NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 21 S 4.4783 8.1927 115.5525 58.2921 64.8565 171.7536 22 I 4.8272 8.4056 125.0471 57.7950 39.4392 173.0041 23 T 4.7009 8.9391 119.1464 59.8669 72.6374 171.7357 24 E 4.8612 8.5263 123.2652 54.8641 31.4887 175.1577 25 N 4.7374 9.0475 126.2028 51.2358 39.5106 174.6298 26 T 4.0709 8.2549 116.1289 63.6081 69.0828 176.2686 27 S 4.2566 7.9132 117.3419 60.8868 63.0264 176.1401 28 W 4.6543 8.2194 122.0353 59.2095 28.8925 177.6590 29 N 4.7249 8.5809 117.2088 55.7794 37.7821 177.0277 30 K 4.0916 7.9581 122.2418 59.6089 32.2232 178.8804 31 E 3.9455 8.2230 118.0662 58.4086 29.6410 178.5076 32 F 4.4356 8.2661 117.6800 59.4232 39.0021 178.0967 33 S 4.1003 8.6015 113.8945 61.7568 62.7845 176.1318 34 A 3.9573 7.8786 125.1309 54.8805 18.1228 178.5629 35 E 4.0776 8.0377 111.7377 56.7397 30.1580 176.3680 36 A 3.7272 8.4237 120.8592 53.1128 15.9856 177.9099 37 V 4.6782 8.2742 111.7427 60.8919 36.4839 175.7370 38 N 4.7496 8.4674 119.9314 52.3163 40.3614 174.6706 39 G 4.2491 7.7297 109.9002 45.9250 0.0000 172.1954 40 V 4.8164 8.2386 118.3644 59.9010 35.3387 174.1618 41 F 5.8329 10.0215 124.7876 56.6891 42.7793 173.5630 42 V 4.9231 8.8517 125.8487 60.9934 34.3826 173.8635 43 L 5.2010 9.2294 129.3989 53.5356 45.5685 174.1819 44 C 5.6170 9.5412 123.3883 55.1217 43.8072 172.7084 45 K 4.4601 8.7207 125.3339 56.4803 32.4395 175.6190 46 S 4.4633 10.1963 129.0597 58.6676 62.1378 169.8299 47 S 4.7174 7.2253 111.5321 57.2134 65.3384 174.4852 48 S 4.4672 8.8526 113.2798 59.1288 62.4830 175.1823 49 K 4.3065 7.9807 120.4800 58.0011 32.8044 177.2316 50 S 4.7879 7.8461 114.8520 56.4164 62.8632 172.1666 51 C 5.6677 8.9321 119.4015 55.0026 43.1582 173.0870 52 A 5.2948 9.1946 121.9353 50.9691 22.7579 174.9751 53 T 5.9616 8.7463 112.8523 60.8071 70.8438 174.4949 54 N 5.2686 9.3754 123.5864 55.0714 38.6273 174.6385 55 D 4.5453 8.1912 119.3780 51.8528 42.6475 175.2626 56 L 4.0081 9.5705 128.5941 57.5470 41.6438 179.1990 57 A 4.1192 7.9495 120.2269 55.3840 18.5209 179.6396 58 R 3.9061 8.5695 116.8734 59.1874 30.1565 178.3092 59 A 4.1243 8.2670 120.9086 54.6765 18.1035 178.7009 60 S 4.6262 7.5384 110.6098 57.7285 64.0328 174.6489 61 K 4.1843 7.6840 123.1704 56.2761 33.0870 175.7740 62 E 4.8374 8.4237 123.6564 55.3572 31.0914 175.0272 63 Y 4.9089 9.0267 120.9672 55.5138 42.4709 174.9239 64 L 4.8152 9.3102 120.8017 54.4658 41.6843 176.2066 65 P 4.3051 0.0000 0.0000 63.5157 32.9744 177.2605 66 A 3.8227 8.2307 123.1713 53.5428 17.5368 179.2175 67 S 4.3839 8.9548 111.5246 61.6933 63.0224 175.4097 68 T 3.9071 7.6021 110.6365 63.8368 69.0153 174.2333 69 F 3.9310 8.3976 129.7451 58.3680 40.4105 175.6869 *70 K 4.1808 8.1212 122.7105 54.4857 33.4046 174.9505 71 I 4.2142 7.7066 120.2121 60.8201 39.4352 175.8612 72 P 4.2770 0.0000 0.0000 65.9301 31.0002 177.8020 73 N 4.0320 7.2155 116.4702 56.3016 38.7571 176.7095 74 A 4.1118 7.8659 121.6078 55.2045 18.5370 179.5264 75 I 3.6635 7.6518 118.0029 64.5945 37.1048 178.8057 76 I 3.3174 8.2312 121.2641 63.9546 36.7771 178.4867 77 G 3.6989 8.4691 107.0153 48.0336 0.0000 175.7116 78 L 4.1932 8.0684 121.4937 57.4603 41.1667 179.3592 79 E 4.0084 8.2724 118.8967 59.4891 29.2417 178.9464 80 T 4.2750 7.9263 107.2884 62.2054 69.3562 175.7793 81 G 3.9644 7.7204 110.3035 45.3639 0.0000 174.7263 82 V 3.6624 7.2585 117.9805 65.2341 31.6619 176.1353 83 I 4.3846 7.6586 120.8022 59.4291 38.2856 175.5227 84 K 4.0324 9.8929 128.6600 58.7942 32.5437 175.9217 85 N 4.7229 7.4569 113.3760 51.8828 39.4693 174.3840 86 E 3.9763 8.7671 115.5189 59.2385 29.4723 177.3284 87 H 4.8642 8.3797 115.2124 55.2194 29.0293 174.5805 88 Q 3.8775 7.7082 121.0524 56.1802 29.2886 175.4762 89 V 4.3537 7.8512 123.9022 61.1962 33.7157 174.8459 90 F 4.5884 9.5317 127.5588 56.1434 39.9176 175.0143 91 K 4.8372 8.5339 123.6563 55.1047 33.3620 178.2236 92 W 4.4692 9.0730 135.0000 57.8889 31.9626 177.1562 *103 E 2.5400 8.5827 116.6439 54.5621 30.7583 170.9683 104 R 4.7870 7.1558 113.6497 55.4658 32.4022 174.2990 105 D 4.9942 8.5761 118.7936 54.6161 41.7148 175.8379 106 L 5.0763 9.1792 121.3189 53.3254 46.6004 176.4492 107 T 4.6516 8.4297 112.0593 60.7646 71.1853 175.4729 108 L 4.1788 8.8116 122.0478 58.3815 42.0412 178.3977 109 R 4.0175 8.2175 118.2498 59.6564 30.0510 178.4069 110 G 3.6900 8.3594 105.1177 47.8815 0.0000 175.4454 111 A 4.1368 8.2689 122.4821 54.9231 18.4152 179.5786 112 I 3.7679 7.7624 117.7059 64.6245 37.3415 178.2863 113 Q 4.2294 8.2025 117.0922 56.4673 28.9175 175.9307 114 V 4.2788 7.2064 118.6093 60.3612 33.9110 174.6450 115 S 4.2775 8.4471 116.8266 58.1151 62.7368 174.6327 116 A 4.7041 8.4616 133.9603 50.2746 19.2951 176.5220 117 V 3.8440 7.8493 126.7295 65.7424 32.0720 177.7780 118 P 4.5682 0.0000 0.0000 65.1704 31.2024 178.9122 119 V 3.4580 7.5417 116.9293 66.2741 31.4298 178.1839 120 F 3.9164 8.2171 116.4782 59.9424 38.9069 177.8156 121 Q 4.3652 8.4295 118.2669 59.1180 28.5307 178.5323 122 Q 4.0362 8.4064 120.6873 59.1200 29.0469 178.1587 123 I 3.6406 7.8883 120.6904 64.4244 37.1716 178.1785 124 A 4.1621 8.2662 121.4598 55.4630 18.0462 179.9315 125 R 4.0185 8.0448 115.4361 59.4855 30.1885 178.8903 126 E 4.1632 8.1204 117.7523 59.0958 29.4999 179.2417 127 V 3.7513 7.8177 117.9188 64.7396 32.1519 177.5550 128 G 4.1798 7.8842 102.6125 45.8350 0.0000 173.9005 129 E 3.8806 8.7147 120.1233 59.0591 29.7324 179.4348 130 V 3.5588 7.7119 117.7231 66.1781 31.6776 178.1259 131 R 3.9701 7.9415 117.3264 59.3060 30.0378 178.4614 132 M 4.1066 8.3373 118.2290 58.8388 32.2672 178.0428 133 Q 3.9192 8.4097 120.0379 58.9841 29.1926 178.2313 134 K 3.8149 7.8587 120.5255 59.7115 32.1699 178.5188 135 Y 3.5546 8.0021 117.0866 60.8351 37.6775 178.5046 136 L 4.0344 8.0349 119.9298 57.2439 41.6607 179.4966 137 K 4.0857 7.9659 119.8618 59.6265 32.0038 178.9591 138 K 3.9985 7.7028 117.1986 59.3670 32.0693 178.5397 139 F 4.9213 8.3787 115.3396 57.0973 40.1299 175.4500 140 S 3.8222 7.9427 114.5315 59.6417 60.3912 173.8999 141 Y 4.2540 8.4507 121.9449 56.6737 38.6939 175.4026 142 G 3.9326 8.4634 121.0043 46.5987 0.0000 172.9776 143 N 4.4861 9.3387 120.2243 53.1408 37.6891 175.5684 144 Q 3.4592 7.6569 116.2317 56.9364 26.8528 173.0741 145 N 4.6326 8.3776 117.9867 52.5379 38.4311 174.5376 146 I 3.9768 7.8798 118.6540 60.1760 38.2106 176.1623 147 S 4.2042 7.5993 115.7588 59.5776 63.4525 174.4569 148 G 3.9925 9.1611 108.9654 45.0666 0.0000 174.2162 149 G 4.0563 8.5790 109.0667 45.0260 0.0000 175.1280 150 I 4.0514 8.6193 124.7647 63.3421 38.1916 175.9227 151 D 5.1227 8.0835 117.5819 52.8493 39.6541 176.9685 152 K 3.4159 7.8681 115.5489 56.9966 34.3616 177.8211 153 F 4.2911 7.5788 117.0190 59.4267 38.0781 176.5255 154 W 4.4858 6.5742 116.5342 56.7571 28.7824 177.1377 155 L 4.3567 6.9918 117.4664 55.8849 43.0780 176.8811 156 E 4.6170 8.3254 113.5601 55.6082 31.6591 176.9237 157 G 4.1210 7.4485 110.8261 45.6504 0.0000 174.4935 158 Q 4.4062 8.2138 120.1425 55.8061 29.6184 175.6175 159 L 4.6272 7.6330 121.6747 54.6616 43.4777 175.7314 160 R 5.0195 8.8286 123.2521 54.9268 35.0116 173.7054 161 I 4.9091 9.0098 121.7534 59.7743 41.9332 174.2238 162 S 5.5121 8.9748 122.6753 56.5821 65.2193 174.8594 163 A 4.4224 9.0403 122.4130 55.5408 18.1291 180.1574 164 V 3.5895 7.8996 116.5933 66.2965 31.5689 177.8526 165 N 4.6394 8.3549 118.1524 56.1299 38.6885 176.8283 166 Q 3.9559 8.4945 120.0144 58.9783 28.7512 178.9785 167 V 3.6032 7.9662 119.1422 66.0086 31.1820 177.9077 168 E 3.7903 8.2596 118.2809 59.2446 29.3354 179.0520 169 F 4.1495 8.3988 120.7166 61.4674 39.4289 177.2271 170 L 3.9073 8.1787 118.6434 57.5033 41.3605 179.1721 171 E 2.9290 7.8824 119.4814 58.9575 29.3649 178.9548 172 S 3.9080 7.5699 115.1364 61.4076 62.8679 176.4766 173 L 3.5989 7.3275 122.7726 58.1938 41.5727 178.1082 174 Y 3.5329 7.3212 118.3331 60.4076 38.6429 177.4968 175 L 4.1238 7.4777 116.0944 53.8310 42.0226 176.4200 176 N 4.1472 7.6011 115.1545 54.3573 36.3641 175.1225 177 K 4.2727 7.9652 116.8121 56.5838 32.7532 177.4351 178 L 4.2345 7.4069 118.7187 54.7159 42.3017 177.9215 179 S 4.5566 8.6316 117.6101 56.7145 61.0760 173.2714 180 A 4.9427 7.6966 123.1843 50.3092 22.3810 177.3319 181 S 4.3229 9.0948 115.7932 58.2726 64.8857 175.6716 182 K 3.8713 8.5436 124.0959 59.5709 32.0412 178.5645 183 E 3.9021 8.2024 119.1369 59.7078 29.5086 178.6141 184 N 4.4199 8.2955 116.1787 56.1691 38.4679 177.5918 185 Q 3.9508 8.0600 119.6242 58.8511 28.8100 178.5889 186 L 3.9815 8.2938 120.4190 57.8741 41.5729 179.6560 187 I 3.6960 7.8303 119.5805 64.5098 36.8612 178.7486 188 V 3.6531 7.5758 117.6774 65.8045 31.6527 177.7992 189 K 4.2260 8.3904 118.6067 59.6248 32.0489 178.9230 190 E 4.0047 8.4170 119.2856 59.1255 29.3217 178.6458 191 A 4.1230 7.7769 119.6835 54.3229 18.6527 178.5233 192 L 4.3482 7.7670 116.0792 53.7437 42.0052 176.7260 193 V 3.8222 7.1327 120.2093 63.2133 31.7086 175.5093 194 T 4.6335 8.6729 116.1879 61.3925 70.7214 173.9922 195 E 4.7255 7.8524 120.6104 54.7612 33.6043 173.9805 196 A 4.9072 8.4477 124.4592 50.8679 22.2209 175.2611 197 A 4.8232 9.0271 125.0257 49.6006 22.7869 174.9307 198 P 4.3328 0.0000 0.0000 65.6394 31.4899 177.6348 199 E 4.8736 8.1499 115.5177 55.6512 31.7011 175.0242 200 Y 5.1346 8.2071 121.3955 56.4584 42.3967 173.3555 201 L 5.1687 9.0294 128.8417 53.3260 46.0560 174.8954 202 V 4.7168 8.7959 125.5762 61.3636 34.5642 173.5627 203 H 5.1100 8.3635 125.0663 53.9681 30.7812 173.7247 204 S 4.7680 8.6215 116.7751 57.6028 66.6317 173.7289 205 K 4.7827 9.0867 121.5950 55.5114 35.5633 175.3930 206 T 5.2407 8.8583 117.6853 61.2937 71.0221 173.7186 207 G 4.5336 8.8859 107.3797 45.7027 0.0000 172.1261 208 F 5.6664 8.6134 121.0746 57.5648 41.6239 174.0401 209 S 4.2788 9.6897 122.3688 59.2706 63.9435 173.6139 210 G 3.5123 7.1109 105.6150 42.4757 0.0000 172.5690 211 V 4.1357 8.0395 121.4215 62.7565 32.0798 175.5285 212 G 4.4066 8.5890 117.6710 45.2972 0.0000 171.8867 213 T 4.8539 7.9403 110.2398 59.6215 71.3020 175.4374 214 E 4.1042 8.9775 122.5908 59.1340 29.4980 177.8249 215 S 4.5512 7.4713 111.2202 59.2502 64.3462 174.2194 216 N 5.0003 7.7749 118.3167 50.8625 38.8958 171.6553 217 P 4.7805 0.0000 0.0000 62.4793 33.3473 177.6165 218 G 4.6775 8.9241 108.9564 44.8752 0.0000 172.4832 219 V 5.0839 8.9046 118.4147 59.6849 34.6114 174.7449 220 A 5.5117 8.9203 124.0420 50.1920 22.5354 175.0856 221 W 5.9057 9.7154 120.1998 54.9561 34.0914 174.5337 222 W 6.0877 9.9306 131.8178 56.5213 33.5662 174.2193 223 V 4.5508 9.9724 119.8874 58.9386 35.5486 176.4294 224 G 3.2581 6.0479 107.8631 45.8387 0.0000 171.1669 225 W 5.5105 7.3547 117.0032 55.2144 32.1860 174.1505 226 V 4.5947 9.1680 121.9101 61.2671 33.7832 174.0008 227 E 4.9155 9.1165 128.4593 54.8659 31.2470 174.9877 228 K 4.8286 8.6637 126.9304 54.1920 34.9091 176.3737 229 E 3.6244 9.3282 129.6483 58.2478 29.1696 175.6447 230 T 4.4429 8.8340 116.4751 62.1311 69.1001 173.3240 231 E 4.5496 8.1841 123.5213 54.7148 31.8638 174.7182 232 V 4.7913 7.4104 121.1460 59.9507 35.1993 173.7741 233 Y 4.9682 8.6658 120.5145 56.3082 41.4345 174.4236 234 F 5.2834 8.9971 123.6687 56.4018 41.2219 175.0243 235 F 5.5475 9.0286 116.7160 55.5370 41.9106 173.3517 236 A 5.3744 9.1433 121.7178 50.8387 22.7994 174.8773 237 F 5.8723 10.3928 125.6146 56.6163 43.0101 173.6084 238 N 5.4092 8.5238 121.7523 51.6208 40.9364 172.8955 239 M 4.9012 8.4020 116.2456 53.8804 35.1918 173.6221 240 D 4.8894 8.6426 120.9019 54.2708 42.1480 175.8196 241 I 4.6254 8.9329 123.0507 59.0507 40.8561 175.0963 242 D 5.0552 8.6922 125.9088 51.3552 40.5943 174.6441 243 N 4.8025 7.9062 118.1801 51.6414 41.7004 174.5781 244 E 3.9946 9.1270 126.8140 59.4112 29.4982 178.5025 245 S 4.2389 8.5393 112.8898 60.0566 63.4684 175.4726 246 K 4.2154 7.9797 121.7535 56.7797 32.1741 177.9529 247 L 3.6781 7.3591 122.0136 57.8295 41.9846 177.0787 248 P 4.1461 0.0000 0.0000 64.8696 31.2327 178.3038 249 L 4.2073 8.1575 119.6589 56.6513 41.1590 179.3202 250 R 3.5942 7.6229 115.6220 58.5306 29.4220 178.1819 251 K 3.3933 7.3240 118.3921 57.7022 32.8968 178.9398 252 S 3.8964 7.3252 114.0602 61.1314 63.1060 176.4693 253 I 3.2587 7.2076 123.2596 63.5370 36.7695 176.4785 254 P 2.9700 0.0000 0.0000 65.4976 31.0547 178.6947 255 T 3.7104 7.5905 114.2922 66.5571 68.3269 176.8198 256 K 3.8401 7.8186 120.2714 59.3437 32.1530 179.5578 257 I 3.3122 7.3100 119.9992 64.5179 36.9252 178.4401 258 M 3.9445 7.9699 119.8961 58.1200 31.6085 178.4402 259 E 3.8502 8.4449 120.2147 59.3035 29.6359 179.1231 260 S 4.1142 7.8803 112.8230 61.0387 63.0680 175.3606 261 E 4.3831 7.7467 119.5847 56.2873 29.5575 177.3697 262 G 3.9753 8.0449 107.9064 45.4604 0.0000 174.8547 263 I 3.7761 7.5251 121.2766 63.7963 37.2633 176.8594 264 I 3.8861 7.6993 121.2706 61.5131 37.9128 176.9436 265 G 3.6368 8.2102 115.2611 46.3992 0.0000 173.1328 266 G 3.7196 8.5351 107.9863 45.6805 0.0000 173.2045 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 21 S 8.19 4.48 0.00 3.91 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 22 I 8.41 4.83 1.88 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 1.41 1.06 0.92 0.00 0.00 23 T 8.94 4.70 4.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 24 E 8.53 4.86 0.00 1.94 1.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.34 0.00 25 N 9.05 4.74 0.00 2.03 1.42 0.00 0.00 6.63 7.32 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 26 T 8.25 4.07 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 1.18 0.00 0.00 27 S 7.91 4.26 0.00 4.15 4.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 W 8.22 4.65 0.00 3.64 3.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 N 8.58 4.72 0.00 2.94 2.96 0.00 0.00 6.56 7.16 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 30 K 7.96 4.09 0.00 1.98 2.16 0.00 1.68 0.00 0.00 1.80 0.00 0.00 3.02 0.00 0.00 3.33 0.00 0.00 0.00 0.00 1.80 1.43 7.81 31 E 8.22 3.95 0.00 1.99 1.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.37 0.00 32 F 8.27 4.44 0.00 3.30 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 33 S 8.60 4.10 0.00 4.11 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 0.00 34 A 7.88 3.96 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 E 8.04 4.08 0.00 1.93 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 0.00 2.23 2.14 0.00 36 A 8.42 3.73 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 37 V 8.27 4.68 2.18 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 0.76 0.00 0.00 1.19 0.00 0.00 38 N 8.47 4.75 0.00 2.61 2.68 0.00 0.00 6.59 7.58 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 39 G 7.73 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 0.00 0.00 0.00 40 V 8.24 4.82 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 0.67 0.00 0.00 1.10 0.00 0.00 41 F 10.02 5.83 0.00 3.49 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 42 V 8.85 4.92 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 0.95 0.00 0.00 1.04 0.00 0.00 43 L 9.23 5.20 0.00 1.37 1.68 1.10 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 44 C 9.54 5.62 0.00 3.09 3.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 K 8.72 4.46 0.00 2.00 1.77 0.00 2.05 0.00 0.00 1.75 0.00 0.00 2.91 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.24 0.94 7.81 46 S 10.20 4.46 0.00 4.01 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 47 S 7.23 4.72 0.00 4.06 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 S 8.85 4.47 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 49 K 7.98 4.31 0.00 1.77 1.89 0.00 1.64 0.00 0.00 1.68 0.00 0.00 2.94 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.41 1.53 7.81 50 S 7.85 4.79 0.00 3.94 3.78 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 51 C 8.93 5.67 0.00 2.92 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 52 A 9.19 5.29 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 53 T 8.75 5.96 4.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 54 N 9.38 5.27 0.00 3.12 3.50 0.00 0.00 6.10 8.06 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 55 D 8.19 4.55 0.00 2.56 2.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 L 9.57 4.01 0.00 1.60 1.72 0.90 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 57 A 7.95 4.12 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 58 R 8.57 3.91 0.00 1.88 1.91 0.00 3.04 0.00 0.00 3.06 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.79 0.00 59 A 8.27 4.12 1.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 60 S 7.54 4.63 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 61 K 7.68 4.18 0.00 1.94 1.43 0.00 1.70 0.00 0.00 1.61 0.00 0.00 2.83 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.40 1.62 7.81 62 E 8.42 4.84 0.00 1.78 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.30 0.00 63 Y 9.03 4.91 0.00 3.10 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 64 L 9.31 4.82 0.00 1.77 1.87 1.13 1.25 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 65 P 0.00 4.31 0.00 2.43 2.41 0.00 4.17 0.00 0.00 4.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.31 0.00 66 A 8.23 3.82 1.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 67 S 8.95 4.38 0.00 4.06 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 68 T 7.60 3.91 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 1.12 0.00 0.00 69 F 8.40 3.93 0.00 3.11 2.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *70 K 8.12 4.18 0.00 1.56 1.61 0.00 1.66 0.00 0.00 1.70 0.00 0.00 3.06 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.26 1.53 7.81 71 I 7.71 4.21 1.94 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 0.89 1.06 0.00 0.00 72 P 0.00 4.28 0.00 1.67 1.86 0.00 3.40 0.00 0.00 3.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.56 0.67 0.00 73 N 7.22 4.03 0.00 2.23 2.67 0.00 0.00 7.09 7.28 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 74 A 7.87 4.11 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 75 I 7.65 3.66 2.08 0.00 0.00 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.72 0.99 0.00 0.00 76 I 8.23 3.32 1.73 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 0.79 0.57 0.00 0.00 77 G 8.47 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 L 8.07 4.19 0.00 1.86 1.87 0.97 0.85 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 79 E 8.27 4.01 0.00 1.85 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 0.00 2.48 2.52 0.00 80 T 7.93 4.27 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 1.25 0.00 0.00 81 G 7.72 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 V 7.26 3.66 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 0.81 0.00 0.00 0.95 0.00 0.00 83 I 7.66 4.38 1.90 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.74 1.01 0.00 0.00 84 K 9.89 4.03 0.00 1.63 1.83 0.00 1.80 0.00 0.00 1.73 0.00 0.00 3.06 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.43 1.36 7.81 85 N 7.46 4.72 0.00 2.91 2.87 0.00 0.00 5.90 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 86 E 8.77 3.98 0.00 1.96 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 0.00 2.17 2.01 0.00 87 H 8.38 4.86 0.00 3.23 3.29 0.00 5.66 0.00 0.00 0.00 0.00 6.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 88 Q 7.71 3.88 0.00 1.87 1.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.60 0.00 0.00 0.00 0.00 0.00 1.44 1.95 0.00 89 V 7.85 4.35 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 0.88 0.00 0.00 0.95 0.00 0.00 90 F 9.53 4.59 0.00 3.18 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 91 K 8.53 4.84 0.00 1.67 1.78 0.00 1.73 0.00 0.00 1.63 0.00 0.00 2.90 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.57 1.44 7.81 92 W 9.07 4.47 0.00 3.34 3.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *103 E 8.58 2.54 0.00 2.05 1.85 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 2.13 1.88 0.00 104 R 7.16 4.79 0.00 1.84 1.75 0.00 2.98 0.00 0.00 3.22 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.64 0.00 105 D 8.58 4.99 0.00 2.67 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 0.00 106 L 9.18 5.08 0.00 1.68 1.62 0.97 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 107 T 8.43 4.65 4.33 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 0.00 116 A 8.46 4.70 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 0.00 117 V 7.85 3.84 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 0.85 0.00 0.00 0.93 0.00 0.00 118 P 0.00 4.57 0.00 2.23 2.21 0.00 3.58 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 2.22 0.00 119 V 7.54 3.46 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 -0.05 0.00 0.00 0.87 0.00 0.00 120 F 8.22 3.92 0.00 3.21 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 0.00 121 Q 8.43 4.37 0.00 2.38 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.10 6.81 0.00 0.00 0.00 0.00 0.00 2.73 2.78 0.00 122 Q 8.41 4.04 0.00 2.29 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.79 0.00 0.00 0.00 0.00 0.00 2.41 2.62 0.00 123 I 7.89 3.64 1.84 0.00 0.00 -0.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.30 0.86 0.00 0.00 124 A 8.27 4.16 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 0.00 0.00 0.00 0.00 0.00 125 R 8.04 4.02 0.00 1.89 2.08 0.00 3.22 0.00 0.00 3.43 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.94 0.00 126 E 8.12 4.16 0.00 2.20 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 0.00 2.38 2.50 0.00 127 V 7.82 3.75 2.32 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 0.89 0.00 0.00 0.97 0.00 0.00 128 G 7.88 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 0.00 129 E 8.71 3.88 0.00 2.06 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.30 0.00 130 V 7.71 3.56 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 1.00 0.00 0.00 0.93 0.00 0.00 131 R 7.94 3.97 0.00 2.14 2.15 0.00 3.32 0.00 0.00 3.33 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.73 0.00 132 M 8.34 4.11 0.00 2.14 2.25 0.00 0.00 0.00 0.00 0.00 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.67 2.73 0.00 133 Q 8.41 3.92 0.00 2.24 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.59 0.00 0.00 0.00 0.00 0.00 2.31 2.37 0.00 134 K 7.86 3.81 0.00 1.77 1.72 0.00 1.56 0.00 0.00 1.45 0.00 0.00 2.75 0.00 0.00 2.82 0.00 0.00 0.00 0.00 0.92 1.21 7.81 135 Y 8.00 3.55 0.00 2.83 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 136 L 8.03 4.03 0.00 1.74 1.86 1.09 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 137 K 7.97 4.09 0.00 1.91 1.91 0.00 1.61 0.00 0.00 1.60 0.00 0.00 2.91 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.42 1.48 7.81 138 K 7.70 4.00 0.00 1.75 1.93 0.00 1.29 0.00 0.00 1.60 0.00 0.00 2.86 0.00 0.00 2.64 0.00 0.00 0.00 0.00 1.39 1.44 7.81 139 F 8.38 4.92 0.00 3.09 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 0.00 140 S 7.94 3.82 0.00 4.11 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 141 Y 8.45 4.25 0.00 3.12 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 0.00 142 G 8.46 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 143 N 9.34 4.49 0.00 2.81 3.13 0.00 0.00 6.92 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 0.00 144 Q 7.66 3.46 0.00 2.26 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.87 0.00 0.00 0.00 0.00 0.00 2.51 2.63 0.00 145 N 8.38 4.63 0.00 2.77 2.98 0.00 0.00 6.87 7.98 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 0.00 146 I 7.88 3.98 0.56 0.00 0.00 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.50 0.36 0.00 0.00 147 S 7.60 4.20 0.00 4.02 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 0.00 148 G 9.16 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 0.00 149 G 8.58 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 0.00 150 I 8.62 4.05 1.98 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.06 1.02 0.00 0.00 151 D 8.08 5.12 0.00 2.87 2.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 152 K 7.87 3.42 0.00 1.53 1.65 0.00 1.21 0.00 0.00 1.72 0.00 0.00 2.94 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.33 1.21 7.81 153 F 7.58 4.29 0.00 3.15 3.40 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 0.00 154 W 6.57 4.49 0.00 3.29 2.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 155 L 6.99 4.36 0.00 1.22 1.50 0.25 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.44 0.00 0.00 0.00 0.00 0.00 0.00 156 E 8.33 4.62 0.00 1.75 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 1.99 0.00 157 G 7.45 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 0.00 158 Q 8.21 4.41 0.00 2.11 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.13 6.78 0.00 0.00 0.00 0.00 0.00 2.33 2.42 0.00 159 L 7.63 4.63 0.00 2.15 1.88 1.20 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 160 R 8.83 5.02 0.00 1.74 1.65 0.00 3.52 0.00 0.00 3.42 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 1.56 0.00 161 I 9.01 4.91 1.55 0.00 0.00 -0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 1.41 0.81 0.00 0.00 162 S 8.97 5.51 0.00 4.27 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 0.00 163 A 9.04 4.42 1.56 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 0.00 0.00 164 V 7.90 3.59 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 1.01 0.00 0.00 1.02 0.00 0.00 165 N 8.35 4.64 0.00 2.83 2.88 0.00 0.00 6.76 6.93 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 0.00 166 Q 8.49 3.96 0.00 2.34 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.58 0.00 0.00 0.00 0.00 0.00 2.26 2.22 0.00 167 V 7.97 3.60 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.00 0.00 1.06 0.00 0.00 168 E 8.26 3.79 0.00 2.24 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 0.00 2.28 2.41 0.00 169 F 8.40 4.15 0.00 3.04 3.28 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 0.00 170 L 8.18 3.91 0.00 1.82 2.08 0.98 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 171 E 7.88 2.93 0.00 1.16 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 0.00 1.90 1.50 0.00 172 S 7.57 3.91 0.00 3.79 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 0.00 173 L 7.33 3.60 0.00 1.19 1.54 0.78 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 0.00 174 Y 7.32 3.53 0.00 1.89 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 0.00 175 L 7.48 4.12 0.00 1.55 1.59 0.86 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 176 N 7.60 4.15 0.00 2.79 2.84 0.00 0.00 6.88 7.21 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 0.00 177 K 7.97 4.27 0.00 1.73 1.78 0.00 1.62 0.00 0.00 1.65 0.00 0.00 2.92 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.36 1.49 7.81 178 L 7.41 4.23 0.00 1.48 1.45 0.17 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.00 0.00 0.00 0.00 0.00 0.00 179 S 8.63 4.56 0.00 4.11 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 0.00 180 A 7.70 4.94 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 0.00 181 S 9.09 4.32 0.00 4.05 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 0.00 182 K 8.54 3.87 0.00 1.81 1.83 0.00 1.68 0.00 0.00 1.71 0.00 0.00 2.85 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.47 1.59 7.81 183 E 8.20 3.90 0.00 2.06 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 0.00 2.38 2.41 0.00 184 N 8.30 4.42 0.00 2.80 2.85 0.00 0.00 7.10 6.75 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 0.00 185 Q 8.06 3.95 0.00 2.22 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.79 0.00 0.00 0.00 0.00 0.00 2.28 2.51 0.00 186 L 8.29 3.98 0.00 1.82 1.72 0.90 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 187 I 7.83 3.70 2.03 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 1.47 0.92 0.00 0.00 188 V 7.58 3.65 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 0.85 0.00 0.00 1.00 0.00 0.00 189 K 8.39 4.23 0.00 2.13 2.04 0.00 1.87 0.00 0.00 1.71 0.00 0.00 2.95 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.87 1.72 7.81 190 E 8.42 4.00 0.00 2.09 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 0.00 2.32 2.35 0.00 191 A 7.78 4.12 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 0.00 192 L 7.77 4.35 0.00 1.78 1.52 0.90 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 193 V 7.13 3.82 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 0.71 0.00 0.00 0.80 0.00 0.00 194 T 8.67 4.63 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 1.37 0.00 0.00 195 E 7.85 4.73 0.00 2.13 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 0.00 2.36 2.41 0.00 196 A 8.45 4.91 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 0.00 197 A 9.03 4.82 1.27 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 0.00 198 P 0.00 4.33 0.00 2.08 2.18 0.00 3.65 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.15 0.00 199 E 8.15 4.87 0.00 1.95 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.30 0.00 200 Y 8.21 5.13 0.00 2.95 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 0.00 201 L 9.03 5.17 0.00 1.77 1.47 1.00 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 202 V 8.80 4.72 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 1.05 0.00 0.00 1.00 0.00 0.00 203 H 8.36 5.11 0.00 1.40 2.03 0.00 5.89 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 0.00 204 S 8.62 4.77 0.00 3.70 3.66 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 0.00 205 K 9.09 4.78 0.00 1.80 1.63 0.00 1.51 0.00 0.00 1.64 0.00 0.00 3.06 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.30 1.48 7.81 206 T 8.86 5.24 4.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 207 G 8.89 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 0.00 0.00 0.00 0.00 208 F 8.61 5.67 0.00 2.88 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 0.00 209 S 9.69 4.28 0.00 3.90 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 0.00 210 G 7.11 3.51 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 0.00 211 V 8.04 4.14 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 0.88 0.00 0.00 1.22 0.00 0.00 212 G 8.59 4.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 213 T 7.94 4.85 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 1.22 0.00 0.00 214 E 8.98 4.10 0.00 1.96 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.33 0.00 215 S 7.47 4.55 0.00 3.94 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 0.00 216 N 7.77 5.00 0.00 2.75 2.74 0.00 0.00 6.59 8.78 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 0.00 217 P 0.00 4.78 0.00 2.10 2.07 0.00 3.79 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 2.02 1.99 0.00 218 G 8.92 4.68 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 0.00 0.00 0.00 219 V 8.90 5.08 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.00 0.00 0.41 0.00 0.00 220 A 8.92 5.51 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 0.00 221 W 9.72 5.91 0.00 3.37 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 0.00 222 W 9.93 6.09 0.00 3.54 3.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 223 V 9.97 4.55 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 0.85 0.00 0.00 0.92 0.00 0.00 224 G 6.05 3.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 225 W 7.35 5.51 0.00 2.90 3.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 226 V 9.17 4.59 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 0.57 0.00 0.00 0.93 0.00 0.00 227 E 9.12 4.92 0.00 1.99 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 0.00 2.34 2.47 0.00 228 K 8.66 4.83 0.00 1.86 1.82 0.00 1.96 0.00 0.00 1.80 0.00 0.00 2.91 0.00 0.00 3.21 0.00 0.00 0.00 0.00 1.51 1.73 7.81 229 E 9.33 3.62 0.00 2.17 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.31 0.00 230 T 8.83 4.44 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 1.23 0.00 0.00 231 E 8.18 4.55 0.00 2.02 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 1.47 0.00 232 V 7.41 4.79 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 0.39 0.00 0.00 -0.22 0.00 0.00 233 Y 8.67 4.97 0.00 2.90 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 0.00 234 F 9.00 5.28 0.00 3.11 2.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 235 F 9.03 5.55 0.00 3.01 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 0.00 236 A 9.14 5.37 1.47 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 0.00 0.00 0.00 237 F 10.39 5.87 0.00 3.66 3.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 238 N 8.52 5.41 0.00 1.64 1.42 0.00 0.00 6.36 8.50 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 0.00 239 M 8.40 4.90 0.00 2.06 2.19 0.00 0.00 0.00 0.00 0.00 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.53 2.73 0.00 240 D 8.64 4.89 0.00 2.55 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 0.00 241 I 8.93 4.63 1.91 0.00 0.00 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.63 1.17 0.00 0.00 242 D 8.69 5.06 0.00 2.84 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 0.00 243 N 7.91 4.80 0.00 2.70 2.66 0.00 0.00 6.73 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 0.00 244 E 9.13 3.99 0.00 2.13 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.39 2.43 0.00 245 S 8.54 4.24 0.00 4.01 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 246 K 7.98 4.22 0.00 1.94 1.84 0.00 1.68 0.00 0.00 1.57 0.00 0.00 2.88 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.38 1.41 7.81 247 L 7.36 3.68 0.00 1.37 1.44 -0.01 0.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 248 P 0.00 4.15 0.00 2.04 1.92 0.00 3.65 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.04 0.00 249 L 8.16 4.21 0.00 1.71 1.59 0.88 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 250 R 7.62 3.59 0.00 2.09 2.13 0.00 3.04 0.00 0.00 2.96 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 1.53 0.00 251 K 7.32 3.39 0.00 1.25 0.99 0.00 1.14 0.00 0.00 0.94 0.00 0.00 2.40 0.00 0.00 2.47 0.00 0.00 0.00 0.00 0.30 0.50 7.81 252 S 7.33 3.90 0.00 3.83 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 0.00 253 I 7.21 3.26 1.32 0.00 0.00 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.40 0.16 0.00 0.00 254 P 0.00 2.97 0.00 2.04 1.55 0.00 3.00 0.00 0.00 2.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 1.43 0.00 255 T 7.59 3.71 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 1.10 0.00 0.00 256 K 7.82 3.84 0.00 1.68 1.85 0.00 1.50 0.00 0.00 1.66 0.00 0.00 2.84 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.30 1.50 7.81 257 I 7.31 3.31 1.17 0.00 0.00 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 0.75 -0.41 0.00 0.00 258 M 7.97 3.94 0.00 1.88 2.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.68 2.52 0.00 259 E 8.44 3.85 0.00 1.99 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 2.24 2.25 0.00 260 S 7.88 4.11 0.00 4.09 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 0.00 261 E 7.75 4.38 0.00 2.11 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.59 0.00 262 G 8.04 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 0.00 263 I 7.53 3.78 1.80 0.00 0.00 0.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.32 0.23 0.77 0.00 0.00 264 I 7.70 3.89 1.79 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.48 0.79 0.00 0.00 265 G 8.21 3.64 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 0.00 266 G 8.54 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.