NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 D 4.5789 8.3649 120.1912 53.7720 42.6123 174.1532 2 V 3.9467 8.0187 112.4417 60.5651 32.6880 173.9969 3 K 5.0708 9.3685 126.0527 54.5631 36.0707 174.5083 4 L 4.9258 8.7394 128.4004 53.7793 44.8666 175.7337 5 V 4.2404 8.5693 128.3956 61.2773 32.5606 175.0386 6 E 4.9304 8.9358 127.9331 55.8732 30.5817 176.6060 7 S 4.4997 8.5323 112.4609 59.7533 63.6686 177.0895 8 G 3.4203 8.5342 106.3457 44.6978 0.0000 175.4046 9 G 3.9216 8.2074 101.4114 44.3157 0.0000 173.1211 10 G 3.8971 7.5253 107.9081 45.9688 0.0000 171.0483 11 L 4.8219 8.2982 121.7212 55.0784 43.0397 176.6247 12 V 4.5606 8.5773 123.7420 61.2911 35.4734 174.0514 13 Q 4.8302 8.9988 126.1839 54.3103 30.0660 173.9797 14 P 4.5129 0.0000 0.0000 64.3625 31.6690 175.9750 15 G 4.0082 9.4009 111.7386 45.3387 0.0000 173.8824 16 G 4.0617 8.1814 107.2000 45.6709 0.0000 172.3479 17 S 5.1133 8.2453 113.2765 56.8864 66.5007 173.2761 18 R 4.5477 7.9689 117.1822 55.0073 34.9892 174.7401 19 K 4.6786 8.1741 121.9295 54.8208 34.6860 175.7970 20 L 4.4720 8.6024 128.3469 54.5118 43.3677 176.3294 21 S 5.2889 8.6582 115.3332 57.1907 67.8284 174.0157 22 C 5.2387 8.8564 121.6844 55.1514 47.9337 172.8429 23 A 4.3948 9.1362 130.2992 50.6547 19.4605 175.7287 24 A 4.8837 8.2127 125.2159 52.0443 19.9267 176.5402 25 S 4.2293 9.1684 114.9122 58.1008 66.5942 175.6337 26 G 4.0318 10.6277 109.3207 45.2727 0.0000 172.7730 27 F 4.8417 7.0071 112.2376 55.8435 40.7566 175.0603 28 T 4.1951 8.5871 118.1103 62.3704 66.9865 175.1054 29 F 3.9568 8.5611 128.9322 61.1413 39.3881 177.7609 30 S 4.1244 8.2947 112.6587 60.4202 62.6150 174.7367 31 S 4.5642 8.1394 114.4399 57.8218 62.9961 173.4903 32 F 4.8895 8.0458 118.6596 55.8750 42.6822 174.9708 33 G 4.1233 8.6390 107.8403 45.5481 0.0000 172.2787 34 M 5.3740 8.3651 119.0355 53.7503 36.9177 174.1428 35 H 5.7944 9.1361 116.8074 54.0507 33.9189 172.5648 36 W 5.3249 9.0700 119.2063 55.1090 32.3787 174.9457 37 V 5.1721 9.5058 124.6585 61.1601 34.7498 174.2776 38 R 5.1677 9.2113 121.6104 54.7063 33.8097 173.9984 39 Q 4.6553 8.7769 120.3378 54.5046 32.1543 174.3012 40 A 4.4577 8.8626 129.7425 51.3567 18.5979 174.9279 41 P 3.9237 0.0000 0.0000 65.7293 32.0516 176.2835 42 E 4.6410 7.9237 118.7519 56.6389 30.3879 176.1036 43 K 4.6549 7.9170 117.1281 54.4162 35.6260 176.1467 44 G 3.9886 8.2527 109.6581 43.9417 0.0000 173.2952 45 L 4.3316 8.2157 118.7111 55.6323 42.3922 177.0607 46 E 4.7631 9.2496 122.1959 54.3148 33.2582 174.2822 47 W 4.6706 9.1623 135.0000 57.9766 31.5016 174.5835 48 V 4.0031 8.1385 124.9656 63.5512 33.1823 174.9114 49 A 4.4774 6.4751 119.1162 50.9709 22.4555 173.8186 50 Y 5.5072 9.3331 120.9403 56.0141 42.9636 174.2926 51 I 4.5053 7.3364 124.9241 58.9840 41.5710 174.8025 52 S 4.5125 8.5672 124.7194 57.8591 63.8345 175.6289 52A S 3.8911 8.6735 115.0727 60.7744 62.7984 175.3184 53 G 3.7055 7.9804 108.4125 45.0705 0.0000 174.3483 54 S 3.7795 8.0306 114.8579 59.2776 61.0870 173.2921 55 S 4.3575 7.6015 115.4802 59.9577 63.5152 174.3889 56 T 4.6058 8.0233 118.0558 61.5584 71.3844 173.5853 57 I 4.7371 7.8759 125.5371 60.0139 41.0684 173.9456 58 Y 5.2636 8.9511 124.7746 56.5788 41.3280 174.4552 59 Y 5.3269 8.7769 118.3713 55.9992 42.1726 175.2176 60 A 4.5081 8.9898 125.2723 52.0478 19.2667 178.4988 61 D 4.4241 9.0425 120.0804 57.8528 41.3359 178.5235 62 T 3.9588 8.1374 114.6481 66.3546 68.6518 175.2826 63 V 3.7258 7.3357 111.3738 60.2879 32.1713 175.2313 64 K 3.9923 7.5367 122.8432 58.2932 31.9936 176.9292 65 G 3.9825 8.8556 115.4209 44.9777 0.0000 173.3049 66 R 4.6637 8.1461 116.6271 55.6387 33.1828 175.4582 67 F 5.8250 8.1538 116.0011 55.0871 42.3255 175.2834 68 T 4.6771 8.1935 117.2252 61.9713 71.9347 172.9129 69 I 4.8670 8.9630 127.5014 60.8050 39.2993 174.7014 70 S 4.9451 8.9245 121.3354 58.0464 66.8680 172.7118 71 R 5.0961 8.4446 114.7777 55.4248 32.2344 174.4997 72 D 4.8574 9.4191 121.1986 52.3615 42.2245 175.7689 73 N 4.7007 9.0750 123.8085 55.7600 38.8098 175.3598 74 P 4.5136 0.0000 0.0000 63.6413 31.6326 176.2510 75 K 4.3562 8.1735 119.8041 55.3200 32.6947 175.3333 76 N 3.5483 7.3457 113.6333 54.4867 36.9978 173.5286 77 T 4.7199 6.7142 111.7948 61.4318 72.6704 173.2706 78 L 5.1891 8.0783 125.0552 53.4733 45.8038 175.1656 79 F 5.8406 9.3620 121.9418 54.9071 44.1750 174.1303 80 L 4.4361 8.1899 121.9282 54.0437 44.6203 174.5809 81 Q 4.4602 8.9129 130.0660 55.3851 29.6969 174.8627 82 M 3.6788 8.9070 128.0576 55.0566 33.7549 175.6626 82A T 4.1973 7.7976 114.5949 63.0903 73.3646 173.2461 82B S 3.7351 8.7011 117.0382 59.3547 60.6371 173.5338 82C L 4.1639 7.8271 120.4183 55.2686 41.7034 177.9597 83 R 4.6813 8.5215 120.8832 54.1937 31.7359 177.5475 84 S 4.2191 8.5306 112.2637 61.4178 63.0121 176.2357 85 E 4.2732 8.2433 119.0611 58.6069 29.2329 177.2276 86 D 4.7669 7.8144 117.1236 55.3254 41.3964 176.5225 87 T 4.3634 8.3815 117.4350 64.3323 68.9868 173.5768 88 A 4.3301 8.5432 126.8662 51.8206 23.9939 173.9990 89 M 4.7236 8.2971 119.2989 55.0096 34.0067 174.3692 90 Y 5.1924 9.2301 124.4187 56.7202 40.3541 174.2353 91 Y 5.3904 9.5749 122.3648 56.3310 41.4078 172.7804 92 C 4.3658 8.4530 118.2813 54.3880 43.1789 172.8009 93 A 4.7781 8.2746 120.4717 50.3479 22.6598 176.0235 94 R 4.0928 8.5060 120.7340 55.7822 31.0422 177.5919 95 G 3.8133 8.6743 113.1147 48.3462 0.0000 174.1614 96 D 4.8139 8.1463 117.1355 52.3616 39.6937 175.8714 97 Y 3.7809 7.6730 115.6219 59.0023 36.1162 170.2810 98 Y 3.8640 7.4840 119.1259 57.3604 39.2983 175.7871 99 G 3.4973 8.0068 116.2726 45.9579 0.0000 172.4816 100 S 5.1105 8.3208 120.2206 56.2587 65.6734 174.3789 100A R 4.0919 9.0742 121.6603 56.2145 30.9065 176.1994 100B G 4.2730 8.4723 110.1189 46.2590 0.0000 173.0023 101 A 4.1457 8.1326 126.8218 50.1953 20.3849 177.6134 102 Y 4.5228 7.8795 120.5805 60.4181 38.9153 177.8131 103 W 4.5317 7.8447 115.9986 56.8111 29.7187 177.3083 104 G 4.0436 6.0831 106.8031 45.6073 0.0000 170.6406 105 Q 4.7883 8.3627 123.3295 55.5415 32.2422 176.4296 106 G 3.3347 10.8821 111.5081 45.3799 0.0000 171.6833 107 T 4.2815 7.5921 110.4929 61.1850 71.3387 173.2705 108 L 4.8001 8.5162 131.8512 54.9602 44.0130 175.7067 109 V 4.9655 8.7297 118.2053 60.0318 35.8465 174.3899 110 T 4.8829 8.6170 121.7254 60.9913 71.2361 173.7580 111 V 4.8462 8.1216 126.1843 61.4256 31.9766 174.2158 112 S 4.4936 8.8824 126.4417 58.6483 67.3242 173.1628 113 A 4.2041 8.7420 126.3046 52.5958 16.5935 180.2443 110 K 4.8529 8.7570 128.5254 55.3913 34.5361 175.6580 111 T 5.0762 8.2416 120.5843 61.0256 68.8766 172.6158 112 T 4.3736 8.7224 124.3417 62.1483 73.3242 173.2628 113 A 4.2041 8.7420 126.3046 52.5958 16.5935 180.2443 119 P 4.9716 0.0000 0.0000 62.6117 33.4469 175.4946 120 S 4.4217 8.7867 115.1935 56.6218 65.7059 173.7624 121 V 4.2834 8.0646 125.4726 61.9653 32.3832 174.6157 122 Y 5.1979 9.2077 125.8086 55.5761 41.4564 172.8438 123 P 4.9620 0.0000 0.0000 62.0873 33.1627 175.2807 124 L 4.6481 8.9119 124.0841 53.4197 43.2223 175.5726 125 A 4.5275 8.3123 125.6766 50.7471 22.0399 175.8124 126 P 4.3622 0.0000 0.0000 61.8791 30.8568 178.9437 127 V 3.9034 9.2364 126.4496 62.4130 31.9066 172.5635 128 C 4.4409 7.4563 110.6145 60.5221 31.6021 176.8852 129 G 3.6865 7.6779 108.6637 48.5696 0.0000 174.5628 130 D 4.1875 7.1937 114.2140 55.6989 42.4995 178.9773 *133 T 4.5811 7.4269 114.6203 61.3208 70.0421 173.5259 134 T 4.3316 8.2128 118.1473 63.3765 74.9934 173.6555 135 G 4.1805 6.6124 112.1810 46.8938 0.0000 174.2307 136 S 4.3741 8.5066 121.9049 58.2331 62.4888 172.4913 137 S 5.2772 8.1568 116.5090 56.4145 65.6031 173.1065 138 V 4.5653 8.4009 123.2434 60.1637 33.6066 174.6396 139 T 4.9920 8.3643 113.6838 59.9893 71.0738 173.2627 140 L 4.6346 8.6142 123.4275 52.9530 46.3356 175.1205 141 G 4.6627 8.8290 106.6914 45.4406 0.0000 170.5005 142 C 5.5230 9.3612 118.4937 55.1573 45.9603 172.2576 143 L 5.1553 9.4016 128.4439 53.3698 44.5607 175.0326 144 V 4.7336 9.2031 127.7845 61.2887 32.8765 174.3640 145 K 4.7880 8.8000 127.4467 54.8321 36.1826 175.6499 146 G 4.0093 8.5558 106.8715 47.1651 0.0000 172.0571 147 Y 5.2499 7.6428 116.1058 55.4733 42.4540 175.8069 148 F 5.1281 8.8262 119.2332 57.1745 42.4101 171.7238 149 P 3.4863 0.0000 0.0000 60.8575 33.7314 174.8113 150 E 4.1056 8.1070 118.6664 55.7321 29.9819 174.4301 151 P 4.6806 0.0000 0.0000 61.2655 33.6052 174.4599 152 V 4.3663 7.4929 117.4204 61.2843 34.1936 174.5298 153 T 4.5672 8.9642 123.9946 61.8029 70.9162 173.3352 154 L 5.6890 8.3224 127.1125 52.3454 45.7426 175.3833 *156 T 4.8582 8.2872 114.8316 61.6391 71.1332 172.1623 157 W 4.8131 8.2994 120.3828 54.2601 32.4062 176.3697 *162 N 4.4992 8.2314 122.4962 55.0696 39.1821 174.4701 163 S 3.7136 10.1711 106.5322 59.4141 61.6969 174.4360 164 G 4.0449 8.1093 109.3247 45.5815 0.0000 175.9678 165 S 4.0889 8.3423 115.7583 61.1861 62.8553 174.3601 166 L 4.3868 7.8579 123.4780 54.0504 41.1452 175.4139 167 S 4.6319 8.4493 120.2852 58.2365 65.1789 174.5545 168 S 4.2638 7.9743 115.1637 58.5479 63.2343 173.8575 169 G 3.6890 8.5466 114.5215 45.8082 0.0000 172.7202 *171 V 4.6039 7.2916 117.4261 61.7705 32.7486 174.5759 172 H 4.6454 8.8687 119.7885 54.2593 32.1513 172.5157 173 T 4.8074 8.2628 120.1817 61.6027 69.8514 174.1061 174 F 4.4772 8.7378 126.6843 56.0726 39.6169 174.3167 175 P 4.3006 0.0000 0.0000 63.0382 31.4416 175.8760 176 A 4.5337 8.5378 122.0800 52.4170 19.3281 176.8879 177 V 4.4011 8.5549 120.3696 60.8854 34.5345 174.3285 178 L 4.1945 8.6975 130.6824 54.5270 42.7893 175.3650 179 Q 4.4582 8.6719 128.4780 54.8878 32.1815 175.2162 180 S 3.9224 8.7850 124.0468 60.1312 60.5210 171.6268 *183 D 4.9235 8.7482 123.6825 54.9644 41.9646 174.6320 184 L 5.0440 7.6190 116.5526 53.3703 46.5777 175.6087 185 Y 5.0973 8.6312 118.7118 55.8947 40.9913 175.0115 186 T 5.1798 8.2212 117.1480 62.0283 73.1414 172.6379 187 L 5.3337 9.8310 127.0848 54.1413 46.6533 174.6316 188 S 5.2655 8.5265 114.7248 57.4769 66.4793 173.0277 189 S 5.5259 9.5419 116.2383 56.7979 65.9965 172.6550 190 S 5.5211 9.2789 121.3496 56.5548 65.9510 173.2586 191 V 4.4992 8.4646 121.1526 60.0912 34.4918 174.3136 192 T 4.8124 8.3416 120.1251 62.1159 70.5437 173.7941 193 V 4.5481 8.2685 119.7028 59.1727 35.8670 175.3580 194 T 4.4504 8.2511 111.1974 60.9723 69.5821 175.9170 195 S 4.3378 8.4648 118.3408 61.5314 62.9811 176.1308 196 S 4.1905 7.4278 116.3869 61.3476 63.1313 175.5006 *198 T 4.8816 7.7703 115.4631 62.9397 70.0717 173.1174 199 W 5.0313 7.5276 128.5116 55.3100 32.0692 174.4781 200 P 2.9955 0.0000 0.0000 63.9396 30.4518 177.3833 *202 S 4.3317 7.2359 113.6084 58.5136 65.2467 173.3434 203 Q 4.3461 9.0539 118.0193 55.7122 29.9940 175.5998 204 S 4.6041 8.8521 119.5492 58.5866 64.0444 173.4247 205 I 4.9238 8.8265 124.5446 59.8621 40.0078 174.6366 206 T 5.3235 9.3189 122.7409 60.7758 72.9771 172.1634 *208 C 4.3846 8.4105 122.3663 56.5411 46.4718 171.8559 209 N 5.4591 8.5780 123.6979 50.6428 40.7171 173.7990 210 V 4.8432 8.9448 123.6776 60.9291 35.3092 174.3025 211 A 4.7384 8.8976 128.3321 50.9322 22.2870 174.6589 212 H 4.7659 8.7008 124.3641 53.3711 29.1664 172.8022 213 P 4.0164 0.0000 0.0000 65.1531 31.5436 178.3506 214 A 4.0120 7.7392 118.3593 54.3242 17.7146 177.9875 215 S 4.5020 8.0636 107.7337 57.2270 64.9681 174.4837 216 S 3.6245 8.1633 115.8702 60.1891 60.8119 171.7941 217 T 4.4313 7.0304 112.9043 62.6655 70.2464 174.9079 218 K 4.5196 8.3412 126.9277 55.9748 34.2749 174.9539 219 V 4.5491 8.9282 121.6302 59.4663 35.7241 174.5781 220 D 5.2870 8.5722 123.0348 52.3277 43.7196 174.7433 221 K 4.4249 9.1600 124.9196 54.3177 34.8821 174.7087 222 K 4.6937 8.7398 129.6391 56.0923 33.1079 175.9720 223 I 4.4190 8.5843 129.0576 60.8231 37.7753 175.3689 224 E 5.0010 8.9542 125.7880 53.4684 32.8500 173.9605 225 P 4.5427 0.0000 0.0000 63.9144 32.7240 175.1286 226 R 4.6595 7.8712 118.5032 54.8705 29.7408 175.2183 227 G 4.3267 8.3621 114.4285 47.2067 0.0000 171.9734 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 1 D 8.36 4.58 0.00 2.67 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 2 V 8.02 3.95 1.97 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 0.01 0.00 0.00 0.86 0.00 0.00 3 K 9.37 5.07 0.00 1.74 1.55 0.00 1.41 0.00 0.00 1.45 0.00 0.00 2.65 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.23 1.37 7.81 4 L 8.74 4.93 0.00 1.65 1.51 1.11 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 5 V 8.57 4.24 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.00 0.00 0.76 0.00 0.00 6 E 8.94 4.93 0.00 2.18 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 0.00 2.69 2.42 0.00 7 S 8.53 4.50 0.00 3.87 4.10 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 8 G 8.53 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 0.00 0.00 0.00 9 G 8.21 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 10 G 7.53 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 0.00 0.00 0.00 11 L 8.30 4.82 0.00 1.72 1.63 1.28 1.03 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 12 V 8.58 4.56 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 0.93 0.00 0.00 0.93 0.00 0.00 13 Q 9.00 4.83 0.00 2.02 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.85 0.00 0.00 0.00 0.00 0.00 2.46 2.15 0.00 14 P 0.00 4.51 0.00 2.19 2.10 0.00 3.74 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 2.00 1.98 0.00 15 G 9.40 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 16 G 8.18 4.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 S 8.25 5.11 0.00 3.98 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 18 R 7.97 4.55 0.00 1.43 1.52 0.00 3.09 0.00 0.00 2.98 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.57 0.00 19 K 8.17 4.68 0.00 1.78 1.55 0.00 1.72 0.00 0.00 1.53 0.00 0.00 2.13 0.00 0.00 2.38 0.00 0.00 0.00 0.00 1.30 1.37 7.81 20 L 8.60 4.47 0.00 1.05 1.45 0.03 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 21 S 8.66 5.29 0.00 3.85 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 22 C 8.86 5.24 0.00 2.84 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 23 A 9.14 4.39 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 0.00 0.00 0.00 0.00 0.00 0.00 24 A 8.21 4.88 0.98 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 0.00 0.00 25 S 9.17 4.23 0.00 3.77 3.79 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 26 G 10.63 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 27 F 7.01 4.84 0.00 2.98 2.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 T 8.59 4.20 4.47 0.00 0.00 0.00 0.00 0.00 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 29 F 8.56 3.96 0.00 2.67 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 30 S 8.29 4.12 0.00 4.01 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 31 S 8.14 4.56 0.00 3.54 3.82 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 32 F 8.05 4.89 0.00 2.95 2.94 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 33 G 8.64 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 34 M 8.37 5.37 0.00 1.79 1.79 0.00 0.00 0.00 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.43 2.45 0.00 35 H 9.14 5.79 0.00 3.14 3.49 0.00 5.75 0.00 0.00 0.00 0.00 6.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 W 9.07 5.32 0.00 3.35 3.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 V 9.51 5.17 2.36 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 1.26 0.00 0.00 1.32 0.00 0.00 38 R 9.21 5.17 0.00 1.15 1.21 0.00 2.98 0.00 0.00 2.96 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.64 0.00 39 Q 8.78 4.66 0.00 2.23 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.98 0.00 0.00 0.00 0.00 0.00 2.31 2.50 0.00 40 A 8.86 4.46 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 P 0.00 3.92 0.00 2.11 2.07 0.00 3.72 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.23 0.00 42 E 7.92 4.64 0.00 1.98 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 2.28 2.36 0.00 43 K 7.92 4.65 0.00 1.85 1.70 0.00 1.72 0.00 0.00 1.73 0.00 0.00 3.05 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.38 1.37 7.81 44 G 8.25 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 0.00 0.00 0.00 45 L 8.22 4.33 0.00 1.54 1.68 0.82 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 46 E 9.25 4.76 0.00 2.02 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 2.35 0.00 47 W 9.16 4.67 0.00 3.43 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 48 V 8.14 4.00 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 1.00 0.00 0.00 1.04 0.00 0.00 49 A 6.48 4.48 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 50 Y 9.33 5.51 0.00 3.82 3.45 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 51 I 7.34 4.51 1.74 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 1.10 1.33 0.77 0.00 0.00 52 S 8.57 4.51 0.00 3.88 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52A S 8.67 3.89 0.00 3.98 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 53 G 7.98 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 54 S 8.03 3.78 0.00 3.99 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 55 S 7.60 4.36 0.00 4.01 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 56 T 8.02 4.61 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 0.78 0.00 0.00 57 I 7.88 4.74 1.76 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.39 0.44 0.00 0.00 58 Y 8.95 5.26 0.00 3.51 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 59 Y 8.78 5.33 0.00 2.92 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 60 A 8.99 4.51 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 61 D 9.04 4.42 0.00 2.73 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 62 T 8.14 3.96 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 1.15 0.00 0.00 63 V 7.34 3.73 0.67 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 -0.20 0.00 0.00 0.80 0.00 0.00 64 K 7.54 3.99 0.00 2.02 1.87 0.00 1.93 0.00 0.00 1.93 0.00 0.00 3.15 0.00 0.00 3.21 0.00 0.00 0.00 0.00 1.50 1.44 7.81 65 G 8.86 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 0.00 0.00 0.00 66 R 8.15 4.66 0.00 2.02 2.36 0.00 3.15 0.00 0.00 3.20 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.59 0.00 67 F 8.15 5.83 0.00 2.62 2.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 68 T 8.19 4.68 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 1.31 0.00 0.00 69 I 8.96 4.87 2.09 0.00 0.00 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.28 0.85 0.00 0.00 70 S 8.92 4.95 0.00 4.12 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 71 R 8.44 5.10 0.00 2.17 2.01 0.00 2.86 0.00 0.00 3.13 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.70 0.00 72 D 9.42 4.86 0.00 3.03 2.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 73 N 9.07 4.70 0.00 2.87 2.97 0.00 0.00 6.79 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 74 P 0.00 4.51 0.00 2.19 2.18 0.00 3.80 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 1.98 0.00 75 K 8.17 4.36 0.00 1.87 2.03 0.00 1.93 0.00 0.00 1.75 0.00 0.00 3.18 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.32 1.37 7.81 76 N 7.35 3.55 0.00 2.59 2.44 0.00 0.00 6.77 6.94 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 77 T 6.71 4.72 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 0.41 0.00 0.00 78 L 8.08 5.19 0.00 1.89 1.48 1.07 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 79 F 9.36 5.84 0.00 3.08 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 80 L 8.19 4.44 0.00 0.34 0.50 0.51 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.46 0.00 0.00 0.00 0.00 0.00 0.00 81 Q 8.91 4.46 0.00 2.13 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.74 6.64 0.00 0.00 0.00 0.00 0.00 2.22 2.23 0.00 82 M 8.91 3.68 0.00 1.05 1.53 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.14 0.00 82A T 7.80 4.20 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 1.18 0.00 0.00 82B S 8.70 3.74 0.00 4.02 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 82C L 7.83 4.16 0.00 1.84 1.64 0.77 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 83 R 8.52 4.68 0.00 2.13 2.11 0.00 3.01 0.00 0.00 3.48 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.80 0.00 84 S 8.53 4.22 0.00 4.08 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 0.00 85 E 8.24 4.27 0.00 2.01 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 0.00 2.35 2.44 0.00 86 D 7.81 4.77 0.00 3.00 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 87 T 8.38 4.36 4.36 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 1.36 0.00 0.00 88 A 8.54 4.33 1.11 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 89 M 8.30 4.72 0.00 2.21 1.95 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.15 0.00 90 Y 9.23 5.19 0.00 3.12 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 91 Y 9.57 5.39 0.00 2.99 2.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 92 C 8.45 4.37 0.00 2.14 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 93 A 8.27 4.78 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 94 R 8.51 4.09 0.00 1.48 1.65 0.00 2.21 0.00 0.00 2.25 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 1.17 0.00 95 G 8.67 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 96 D 8.15 4.81 0.00 2.93 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 97 Y 7.67 3.78 0.00 3.16 3.04 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 98 Y 7.48 3.86 0.00 3.00 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 99 G 8.01 3.50 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 0.00 0.00 0.00 0.00 100 S 8.32 5.11 0.00 3.89 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 100A R 9.07 4.09 0.00 1.84 1.86 0.00 3.09 0.00 0.00 3.18 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.61 0.00 100B G 8.47 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 0.00 101 A 8.13 4.15 -0.54 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 0.00 102 Y 7.88 4.52 0.00 2.75 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 0.00 103 W 7.84 4.53 0.00 3.37 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 0.00 104 G 6.08 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 0.00 0.00 0.00 105 Q 8.36 4.79 0.00 2.07 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.42 0.00 0.00 0.00 0.00 0.00 2.35 2.66 0.00 106 G 10.88 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 0.00 0.00 0.00 107 T 7.59 4.28 4.36 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 1.44 0.00 0.00 108 L 8.52 4.80 0.00 1.81 1.49 1.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 109 V 8.73 4.97 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.68 0.00 0.00 0.90 0.00 0.00 110 T 8.62 4.88 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 1.35 0.00 0.00 111 V 8.12 4.85 2.15 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 1.23 0.00 0.00 1.03 0.00 0.00 112 S 8.88 4.49 0.00 4.12 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 0.00 113 A 8.74 4.20 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 110 K 8.76 4.85 0.00 1.65 1.50 0.00 0.95 0.00 0.00 1.67 0.00 0.00 2.13 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.36 1.06 7.81 111 T 8.24 5.08 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 1.31 0.00 0.00 112 T 8.72 4.37 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 113 A 8.74 4.20 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 119 P 0.00 4.97 0.00 2.04 2.02 0.00 3.70 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 1.78 0.00 120 S 8.79 4.42 0.00 3.42 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 0.00 121 V 8.06 4.28 1.94 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 0.67 0.00 0.00 0.78 0.00 0.00 122 Y 9.21 5.20 0.00 2.95 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 0.00 123 P 0.00 4.96 0.00 2.19 2.15 0.00 3.94 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.10 0.00 124 L 8.91 4.65 0.00 1.78 1.69 1.00 0.50 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 0.00 125 A 8.31 4.53 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 0.00 126 P 0.00 4.36 0.00 2.34 2.02 0.00 3.76 0.00 0.00 3.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.08 0.00 127 V 9.24 3.90 2.26 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 0.73 0.00 0.00 0.97 0.00 0.00 128 C 7.46 4.44 0.00 3.06 3.04 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 0.00 129 G 7.68 3.69 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 0.00 130 D 7.19 4.19 0.00 2.68 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 *133 T 7.43 4.58 4.60 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 1.24 0.00 0.00 134 T 8.21 4.33 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 1.21 0.00 0.00 135 G 6.61 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 0.00 136 S 8.51 4.37 0.00 3.91 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 0.00 137 S 8.16 5.28 0.00 3.85 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 138 V 8.40 4.57 2.16 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 0.92 0.00 0.00 0.90 0.00 0.00 139 T 8.36 4.99 4.14 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 1.20 0.00 0.00 140 L 8.61 4.63 0.00 1.10 1.24 0.32 -0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 141 G 8.83 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 0.00 0.00 0.00 0.00 142 C 9.36 5.52 0.00 3.10 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 0.00 143 L 9.40 5.16 0.00 1.87 1.69 1.08 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 144 V 9.20 4.73 2.19 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 0.84 0.00 0.00 0.87 0.00 0.00 145 K 8.80 4.79 0.00 1.91 1.98 0.00 1.70 0.00 0.00 2.00 0.00 0.00 2.96 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.52 1.51 7.81 146 G 8.56 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 147 Y 7.64 5.25 0.00 2.99 3.04 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 0.00 148 F 8.83 5.13 0.00 3.16 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 0.00 149 P 0.00 3.49 0.00 1.62 1.11 0.00 3.86 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.91 0.00 150 E 8.11 4.11 0.00 1.59 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 0.00 1.47 1.47 0.00 151 P 0.00 4.68 0.00 2.07 1.97 0.00 3.60 0.00 0.00 3.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.83 0.00 152 V 7.49 4.37 1.58 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 0.50 0.00 0.00 -0.39 0.00 0.00 153 T 8.96 4.57 4.14 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 1.16 0.00 0.00 154 L 8.32 5.69 0.00 1.53 1.35 0.79 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 0.00 0.00 0.00 0.00 *156 T 8.29 4.86 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 1.24 0.00 0.00 157 W 8.30 4.81 0.00 3.47 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 *162 N 8.23 4.50 0.00 2.96 2.91 0.00 0.00 7.35 7.57 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 0.00 163 S 10.17 3.71 0.00 3.90 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 0.00 164 G 8.11 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 0.00 0.00 0.00 165 S 8.34 4.09 0.00 3.93 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 0.00 166 L 7.86 4.39 0.00 1.66 1.93 0.87 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 167 S 8.45 4.63 0.00 3.96 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 168 S 7.97 4.26 0.00 3.82 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 0.00 169 G 8.55 3.69 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 0.00 *171 V 7.29 4.60 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 1.13 0.00 0.00 172 H 8.87 4.65 0.00 2.54 2.45 0.00 5.57 0.00 0.00 0.00 0.00 6.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173 T 8.26 4.81 4.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 174 F 8.74 4.48 0.00 3.01 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 0.00 175 P 0.00 4.30 0.00 2.26 2.15 0.00 3.95 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 2.12 2.08 0.00 176 A 8.54 4.53 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 0.00 177 V 8.55 4.40 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 0.96 0.00 0.00 1.00 0.00 0.00 178 L 8.70 4.19 0.00 1.09 1.41 0.11 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 0.00 0.00 0.00 0.00 179 Q 8.67 4.46 0.00 2.07 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.63 5.33 0.00 0.00 0.00 0.00 0.00 2.20 2.26 0.00 180 S 8.78 3.92 0.00 4.06 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 *183 D 8.75 4.92 0.00 2.53 2.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 184 L 7.62 5.04 0.00 1.50 1.43 0.89 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 185 Y 8.63 5.10 0.00 1.43 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 0.00 0.00 0.00 186 T 8.22 5.18 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 1.36 0.00 0.00 187 L 9.83 5.33 0.00 1.85 1.73 1.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 188 S 8.53 5.27 0.00 4.12 4.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 189 S 9.54 5.53 0.00 4.06 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 0.00 190 S 9.28 5.52 0.00 3.96 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 0.00 191 V 8.46 4.50 0.67 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 -0.30 0.00 0.00 0.45 0.00 0.00 192 T 8.34 4.81 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 1.16 0.00 0.00 193 V 8.27 4.55 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.80 0.00 0.00 0.96 0.00 0.00 194 T 8.25 4.45 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 1.21 0.00 0.00 195 S 8.46 4.34 0.00 4.05 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 0.00 196 S 7.43 4.19 0.00 3.78 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 *198 T 7.77 4.88 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 1.33 0.00 0.00 199 W 7.53 5.03 0.00 3.22 3.12 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 0.00 200 P 0.00 3.00 0.00 1.59 1.03 0.00 3.50 0.00 0.00 3.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.54 0.00 *202 S 7.24 4.33 0.00 4.03 3.82 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 0.00 203 Q 9.05 4.35 0.00 2.21 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 7.00 0.00 0.00 0.00 0.00 0.00 2.42 2.39 0.00 204 S 8.85 4.60 0.00 3.96 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 205 I 8.83 4.92 2.03 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 1.45 1.18 1.04 0.00 0.00 206 T 9.32 5.32 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 *208 C 8.41 4.38 0.00 2.35 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 0.00 209 N 8.58 5.46 0.00 2.53 2.58 0.00 0.00 6.27 7.52 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 0.00 210 V 8.94 4.84 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.85 0.00 0.00 0.72 0.00 0.00 211 A 8.90 4.74 1.10 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 0.00 0.00 212 H 8.70 4.77 0.00 2.99 3.07 0.00 5.65 0.00 0.00 0.00 0.00 6.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 213 P 0.00 4.02 0.00 2.06 1.98 0.00 3.69 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.99 0.00 214 A 7.74 4.01 1.10 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 0.00 0.00 215 S 8.06 4.50 0.00 3.94 4.00 0.00 0.00 0.00 0.00 0.00 0.00 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 S 8.16 3.62 0.00 3.97 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 217 T 7.03 4.43 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 1.16 0.00 0.00 218 K 8.34 4.52 0.00 1.66 1.62 0.00 1.67 0.00 0.00 1.96 0.00 0.00 2.98 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.26 1.37 7.81 219 V 8.93 4.55 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 0.59 0.00 0.00 0.83 0.00 0.00 220 D 8.57 5.29 0.00 2.53 2.51 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 0.00 221 K 9.16 4.42 0.00 1.73 1.62 0.00 1.51 0.00 0.00 1.54 0.00 0.00 3.05 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.35 1.43 7.81 222 K 8.74 4.69 0.00 1.88 1.78 0.00 1.89 0.00 0.00 1.77 0.00 0.00 2.93 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.56 1.76 7.81 223 I 8.58 4.42 1.97 0.00 0.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.12 0.94 0.00 0.00 224 E 8.95 5.00 0.00 2.03 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 2.42 0.00 225 P 0.00 4.54 0.00 1.90 1.81 0.00 3.53 0.00 0.00 3.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.85 0.00 226 R 7.87 4.66 0.00 1.96 1.97 0.00 3.40 0.00 0.00 3.26 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.37 0.00 227 G 8.36 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 * Residues marked with a * may have inaccurate shift predictions.