125 V 3.5509 8.5696 122.9088 63.8304 32.6586 174.6583 137 C 4.8939 9.2011 119.7417 54.9194 45.1341 173.1824 138 R 4.2821 7.9088 117.5550 53.9585 32.3815 174.1766 139 S 5.1427 8.0324 114.7678 56.8269 65.9868 172.9792 140 G 4.1457 8.5976 111.6048 45.4244 0.0000 174.0782 141 A 4.1315 8.9059 123.1082 53.9831 18.9074 179.4261 142 T 4.1742 8.3636 113.1093 65.6005 68.7550 176.5251 143 T 4.3861 7.3242 107.2576 61.7214 70.8040 174.0220 *156 G 3.3005 7.2590 108.8988 45.8907 0.0000 174.1759 157 W 5.4052 8.9245 135.0000 55.6228 31.9785 174.6369 158 R 4.6774 8.4020 125.4940 54.6463 34.0330 173.6370 159 C 5.4800 8.2699 118.5343 55.7135 44.1549 173.9006 160 G 3.9949 7.7546 104.6814 46.7825 0.0000 172.3965 161 T 5.0463 8.3826 117.1348 61.5958 72.5073 173.7807 162 I 4.1017 8.5297 126.5230 61.8633 37.1164 175.4353 163 Q 4.3777 8.9935 127.0147 57.6221 30.2395 176.5114 164 S 4.5400 7.5570 110.9936 57.3317 65.7888 174.2263 165 K 4.5126 8.5956 125.6287 54.9941 34.8154 174.7566 166 N 4.0681 8.2124 114.8481 54.8878 37.3228 173.1932 167 Q 4.7177 8.3269 115.7613 54.9846 31.2772 175.8645 168 T 4.8585 8.2290 119.1227 61.9336 70.5045 174.1511 169 V 3.8461 8.3512 126.0170 60.9045 34.3774 175.6062 170 R 4.1633 8.1576 128.2620 54.7295 28.2762 175.6903 171 Y 4.3242 7.2109 119.0348 57.9935 39.0449 177.0547 *173 A 4.3805 8.3150 123.6609 52.4100 20.3884 177.9563 174 E 4.2039 8.5825 112.9300 57.2470 30.0994 175.9213 175 G 4.3262 6.9787 105.0280 43.1803 0.0000 172.9813 176 T 4.2386 7.7889 117.9920 63.1805 69.4214 174.4688 177 V 4.6382 8.6163 125.8939 61.2574 34.5111 174.5594 178 T 4.5317 8.6638 117.5890 60.2463 71.6795 174.2469 179 G 4.1963 8.5863 107.0109 45.7147 0.0000 173.6277 180 L 4.4679 7.7337 119.6057 54.3140 43.5531 175.8342 181 T 4.5539 8.0484 118.7329 61.8495 70.4054 173.8676 182 R 4.1468 8.7774 128.2536 55.6205 31.7325 175.2193 183 T 5.1867 8.5346 115.5527 60.1293 72.7917 174.0651 184 T 4.3892 8.5473 110.6991 61.8479 69.5246 175.2202 185 A 4.1630 8.1611 126.6585 52.3752 19.1054 174.5383 *189 C 4.8766 8.5562 113.2765 55.8127 41.2637 172.6063 190 A 4.6846 7.7713 121.0917 51.6189 21.7673 174.9118 191 E 4.8546 9.3940 118.6666 53.9089 33.7460 175.7987 192 G 3.9417 8.5455 108.9044 47.8029 0.0000 173.0885 193 G 4.2650 8.8678 109.9327 46.2572 0.0000 174.3328 194 D 4.4977 8.2040 118.1946 55.6643 41.5084 176.7279 195 S 4.4458 7.8178 116.7047 59.9620 63.1500 174.9477 196 G 4.4334 8.7354 112.9501 46.3944 0.0000 173.9171 197 G 3.9662 8.0508 106.5263 44.7161 0.0000 171.5426 198 P 4.8112 0.0000 0.0000 62.0194 33.1879 174.9245 199 W 4.9746 9.0786 120.9233 54.8983 32.1885 174.6834 200 L 5.3481 9.1398 123.6679 53.3191 45.6339 175.7179 201 T 4.6067 8.8049 120.2295 61.2209 70.3592 174.9973 201A G 3.6501 8.7679 119.1270 47.0904 0.0000 174.1044 *207 S 4.7664 8.6124 119.2132 57.6299 65.0394 172.2008 208 Q 4.7863 8.0582 120.8638 54.1905 30.2447 175.0282 209 A 4.4860 8.8197 126.6187 52.7709 18.5520 176.5676 210 Q 4.3656 9.5567 120.8704 56.1769 32.2467 175.8173 211 G 4.1201 7.0731 103.1605 46.4897 0.0000 171.9855 212 V 5.5330 8.1336 111.9703 59.5143 35.8356 175.9478 213 T 4.6183 9.1988 121.2281 64.5310 68.7808 174.7016 214 S 4.5854 8.6346 121.4556 58.3279 64.1994 173.8884 215 G 4.1630 7.1468 104.9330 46.1331 0.0000 171.0765 216 G 3.9748 7.8901 104.7121 46.2260 0.0000 171.3461 217 T 4.6732 8.0490 112.7899 61.4069 71.1181 175.1016 218 G 4.1124 10.4391 111.8074 44.9016 0.0000 170.5285 219 D 4.7875 8.0273 117.5481 54.0328 42.1113 174.8528 219A C 4.6209 9.0446 115.7714 57.6500 40.7056 175.2585 220 R 4.0371 8.1870 120.2771 58.6967 29.8809 177.0127 222 S 4.5046 8.6699 111.0552 57.5852 64.7922 174.1211 223 G 3.9094 8.3284 106.5872 44.5331 0.0000 172.7926 224 G 4.7809 7.4734 103.2118 45.6591 0.0000 172.2565 225 I 4.9204 7.6579 111.6886 59.2825 41.4249 174.4932 226 T 5.2592 8.4973 112.6565 60.0746 72.6446 172.4907 227 F 5.2128 9.5340 121.2857 55.5639 42.6518 174.2367 228 F 5.2996 8.2181 117.4248 54.8522 41.1558 174.1311 229 Q 4.5490 9.0972 122.9665 54.9285 29.5364 173.4131 230 P 4.9935 0.0000 0.0000 63.4112 32.2626 177.5490 231 I 4.0952 8.6990 123.2326 64.0992 37.8809 178.2161 232 N 4.3263 8.1261 116.9960 55.9265 38.3768 175.3320 233 P 4.2308 0.0000 0.0000 65.3060 31.4405 178.3815 234 L 4.0310 7.5114 119.5374 58.2888 42.0384 179.0479 235 L 4.0272 8.1127 118.9378 57.7643 41.4161 179.5350 236 S 4.0296 8.3238 113.1993 61.5581 62.1772 175.4664 237 Y 3.8177 8.0043 121.0579 60.3327 38.5985 177.3037 238 F 4.9178 7.9398 114.9438 56.1792 40.1922 175.6048 239 G 3.8518 7.7481 106.7212 46.8900 0.0000 173.6071 240 L 4.6768 7.9696 117.1527 52.6285 44.9539 177.2629 241 Q 4.4901 8.6664 123.7633 53.9495 30.9171 174.5779 242 L 4.2720 8.4650 129.1727 55.2013 43.3044 176.3724 243 V 4.0112 8.7326 127.0824 62.9761 32.1479 174.8964 244 T 4.9813 8.5970 117.9122 59.8246 71.8892 174.5907 245 G 3.7214 8.4222 109.9464 45.9128 0.0000 172.5205 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 15 A 8.12 4.44 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 15B A 8.42 4.32 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 16 I 9.58 4.11 1.91 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 1.41 0.98 0.87 0.00 0.00 17 I 8.08 4.65 1.78 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.56 0.85 0.00 0.00 18 G 8.37 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 0.00 0.00 0.00 19 G 9.32 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 *31 N 8.01 4.81 0.00 2.77 2.74 0.00 0.00 7.38 8.03 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 32 P 0.00 4.90 0.00 1.55 1.99 0.00 3.73 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 2.06 0.00 33 Y 8.45 5.28 0.00 3.11 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 34 Y 8.52 5.42 0.00 2.90 2.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 F 8.71 4.81 0.00 3.34 3.33 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 36 G 9.14 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 *39 N 8.80 4.47 0.00 2.32 1.72 0.00 0.00 7.13 7.54 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 40 Y 7.53 4.80 0.00 1.62 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 41 R 8.26 4.83 0.00 1.94 1.70 0.00 3.22 0.00 0.00 3.60 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.48 0.00 42 C 8.32 5.01 0.00 2.21 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 43 S 8.98 5.35 0.00 3.92 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 44 I 8.86 3.08 1.72 0.00 0.00 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 0.44 0.43 0.00 0.00 44A G 9.42 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 45 F 8.34 5.23 0.00 3.07 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 46 S 9.06 4.85 0.00 3.97 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 47 V 9.12 5.01 1.93 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 0.87 0.00 0.00 0.91 0.00 0.00 48 R 9.03 5.10 0.00 1.63 1.75 0.00 3.06 0.00 0.00 3.10 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.53 0.00 48A Q 8.62 4.31 0.00 1.54 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 5.86 0.00 0.00 0.00 0.00 0.00 2.21 2.36 0.00 48B G 8.94 4.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48C S 9.22 4.51 0.00 4.00 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 49 Q 8.39 4.48 0.00 1.97 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.08 6.74 0.00 0.00 0.00 0.00 0.00 2.28 2.16 0.00 50 T 7.91 5.16 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 51 G 8.46 4.74 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 52 F 8.20 5.76 0.00 3.20 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 53 A 9.63 4.81 1.51 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 54 T 8.69 5.00 4.53 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 0.00 0.00 0.00 1.22 0.00 0.00 55 A 8.73 4.71 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 56 G 8.87 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 57 H 8.12 3.73 0.00 1.88 1.31 0.00 5.56 0.00 0.00 0.00 0.00 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 C 7.69 4.40 0.00 3.09 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 59 G 6.59 4.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59A S 7.55 4.78 0.00 4.03 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 59B T 8.30 3.97 4.23 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 1.22 0.00 0.00 60 G 9.18 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 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0.00 0.00 6.82 6.72 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 0.00 167 Q 8.33 4.72 0.00 2.12 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.33 6.57 0.00 0.00 0.00 0.00 0.00 2.51 2.55 0.00 168 T 8.23 4.86 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 1.07 0.00 0.00 169 V 8.35 3.85 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.26 0.00 0.00 -0.41 0.00 0.00 170 R 8.16 4.16 0.00 1.76 1.81 0.00 3.22 0.00 0.00 3.17 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.54 0.00 171 Y 7.21 4.32 0.00 3.32 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 *173 A 8.31 4.38 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 0.00 174 E 8.58 4.20 0.00 2.20 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.53 2.48 0.00 175 G 6.98 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 0.00 0.00 0.00 0.00 176 T 7.79 4.24 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 1.14 0.00 0.00 177 V 8.62 4.64 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 1.05 0.00 0.00 1.26 0.00 0.00 178 T 8.66 4.53 4.15 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 1.12 0.00 0.00 179 G 8.59 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 0.00 0.00 0.00 180 L 7.73 4.47 0.00 1.67 1.63 0.75 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 181 T 8.05 4.55 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 0.70 0.00 0.00 182 R 8.78 4.15 0.00 1.71 1.60 0.00 2.88 0.00 0.00 3.20 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.63 0.00 183 T 8.53 5.19 4.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.00 0.00 184 T 8.55 4.39 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 0.00 185 A 8.16 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 *189 C 8.56 4.88 0.00 3.25 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 0.00 190 A 7.77 4.68 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 0.00 191 E 9.39 4.85 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 2.22 2.22 0.00 192 G 8.55 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 193 G 8.87 4.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 194 D 8.20 4.50 0.00 2.86 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 0.00 195 S 7.82 4.45 0.00 3.93 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 0.00 196 G 8.74 4.43 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 0.00 197 G 8.05 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 0.00 198 P 0.00 4.81 0.00 1.54 1.07 0.00 3.72 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.71 0.00 199 W 9.08 4.97 0.00 3.00 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 0.00 200 L 9.14 5.35 0.00 1.58 1.83 1.22 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 201 T 8.80 4.61 4.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 201A G 8.77 3.65 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *207 S 8.61 4.77 0.00 4.05 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 0.00 208 Q 8.06 4.79 0.00 2.16 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.58 7.01 0.00 0.00 0.00 0.00 0.00 2.32 2.46 0.00 209 A 8.82 4.49 0.48 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 0.00 210 Q 9.56 4.37 0.00 1.71 1.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.71 0.00 0.00 0.00 0.00 0.00 2.44 2.45 0.00 211 G 7.07 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 0.00 212 V 8.13 5.53 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 1.04 0.00 0.00 1.22 0.00 0.00 213 T 9.20 4.62 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 1.51 0.00 0.00 214 S 8.63 4.59 0.00 4.06 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 215 G 7.15 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 0.00 216 G 7.89 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 0.00 217 T 8.05 4.67 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 1.28 0.00 0.00 218 G 10.44 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 0.00 219 D 8.03 4.79 0.00 3.11 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 219A C 9.04 4.62 0.00 3.09 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 0.00 220 R 8.19 4.04 0.00 1.77 2.05 0.00 3.19 0.00 0.00 3.22 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.64 0.00 222 S 8.67 4.50 0.00 3.86 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 0.00 223 G 8.33 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 224 G 7.47 4.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 225 I 7.66 4.92 1.63 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.69 0.85 0.00 0.00 226 T 8.50 5.26 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 1.42 0.00 0.00 227 F 9.53 5.21 0.00 3.09 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 0.00 228 F 8.22 5.30 0.00 2.65 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 0.00 229 Q 9.10 4.55 0.00 2.36 2.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.96 0.00 0.00 0.00 0.00 0.00 2.65 2.52 0.00 230 P 0.00 4.99 0.00 2.18 2.11 0.00 3.68 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 2.20 2.11 0.00 231 I 8.70 4.10 2.01 0.00 0.00 0.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.45 0.84 0.00 0.00 232 N 8.13 4.33 0.00 2.78 2.85 0.00 0.00 7.15 8.03 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 0.00 233 P 0.00 4.23 0.00 2.14 2.08 0.00 3.73 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.14 0.00 234 L 7.51 4.03 0.00 2.01 2.02 1.24 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 235 L 8.11 4.03 0.00 1.86 1.84 0.91 0.64 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 0.00 236 S 8.32 4.03 0.00 3.88 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 0.00 237 Y 8.00 3.82 0.00 2.86 2.38 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 0.00 238 F 7.94 4.92 0.00 3.18 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 0.00 239 G 7.75 3.85 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 0.00 0.00 0.00 240 L 7.97 4.68 0.00 1.36 1.29 0.51 -0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 241 Q 8.67 4.49 0.00 2.01 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.99 0.00 0.00 0.00 0.00 0.00 2.23 2.24 0.00 242 L 8.47 4.27 0.00 1.59 1.49 0.70 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 243 V 8.73 4.01 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 0.93 0.00 0.00 0.96 0.00 0.00 244 T 8.60 4.98 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 1.22 0.00 0.00 245 G 8.42 3.72 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 * Residues marked with a * may have inaccurate shift predictions.