NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 A 4.3808 8.2493 122.4650 51.3244 20.5217 175.1230 4 V 4.3541 8.7050 117.5755 60.9074 31.5836 173.4898 5 T 4.8923 8.8954 117.6658 60.8733 73.0201 173.3900 6 Q 5.5897 8.3635 117.2861 56.5309 32.8645 175.1665 7 S 4.8208 8.4588 117.8943 55.5967 62.5458 172.0594 8 P 4.8337 0.0000 0.0000 62.2605 31.9057 177.1846 9 R 4.3281 8.3713 118.4111 55.3061 32.0896 175.1669 10 N 4.1417 8.0148 113.2126 52.9749 35.4274 172.5808 11 K 4.2951 7.2844 116.5839 55.6262 35.4655 173.9117 12 V 4.5086 8.2366 122.3471 61.3496 34.0219 174.1424 13 A 4.8791 8.3304 125.0059 50.4061 22.9098 175.7528 14 V 4.6263 7.8754 111.8900 59.4055 35.7398 174.4226 15 T 3.8600 8.6378 117.4442 64.5597 69.1054 175.0704 16 G 3.8570 8.2234 117.9910 46.4061 0.0000 173.4820 17 G 3.3673 8.4801 108.0187 45.8783 0.0000 174.5838 18 K 4.9029 8.1491 116.3427 56.2569 36.2644 174.5725 19 V 4.1725 7.5913 123.5937 61.9116 34.5362 173.6965 20 T 4.7156 8.4422 125.4486 61.8195 70.2612 174.2387 21 L 4.6418 8.2350 126.6609 52.9872 45.9190 175.8124 22 S 4.8279 8.7808 120.0601 56.9208 65.4201 173.4687 23 C 6.0086 8.8322 124.9371 54.2650 47.7938 172.8160 24 N 5.1942 8.6377 121.8590 52.1237 42.1672 173.6566 25 Q 4.6589 8.5055 120.7265 55.4048 32.5060 174.4020 26 T 4.6806 7.5332 120.1849 62.4839 68.9040 171.9667 27 N 4.6591 7.8434 113.9430 53.3238 39.8759 172.7344 28 N 4.1806 8.1590 110.7742 54.8201 36.5335 173.1344 29 H 5.0012 7.8999 113.2257 53.9176 30.9487 174.4300 30 N 4.7758 8.8865 121.7934 54.0812 39.3454 173.9522 31 N 5.1008 7.8306 113.7976 52.7970 43.6326 173.0273 32 M 4.8928 8.7289 122.0529 52.9244 35.6106 173.8761 33 Y 5.1004 8.8665 121.5378 56.1025 42.5486 174.7490 34 W 5.0909 8.8605 119.7919 55.6398 33.2348 174.2715 35 Y 5.2039 8.9323 121.9586 56.2543 41.6056 174.3991 36 R 5.1343 8.7638 119.0353 55.2032 34.6635 173.7711 37 Q 5.4857 8.7116 122.1866 53.1563 31.2566 175.3599 38 D 4.8576 8.3677 124.7317 53.9660 42.2769 176.5678 39 T 3.1239 8.9800 114.7516 64.2241 67.7340 171.5071 40 G 4.0222 8.7027 112.5352 46.6871 0.0000 174.3685 41 H 4.8330 7.3781 112.9243 53.3117 30.4929 175.7113 42 G 4.1211 8.0077 110.6602 46.8833 0.0000 174.9931 43 L 4.2232 5.7043 116.8877 54.4654 43.8336 178.3878 44 R 4.2609 7.5772 118.6699 55.5528 32.2053 173.4384 45 L 4.4863 8.7050 129.6811 55.1972 43.0177 177.1050 46 I 4.5721 8.6491 115.7612 61.8342 41.2548 174.3352 47 H 5.0160 7.8706 117.6196 54.5042 33.8100 172.0410 48 Y 5.0172 7.3449 113.4032 56.7699 39.8182 173.0290 49 S 4.3797 8.1389 118.5366 56.4127 65.6092 173.6696 50 Y 4.5612 7.5641 121.8391 56.4387 39.7958 174.8651 51 G 4.0820 6.7487 107.4133 44.1464 0.0000 170.9803 52 A 4.4380 8.4592 121.4083 51.5643 20.7005 177.2340 53 G 3.8854 8.3732 108.3336 46.5206 0.0000 175.7473 54 S 4.3245 7.5384 112.7097 56.3039 63.0956 171.8560 55 T 4.4712 7.8281 114.4507 59.5562 70.7877 174.6240 56 E 4.6613 7.8342 121.5575 54.5218 33.6655 174.9569 57 K 4.2681 8.4751 120.5146 55.8192 35.5111 175.6402 58 G 3.9908 8.8492 111.2974 46.2869 0.0000 173.2230 59 D 4.6895 6.0500 118.3430 55.0549 43.5158 176.0364 60 I 4.6274 7.1039 110.8161 58.7599 37.4879 171.4900 61 P 4.2784 0.0000 0.0000 63.8886 32.1019 175.7311 62 D 4.3830 8.5630 113.4379 54.8741 44.9773 176.0779 63 G 3.7039 8.6548 114.4128 46.1679 0.0000 171.4835 *65 Y 5.0947 7.2651 116.9909 57.2932 39.8922 175.4255 66 K 4.3848 8.6686 120.7212 55.1732 35.7451 174.6198 67 A 5.0052 8.4311 127.6779 50.5733 22.8310 174.7785 68 S 4.5474 8.4122 113.2208 57.4237 68.0846 174.0107 69 R 5.0600 8.4234 122.9156 53.5652 29.2364 173.5700 70 P 4.2830 0.0000 0.0000 64.6919 31.8369 177.7754 71 S 4.7864 7.5773 112.8839 55.8674 66.4660 174.8370 72 Q 4.0931 8.7382 123.1994 58.6561 29.1158 177.0955 73 E 4.8273 8.0946 115.5459 56.0608 30.8186 174.6132 74 N 5.1590 7.7005 118.4701 52.0702 40.9890 173.9071 75 F 5.5244 8.8166 128.2087 57.0680 43.4577 173.0303 76 S 4.7573 8.1787 119.2891 57.1096 66.7229 172.7029 77 L 4.6790 7.9723 120.3956 55.1006 44.4428 173.5549 78 I 5.1172 8.6776 112.2146 59.8642 41.8800 173.5394 79 L 5.0023 8.1578 120.3222 52.7728 45.8662 176.9549 80 E 4.5224 8.3681 123.9392 55.4815 30.2791 176.7732 81 L 4.6092 7.7920 116.0997 54.3250 43.3731 172.8317 82 A 5.0673 8.0468 124.6812 49.6900 22.9632 175.3672 83 T 4.7401 8.1643 108.6051 58.7197 72.1094 173.3843 84 P 4.7514 0.0000 0.0000 61.4445 29.8486 175.8732 85 S 5.1160 7.2786 107.5153 59.2955 64.6423 176.8616 86 Q 4.4388 8.2234 116.8763 56.4651 32.8765 175.5482 87 T 4.1203 7.9574 113.3328 63.4702 69.3880 172.4178 88 S 4.6172 7.0371 111.3079 59.2456 68.4412 174.8670 89 V 4.7257 7.1888 119.9489 62.1982 33.3444 175.8229 90 Y 4.9676 9.3693 126.6862 57.6698 39.4312 174.5040 91 F 4.9871 9.4144 122.2337 55.7649 42.6941 173.0721 92 C 3.3283 8.6750 124.5024 54.5110 46.0152 172.2654 93 A 4.8241 7.9837 127.6093 50.3383 22.2327 174.4228 94 S 4.9701 8.2466 112.2861 57.4044 65.9373 173.2752 95 G 4.0170 8.6880 111.0602 45.3289 0.0000 172.4672 96 G 4.2815 8.6743 110.1476 44.3382 0.0000 173.2221 97 Q 3.9474 8.6757 117.6415 55.1209 27.8355 174.5538 98 G 3.7170 8.6675 107.6890 48.1632 0.0000 174.7867 99 R 4.1584 7.5883 121.0325 53.7970 29.2540 174.2672 *104 A 4.7772 7.6937 122.0764 51.5762 19.9643 176.6487 105 E 3.9367 8.5507 121.0961 55.6878 29.7253 176.7077 106 Q 3.8767 8.6475 126.1847 56.4787 29.5013 177.0929 107 F 4.4521 8.5874 127.4642 56.4049 37.1239 174.0722 108 F 4.0550 8.4396 119.6813 57.7079 39.5565 175.3109 109 G 4.2909 8.2119 115.0343 43.6824 0.0000 171.0879 110 P 4.5729 0.0000 0.0000 63.4247 32.1289 175.4568 111 G 3.8771 8.2562 106.0499 45.2918 0.0000 171.8422 112 T 4.9617 8.6443 116.2308 61.4036 72.2171 174.0164 113 R 4.9308 8.5446 120.5325 54.6012 31.3103 174.1838 114 L 4.8602 8.8307 122.9706 54.5186 44.4825 174.8775 115 T 4.7248 8.4951 115.9552 61.8339 72.0624 172.9550 116 V 4.9188 8.6744 125.7782 60.8855 33.4042 176.2187 116A L 4.2245 8.3373 128.6787 53.7772 43.4930 176.8036 *201 G 4.6051 8.3491 104.6557 46.2137 0.0000 173.9299 202 S 4.3393 7.9167 113.1588 57.2547 63.9602 174.1643 203 D 4.8431 8.3083 125.2857 53.6368 42.1720 175.1282 204 Y 4.3962 8.2210 115.4630 59.0980 41.2212 175.4607 205 K 4.5192 8.1019 119.2045 55.2991 33.6677 176.4709 206 D 5.0112 8.4572 125.1655 52.3411 41.1586 173.5111 207 D 4.8199 7.8798 119.7435 53.3536 42.9678 176.3955 208 D 4.7650 8.7537 123.7599 55.2422 38.6645 174.3023 209 D 4.6795 7.5135 119.2395 54.7294 40.8391 177.7908 210 K 4.3756 7.8374 119.9452 55.7506 29.9632 177.1995 211 R 4.6348 7.5915 120.5996 55.6788 30.2352 179.4833 212 S 4.5208 7.7996 114.9709 58.2899 62.1234 175.3935 213 G 3.9576 7.9688 118.1662 44.7698 0.0000 171.6862 214 G 3.7834 8.3737 100.0835 45.9096 0.0000 173.8961 215 G 3.8271 7.8387 109.8165 43.5701 0.0000 175.1979 216 G 3.8092 8.2478 116.7119 44.7820 0.0000 170.4196 217 S 4.6629 8.5262 113.4391 57.0164 63.9372 175.0205 218 G 3.6918 8.7532 116.1219 48.2147 0.0000 175.1501 219 G 3.9629 8.5757 106.5515 45.8470 0.0000 171.4320 220 G 4.2350 8.1700 106.6277 45.6744 0.0000 172.0686 221 G 4.9716 8.0231 119.6862 46.2555 0.0000 172.0815 222 S 4.3882 8.3806 120.7877 60.0636 64.7413 176.4466 223 G 3.8634 7.8569 110.3216 43.8685 0.0000 173.8934 224 G 3.7953 8.2401 111.4735 46.2451 0.0000 172.3794 225 S 4.5605 8.3092 116.9354 57.0396 65.6477 175.2113 226 G 3.8034 8.5259 116.6621 44.3304 0.0000 172.6347 227 A 4.4019 7.5156 122.6310 50.4780 20.9361 176.0830 *301 Q 4.2297 8.3524 122.7958 56.2655 29.9907 174.3357 301A Q 4.4478 8.5518 122.9736 54.5477 31.8425 173.2531 302 Q 4.4016 8.4029 119.4696 57.3248 31.2267 175.8705 303 V 4.4261 7.4631 115.8067 62.6041 32.1083 175.1897 304 R 4.5075 8.2619 125.5477 54.7916 33.1694 173.3735 305 Q 4.7154 8.6140 127.8484 55.0971 29.7144 175.3629 306 S 4.1988 8.8096 121.5601 61.2361 62.4510 173.5441 307 P 4.1808 0.0000 0.0000 64.5115 31.1667 175.4518 308 Q 3.1042 8.7196 119.0115 56.8965 26.3780 170.4690 309 S 3.8518 8.1734 121.1172 57.2346 64.3450 171.5091 310 L 4.2830 7.6311 120.2852 55.0592 46.0548 173.1458 311 T 5.7517 8.5960 119.3293 60.3643 68.1128 173.8863 312 V 4.0240 7.7857 125.0607 61.2336 33.6903 176.8995 313 W 4.8434 8.4427 120.5181 56.1492 30.6908 175.2547 314 E 4.4590 8.9174 118.4830 56.6453 30.3031 175.9834 315 G 3.8596 8.9312 110.2335 46.7561 0.0000 172.0333 316 E 4.7957 8.0285 119.2036 54.3429 34.2513 173.6720 317 T 4.8892 8.0715 115.6382 61.3926 70.8172 172.0132 318 T 5.0159 8.2990 118.2221 63.2425 73.2702 172.6372 319 I 4.9289 8.0003 113.9481 60.2708 40.9690 174.4665 320 L 4.7545 8.5859 122.2698 53.2404 45.6473 174.9881 321 N 5.5625 8.9028 122.0474 52.1101 41.9062 173.6421 322 C 5.5171 9.3591 124.2541 54.9827 49.1673 172.2610 323 S 5.0608 8.3117 116.5056 57.3193 66.7978 171.9169 324 Y 5.0760 7.4015 115.3215 56.4711 40.1477 173.9397 325 E 4.5678 8.7969 121.3193 56.1069 30.4357 175.1756 326 D 5.1643 8.4119 115.7466 52.6964 43.0774 175.8377 327 S 4.9269 8.2526 114.3123 58.3671 64.1404 175.5017 328 T 4.2472 7.8063 111.4086 61.6723 67.7019 172.3032 329 F 4.7396 7.3125 114.1409 55.4403 39.4822 175.2310 330 D 4.4211 8.5549 123.5009 56.6590 41.2545 175.8540 331 Y 4.4952 6.9926 114.1634 55.9070 41.0265 173.4276 332 F 5.4804 8.5995 118.1962 53.5598 40.0472 172.5329 333 P 4.8296 0.0000 0.0000 62.2547 30.8319 176.9191 334 W 4.5407 8.8757 127.7120 57.1630 26.9782 175.2542 335 Y 4.2440 8.6798 123.0071 58.0397 39.5957 174.5069 336 R 5.2608 8.8461 118.9025 55.7062 34.4406 173.5410 337 Q 4.7205 9.3507 124.5547 54.7428 31.3846 174.0208 338 F 4.8605 8.7871 124.3744 55.1122 41.2670 175.1286 339 P 4.5937 0.0000 0.0000 65.6686 32.9192 178.7000 340 G 3.9446 7.9321 106.3897 45.5912 0.0000 176.0281 341 K 4.6462 8.7982 113.5155 54.6801 35.2139 176.5303 342 S 4.7372 7.3282 111.7220 56.8242 64.3008 173.2601 343 P 4.5342 0.0000 0.0000 63.9385 32.6001 176.7282 344 A 4.7913 8.7557 119.2448 50.6307 22.8694 175.7308 345 L 2.9142 8.5372 124.0541 55.1209 42.3086 176.1478 346 L 4.4064 8.2355 126.5101 55.6681 42.9472 178.8234 347 I 4.4042 7.1128 111.3047 60.5091 39.8863 173.1222 348 A 4.8619 8.4469 123.8061 51.7744 21.7562 175.9652 349 I 4.4373 8.4241 122.9482 62.1000 38.4116 175.3188 350 S 4.5680 9.0283 114.3959 57.5339 65.8459 175.9886 351 L 3.5371 8.3887 120.1359 57.2106 39.3927 174.2327 352 V 4.3909 7.4650 112.9932 61.1159 33.0817 175.7958 353 S 4.6298 7.4311 115.6597 56.7158 66.7705 174.0488 354 N 4.4893 8.7756 122.2760 56.9719 39.5530 174.1841 355 K 4.8660 7.2766 114.1894 56.8681 35.9390 174.8039 356 K 4.7674 7.9965 119.3743 55.3536 37.3979 175.1532 357 E 4.9541 8.1003 117.3940 56.6399 31.9687 174.6692 358 D 4.3511 7.9360 124.6516 54.9332 41.8513 175.1080 359 G 4.2244 9.7461 120.2988 44.5895 0.0000 172.2042 361 R 4.6350 6.5948 116.5628 56.3835 37.7400 176.1777 362 F 4.6314 7.6590 112.7064 56.6589 39.2091 173.9278 363 T 5.1059 8.6608 114.7184 60.4186 71.2642 172.1793 364 I 5.1268 8.7153 118.0686 59.1642 41.0029 174.2991 365 F 5.1614 9.6229 121.3652 55.7355 43.3846 173.8703 366 F 5.2190 8.7031 123.2714 56.9906 40.7179 174.9510 367 N 4.5201 8.6282 125.4159 51.9444 38.8852 176.6127 368 K 3.4940 8.1700 124.3770 59.1437 32.5821 179.8522 369 R 3.6792 7.8923 116.9860 58.5466 29.9624 176.5249 370 E 4.3729 7.4124 114.4494 54.8370 31.2327 175.4396 371 K 3.8732 7.9153 119.0698 57.2251 31.2162 174.2947 372 K 4.9148 7.5558 114.4028 54.6790 37.6034 175.9131 373 L 5.1338 8.6722 121.7619 53.6316 43.6273 175.8555 374 S 5.3506 8.8081 121.0219 56.5884 65.7690 173.5666 375 L 5.3014 8.8794 124.4137 54.3280 43.9287 174.7564 376 H 4.9804 9.1535 115.2489 54.1524 32.0632 173.3278 377 I 4.1880 8.6426 126.0130 60.0052 38.0819 174.9128 378 T 4.8941 8.3223 122.8308 60.0229 69.4388 173.4705 379 D 4.2966 8.3366 122.3851 55.1132 38.6135 172.1483 380 S 4.8104 7.7814 116.1176 56.8955 65.5146 173.4608 381 Q 4.7312 8.0053 118.6606 53.3939 32.7637 175.2343 382 P 4.6880 0.0000 0.0000 63.4977 31.5693 175.6842 383 G 3.5738 8.7897 101.4126 48.5019 0.0000 173.4267 384 D 4.2366 8.5827 112.1614 53.9516 41.4384 176.4544 385 S 3.6610 8.2049 108.5262 56.3134 62.8378 172.9437 386 A 3.9742 5.8000 117.5539 51.7465 24.1501 177.3221 387 T 4.9154 7.1699 109.2511 59.4067 71.0743 173.0870 388 Y 5.1098 8.4885 123.4200 56.3874 40.8608 174.3532 389 F 4.6951 9.1135 121.3101 55.9791 41.9416 173.9413 390 C 4.0203 8.6503 124.6010 54.8563 39.2525 172.1632 391 A 4.9704 7.9773 127.1957 50.2723 22.4905 174.3063 392 A 4.9529 9.3124 118.9291 50.8668 23.1303 175.6743 393 T 4.2907 7.6271 109.3855 61.4721 71.3881 176.5835 *399 G 4.2278 8.7047 105.4234 45.3402 0.0000 171.5612 400 S 4.5542 7.4356 113.6688 56.6902 66.2961 172.3346 401 F 4.9868 8.5023 118.8162 58.1340 40.3149 175.5149 402 N 4.3528 8.8315 120.8901 54.8018 36.2456 174.9117 403 K 4.2348 8.1980 115.0006 57.9604 34.3983 177.0393 404 L 3.6056 7.9583 116.8805 55.6865 39.6821 171.3532 405 T 3.5810 8.9338 116.5535 63.5024 68.3714 173.6701 406 F 4.9800 7.1862 123.2723 55.2167 40.3256 173.6192 407 G 4.1838 8.4463 107.1172 44.8591 0.0000 172.9138 408 A 4.7057 8.1070 120.5376 52.6877 18.4868 178.6851 409 G 3.3182 7.9587 101.8129 45.3109 0.0000 172.6533 410 T 4.3841 8.0846 116.0352 61.8111 71.1801 174.3122 411 R 4.2668 8.4441 126.2050 54.6581 30.5409 173.5261 412 L 4.9115 8.2662 123.8552 53.7721 42.8617 175.9944 413 A 4.8775 8.9045 123.6317 49.1166 23.0196 174.8294 414 V 4.7724 8.3241 118.9337 61.3196 34.0453 175.4404 415 S 4.6163 8.2127 122.8380 56.7618 64.0494 172.8212 416 P 4.3077 0.0000 0.0000 65.0980 31.3381 175.8412 417 Y 4.2405 7.3871 124.2148 57.1998 38.4891 173.8187 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 8.25 4.38 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 4 V 8.70 4.35 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 0.88 0.00 0.00 1.01 0.00 0.00 5 T 8.90 4.89 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 1.25 0.00 0.00 6 Q 8.36 5.59 0.00 2.04 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 7.47 0.00 0.00 0.00 0.00 0.00 2.47 2.27 0.00 7 S 8.46 4.82 0.00 3.93 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 8 P 0.00 4.83 0.00 2.16 2.06 0.00 3.06 0.00 0.00 4.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.04 0.00 9 R 8.37 4.33 0.00 1.70 1.92 0.00 3.42 0.00 0.00 3.19 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.65 0.00 10 N 8.01 4.14 0.00 2.88 2.82 0.00 0.00 6.72 7.62 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 11 K 7.28 4.30 0.00 1.80 1.61 0.00 1.75 0.00 0.00 1.63 0.00 0.00 2.98 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.27 1.36 7.81 12 V 8.24 4.51 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 0.93 0.00 0.00 0.95 0.00 0.00 13 A 8.33 4.88 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 14 V 7.88 4.63 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 0.75 0.00 0.00 0.94 0.00 0.00 15 T 8.64 3.86 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 1.23 0.00 0.00 16 G 8.22 3.86 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 17 G 8.48 3.37 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 0.00 18 K 8.15 4.90 0.00 1.72 1.61 0.00 1.52 0.00 0.00 2.24 0.00 0.00 2.83 0.00 0.00 2.76 0.00 0.00 0.00 0.00 1.13 1.01 7.81 19 V 7.59 4.17 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 0.46 0.00 0.00 1.01 0.00 0.00 20 T 8.44 4.72 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 21 L 8.23 4.64 0.00 1.18 1.46 -0.09 0.42 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 22 S 8.78 4.83 0.00 3.73 3.73 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 23 C 8.83 6.01 0.00 3.36 3.31 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 24 N 8.64 5.19 0.00 2.94 2.75 0.00 0.00 6.43 8.20 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 25 Q 8.51 4.66 0.00 2.14 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.68 7.30 0.00 0.00 0.00 0.00 0.00 2.29 2.34 0.00 26 T 7.53 4.68 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 1.19 0.00 0.00 27 N 7.84 4.66 0.00 2.45 2.21 0.00 0.00 7.04 7.40 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 28 N 8.16 4.18 0.00 2.76 2.79 0.00 0.00 6.98 7.87 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 29 H 7.90 5.00 0.00 3.22 3.20 0.00 5.68 0.00 0.00 0.00 0.00 6.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 N 8.89 4.78 0.00 2.72 2.85 0.00 0.00 7.01 7.80 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 31 N 7.83 5.10 0.00 2.64 2.46 0.00 0.00 6.45 7.55 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 32 M 8.73 4.89 0.00 1.98 1.90 0.00 0.00 0.00 0.00 0.00 2.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.61 0.00 33 Y 8.87 5.10 0.00 3.10 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 34 W 8.86 5.09 0.00 3.53 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 35 Y 8.93 5.20 0.00 2.89 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 36 R 8.76 5.13 0.00 1.90 1.76 0.00 2.21 0.00 0.00 2.94 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 1.55 0.00 37 Q 8.71 5.49 0.00 2.14 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.68 0.00 0.00 0.00 0.00 0.00 2.13 2.12 0.00 38 D 8.37 4.86 0.00 2.59 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 39 T 8.98 3.12 4.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 40 G 8.70 4.02 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 49 S 8.14 4.38 0.00 2.83 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 50 Y 7.56 4.56 0.00 3.23 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 51 G 6.75 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 52 A 8.46 4.44 1.21 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 0.00 0.00 53 G 8.37 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 54 S 7.54 4.32 0.00 3.49 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 55 T 7.83 4.47 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 1.35 0.00 0.00 56 E 7.83 4.66 0.00 1.16 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 2.23 2.18 0.00 57 K 8.48 4.27 0.00 1.86 1.93 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0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.22 1.27 7.81 67 A 8.43 5.01 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 68 S 8.41 4.55 0.00 3.67 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 69 R 8.42 5.06 0.00 2.00 1.76 0.00 3.48 0.00 0.00 2.88 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.81 0.00 70 P 0.00 4.28 0.00 2.22 2.17 0.00 4.02 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.99 0.00 71 S 7.58 4.79 0.00 4.05 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 Q 8.74 4.09 0.00 1.99 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.92 0.00 0.00 0.00 0.00 0.00 2.23 2.32 0.00 73 E 8.09 4.83 0.00 2.07 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 0.00 2.49 2.23 0.00 74 N 7.70 5.16 0.00 2.86 2.71 0.00 0.00 6.44 7.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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0.00 0.00 0.00 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 84 P 0.00 4.75 0.00 2.18 2.17 0.00 3.18 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 2.07 0.00 85 S 7.28 5.12 0.00 3.81 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 86 Q 8.22 4.44 0.00 2.02 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.84 6.63 0.00 0.00 0.00 0.00 0.00 2.31 2.34 0.00 87 T 7.96 4.12 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 1.32 0.00 0.00 88 S 7.04 4.62 0.00 4.03 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 89 V 7.19 4.73 2.28 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 0.87 0.00 0.00 1.00 0.00 0.00 90 Y 9.37 4.97 0.00 3.17 3.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 91 F 9.41 4.99 0.00 3.03 2.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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1.48 0.00 *104 A 7.69 4.78 1.36 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 0.00 0.00 105 E 8.55 3.94 0.00 1.64 1.60 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 2.21 2.21 0.00 106 Q 8.65 3.88 0.00 2.30 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.86 7.14 0.00 0.00 0.00 0.00 0.00 1.45 2.23 0.00 107 F 8.59 4.45 0.00 3.10 3.11 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 0.00 108 F 8.44 4.06 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 0.00 109 G 8.21 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 0.00 0.00 0.00 0.00 110 P 0.00 4.57 0.00 2.11 2.12 0.00 3.82 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.03 0.00 111 G 8.26 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 112 T 8.64 4.96 4.37 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2.34 2.40 0.00 3.32 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 1.84 0.00 334 W 8.88 4.54 0.00 3.39 3.25 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 0.00 335 Y 8.68 4.24 0.00 2.95 2.95 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 0.00 336 R 8.85 5.26 0.00 1.96 1.94 0.00 3.19 0.00 0.00 3.50 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.36 0.00 337 Q 9.35 4.72 0.00 2.18 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.08 6.62 0.00 0.00 0.00 0.00 0.00 1.94 1.75 0.00 338 F 8.79 4.86 0.00 2.95 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 0.00 339 P 0.00 4.59 0.00 2.15 2.14 0.00 3.38 0.00 0.00 3.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 1.92 0.00 340 G 7.93 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 0.00 341 K 8.80 4.65 0.00 1.81 1.89 0.00 1.90 0.00 0.00 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0.00 0.00 0.00 1.91 1.10 1.15 0.00 0.00 350 S 9.03 4.57 0.00 3.84 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 0.00 351 L 8.39 3.54 0.00 2.03 1.78 1.18 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 352 V 7.47 4.39 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.80 0.00 0.00 0.89 0.00 0.00 353 S 7.43 4.63 0.00 3.78 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 0.00 354 N 8.78 4.49 0.00 2.90 2.84 0.00 0.00 6.68 6.40 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 0.00 355 K 7.28 4.87 0.00 1.26 1.22 0.00 1.40 0.00 0.00 1.27 0.00 0.00 2.84 0.00 0.00 2.75 0.00 0.00 0.00 0.00 1.19 1.09 7.81 356 K 8.00 4.77 0.00 1.63 1.65 0.00 1.72 0.00 0.00 1.85 0.00 0.00 2.88 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.36 1.40 7.81 357 E 8.10 4.95 0.00 1.71 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 2.05 2.02 0.00 358 D 7.94 4.35 0.00 2.47 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 0.00 359 G 9.75 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 0.00 0.00 0.00 0.00 361 R 6.59 4.63 0.00 1.76 1.92 0.00 3.25 0.00 0.00 3.30 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.58 0.00 362 F 7.66 4.63 0.00 2.99 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 0.00 363 T 8.66 5.11 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 1.42 0.00 0.00 364 I 8.72 5.13 1.91 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 1.32 0.88 0.79 0.00 0.00 365 F 9.62 5.16 0.00 3.26 3.06 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 0.00 366 F 8.70 5.22 0.00 2.96 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 0.00 367 N 8.63 4.52 0.00 2.92 2.66 0.00 0.00 6.70 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 0.00 368 K 8.17 3.49 0.00 1.67 1.71 0.00 1.76 0.00 0.00 1.97 0.00 0.00 2.83 0.00 0.00 3.07 0.00 0.00 0.00 0.00 0.52 1.16 7.81 369 R 7.89 3.68 0.00 1.71 1.91 0.00 3.16 0.00 0.00 3.19 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.63 0.00 370 E 7.41 4.37 0.00 1.95 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 2.19 2.15 0.00 371 K 7.92 3.87 0.00 1.80 1.72 0.00 1.76 0.00 0.00 1.62 0.00 0.00 2.57 0.00 0.00 2.39 0.00 0.00 0.00 0.00 1.41 1.47 7.81 372 K 7.56 4.91 0.00 1.68 1.98 0.00 1.66 0.00 0.00 1.89 0.00 0.00 2.79 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.33 1.50 7.81 373 L 8.67 5.13 0.00 1.74 1.80 0.58 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 374 S 8.81 5.35 0.00 3.77 3.73 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 0.00 375 L 8.88 5.30 0.00 1.74 1.53 0.60 -0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 376 H 9.15 4.98 0.00 3.16 3.25 0.00 5.60 0.00 0.00 0.00 0.00 6.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 377 I 8.64 4.19 1.60 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 1.04 1.29 0.89 0.00 0.00 378 T 8.32 4.89 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 1.24 0.00 0.00 379 D 8.34 4.30 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 0.00 380 S 7.78 4.81 0.00 4.10 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 0.00 381 Q 8.01 4.73 0.00 2.11 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.83 6.83 0.00 0.00 0.00 0.00 0.00 2.38 2.40 0.00 382 P 0.00 4.69 0.00 2.06 2.05 0.00 4.05 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 1.99 0.00 383 G 8.79 3.57 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 0.00 0.00 0.00 384 D 8.58 4.24 0.00 2.81 2.52 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 0.00 385 S 8.20 3.66 0.00 4.03 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 0.00 386 A 5.80 3.97 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 387 T 7.17 4.92 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 1.06 0.00 0.00 388 Y 8.49 5.11 0.00 3.22 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 0.00 389 F 9.11 4.70 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 0.00 390 C 8.65 4.02 0.00 1.65 2.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 391 A 7.98 4.97 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 0.00 392 A 9.31 4.95 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 393 T 7.63 4.29 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 0.77 0.00 0.00 *399 G 8.70 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 0.00 0.00 0.00 0.00 400 S 7.44 4.55 0.00 3.75 3.73 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 0.00 401 F 8.50 4.99 0.00 3.13 2.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 402 N 8.83 4.35 0.00 2.09 1.42 0.00 0.00 6.98 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 0.00 403 K 8.20 4.23 0.00 1.68 1.79 0.00 1.90 0.00 0.00 1.63 0.00 0.00 2.97 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.40 1.30 7.81 404 L 7.96 3.61 0.00 1.80 1.94 0.92 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 405 T 8.93 3.58 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 1.09 0.00 0.00 406 F 7.19 4.98 0.00 3.10 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 0.00 407 G 8.45 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 0.00 0.00 0.00 0.00 408 A 8.11 4.71 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 409 G 7.96 3.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 410 T 8.08 4.38 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 1.22 0.00 0.00 411 R 8.44 4.27 0.00 1.79 1.75 0.00 3.11 0.00 0.00 3.30 7.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.53 0.00 412 L 8.27 4.91 0.00 1.93 1.66 0.94 0.67 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 0.00 413 A 8.90 4.88 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 0.00 414 V 8.32 4.77 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 1.03 0.00 0.00 1.04 0.00 0.00 415 S 8.21 4.62 0.00 3.52 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 0.00 416 P 0.00 4.31 0.00 2.18 2.16 0.00 3.70 0.00 0.00 3.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.92 0.00 417 Y 7.39 4.24 0.00 2.75 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 * Residues marked with a * may have inaccurate shift predictions.