NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4346 8.3044 118.7951 54.1347 33.0717 174.7980 2 S 4.3529 8.3464 115.0461 57.7697 63.1874 169.1817 3 V 3.8474 9.0214 117.1525 62.6864 32.7315 176.1318 4 I 4.1888 7.4629 121.0546 59.9603 37.2269 175.2084 5 K 4.8650 8.2827 124.6503 53.6008 35.0434 174.5974 6 P 4.6445 0.0000 0.0000 65.1649 31.4912 175.8028 7 D 5.4818 8.0699 116.3790 52.8316 43.6098 175.3817 8 M 5.0491 9.1765 121.9660 53.7007 37.1576 174.3903 9 K 5.0997 9.2493 119.3906 55.0645 35.7958 175.5298 10 I 5.1296 8.6706 121.3447 59.7003 41.5424 174.8389 11 K 5.0641 8.5523 126.4728 54.8913 35.8205 174.8457 12 L 5.2775 9.0018 126.3987 54.6281 44.8346 174.7682 13 R 5.0879 8.7853 119.9208 55.1395 33.5300 173.1314 14 M 5.2964 9.8322 126.8454 53.8503 35.1348 174.1141 15 E 4.8590 8.5857 124.7974 54.8669 33.5809 175.7101 16 G 4.0424 7.8963 108.1002 46.8731 0.0000 171.6490 17 A 5.4652 8.4079 119.6110 51.0325 23.4421 176.3827 18 V 4.6632 8.5320 119.1850 62.2083 33.9262 175.5918 19 N 4.3066 10.3956 125.5230 54.3445 36.5538 175.6056 20 G 3.8569 8.6599 105.6240 45.3917 0.0000 173.5401 21 H 4.9853 8.0641 118.2550 53.4157 30.0316 173.1264 22 P 5.1583 0.0000 0.0000 63.2397 32.3801 175.2798 23 F 5.2010 8.8114 115.2181 56.5654 41.9068 172.4493 24 A 5.2560 9.2445 120.0524 50.8111 22.8540 175.4214 25 I 5.2597 9.2635 121.3118 59.7829 41.9460 174.3445 26 E 5.2862 9.1706 124.4334 55.0010 33.5155 175.0735 27 G 4.4319 8.7146 107.1493 45.5037 0.0000 172.4095 28 V 4.9201 8.4362 113.3608 59.9071 36.1929 175.5713 29 G 4.1971 8.8539 110.1300 46.5718 0.0000 171.3927 30 L 5.0078 8.2951 118.4193 55.4165 44.4126 174.1868 31 G 4.1015 8.6396 106.0919 46.1148 0.0000 172.6247 32 K 5.8247 9.3981 119.9816 52.6347 33.1465 175.4439 33 P 4.2372 0.0000 0.0000 65.7968 31.0586 178.8629 34 F 4.4864 8.1303 115.0725 58.8285 39.2012 175.7699 35 E 4.4538 8.4237 118.8940 55.4626 30.3174 175.9691 36 G 4.0269 7.8135 106.1575 46.7406 0.0000 173.2158 37 K 5.3358 7.9191 117.0324 54.5095 36.6113 175.7744 38 Q 4.8789 8.7219 120.0722 55.4780 32.3282 173.1871 39 S 5.1472 8.7004 114.1626 57.6690 66.8433 172.6067 40 M 5.0676 8.9430 117.2677 54.6450 35.1350 172.8232 41 D 5.3446 9.0042 120.4200 52.6515 43.6122 175.2995 42 L 5.1024 9.0075 123.7101 52.7200 45.0864 175.4727 43 K 5.0619 9.0364 123.7937 54.4709 35.5485 175.3018 44 V 4.2350 8.7077 128.3452 63.2703 31.3547 175.5529 45 K 4.5559 9.2877 127.5394 57.4483 33.9466 176.6877 46 E 4.6250 7.9239 117.4568 55.5267 34.0767 176.7408 47 G 4.1694 9.2385 110.3668 45.7957 0.0000 173.7896 48 G 3.9624 7.7450 107.7989 43.4817 0.0000 172.1165 49 P 4.4100 0.0000 0.0000 61.5264 32.2137 176.3725 50 L 3.6353 8.3608 122.3386 54.8437 41.7155 175.0306 51 P 4.5926 0.0000 0.0000 62.3848 31.5477 175.1803 52 F 4.9042 6.5342 112.1044 54.4921 41.2213 174.1271 53 A 3.7483 8.5351 124.7987 52.5285 18.4297 178.3003 54 Y 3.7999 8.2130 124.2193 60.8514 38.4036 177.7764 55 D 4.6536 8.2726 119.7103 57.3523 40.6325 178.4314 56 I 4.4839 7.6698 111.8339 63.2613 37.8714 177.3381 57 L 3.9662 8.0870 121.0765 56.0747 41.6211 178.5203 58 T 4.3089 7.8321 108.5821 65.1413 68.6029 175.8443 59 T 4.1822 8.0192 109.0590 62.5151 69.2686 175.1552 60 V 4.1803 7.7502 122.1350 65.3347 32.4951 176.8066 61 F 4.7374 7.3863 119.2071 56.6505 37.1230 175.8147 *65 N 4.5582 7.6616 118.6286 53.3527 39.0851 174.1303 66 R 3.8839 8.2152 124.5714 56.8775 29.8072 177.8780 67 V 3.6581 7.8199 116.9040 64.6006 32.0604 177.1231 68 F 4.5810 7.5810 121.7971 55.5118 37.2974 175.0094 69 A 4.8057 7.2616 121.2500 50.1533 22.8853 177.0503 70 K 4.2134 9.1176 124.6211 56.5624 33.0259 175.0702 71 Y 4.7630 8.5396 125.8547 55.6493 39.3358 174.5585 72 P 4.5641 0.0000 0.0000 62.1042 32.3053 177.0431 73 E 4.0374 8.6814 120.6362 59.1303 29.6460 177.2689 74 N 4.6803 8.1639 113.5029 53.2732 37.9287 174.4852 75 I 4.5111 7.2918 120.6171 59.1284 39.6998 175.5977 76 V 3.4807 8.4258 125.3199 63.0817 31.8433 175.1826 77 D 3.7057 8.1631 126.9683 52.3726 40.2437 175.6300 78 Y 3.6945 7.7751 127.0346 60.2049 38.8849 177.4271 79 F 3.8216 7.2176 117.9768 60.4475 39.3530 177.9173 80 K 4.1833 8.4023 117.9920 59.4664 31.5316 179.5267 81 Q 4.1032 7.5430 118.1199 58.6615 28.7665 177.9485 82 S 3.9367 7.5155 114.5347 60.4061 63.2578 174.5450 83 F 4.9047 7.4095 118.3624 55.6871 39.5952 174.0982 84 P 4.7315 0.0000 0.0000 65.4082 31.5798 177.5986 85 E 3.9432 8.3406 118.6906 59.2431 29.7560 176.9335 86 G 3.0238 9.2060 104.1686 44.3880 0.0000 170.7623 87 Y 5.1444 7.4474 114.6766 56.3377 41.9899 173.4472 88 S 5.0495 9.1936 113.3572 56.5071 67.1350 172.8943 89 W 5.8770 8.6630 116.7166 55.1960 32.0341 173.6069 90 E 5.3463 9.2807 119.5546 55.0035 33.3026 174.8734 91 R 5.0461 9.0600 121.8197 55.1635 34.3891 173.4056 92 S 4.9799 8.8387 119.7096 56.6401 65.7122 172.4752 93 M 4.7091 9.1525 126.4376 53.6531 34.7211 174.3964 94 N 4.9497 8.9051 124.7733 52.1470 40.3775 173.7460 95 Y 4.6488 8.9707 125.4343 57.1360 38.9866 177.2017 96 E 4.0599 8.9711 121.0856 58.8308 29.7744 177.5068 97 D 4.7815 8.4804 117.5985 53.1052 39.6519 177.1902 98 G 3.9762 8.3398 109.4155 45.1692 0.0000 174.6619 99 G 2.9249 7.8224 106.9765 46.0115 0.0000 172.9034 100 I 5.1182 8.1463 124.5592 59.4799 41.1676 174.1295 101 C 5.0868 9.1319 124.2332 57.9232 31.3116 172.6099 102 N 5.3532 8.8894 121.2330 51.4950 40.9415 173.7861 103 A 5.1816 8.9322 123.8654 50.8052 23.4860 174.9525 104 T 4.6070 8.4699 108.5126 60.0322 72.9754 172.5090 105 N 4.8610 7.6558 120.9753 51.9596 42.7385 172.2773 106 D 4.8340 8.7383 126.2521 52.6711 42.9808 174.6591 107 I 5.1709 8.3088 127.8372 59.9107 39.5101 175.1900 108 T 4.8656 9.0579 116.5506 59.6987 72.6533 172.3426 109 L 5.1428 8.5813 122.3996 53.3563 45.2196 175.1761 110 D 4.6923 9.0069 125.5418 52.9342 43.7823 177.3539 111 G 3.8986 8.7825 120.5617 46.8502 0.0000 172.4981 112 D 4.8183 8.9735 122.2175 52.6406 41.0836 173.9688 113 C 5.1335 7.9445 119.9010 58.2732 34.3574 172.7138 114 Y 4.8662 8.9790 124.6528 57.8821 39.3662 174.5127 115 I 5.0082 9.1730 123.8180 59.8251 40.4708 173.9892 116 Y 5.4086 8.9932 124.9330 56.2489 40.9520 174.4722 117 E 4.7958 9.0576 124.7144 54.7521 31.9698 174.3582 118 I 4.9761 8.6486 128.1776 59.3612 40.6932 174.8917 119 R 5.1446 8.5462 125.4914 54.5077 33.4485 173.9093 120 F 5.1723 8.9712 127.1973 56.6269 43.2087 173.1095 121 D 5.0594 8.7661 125.7188 52.9292 44.8211 174.4407 122 G 4.5760 9.1912 111.4386 44.5497 0.0000 172.0019 123 V 4.8822 8.2697 115.5125 59.5486 36.9218 174.8931 124 N 4.3141 8.6861 115.4823 54.3667 35.8451 174.4613 125 F 4.4549 8.0899 116.8936 55.9793 39.7805 174.3424 126 P 4.3707 0.0000 0.0000 62.3463 31.8140 177.3522 127 A 4.0226 8.7633 125.3661 54.8750 18.4208 177.9964 128 N 4.6961 8.0527 110.4250 52.7692 37.9722 175.7699 129 G 3.8360 7.8268 107.1287 43.7517 0.0000 173.1233 130 P 4.1199 0.0000 0.0000 65.0286 31.0157 179.4636 131 V 3.2902 7.2396 116.7773 66.3062 31.4168 177.9795 132 M 4.0793 7.8037 116.0576 57.4406 31.9632 177.5390 133 Q 4.2901 7.7117 116.1078 54.1360 30.3631 175.4977 134 K 3.6625 7.5357 118.4153 58.1441 29.5247 174.9724 135 R 4.6904 8.4086 113.1705 56.1210 31.9876 177.5912 136 T 4.5919 7.7522 108.9921 61.1874 70.0613 174.1982 137 V 4.2106 8.3862 124.2058 63.4511 32.6412 175.6037 138 K 4.3387 7.2599 116.0390 56.1769 36.1780 173.2369 139 W 5.1164 8.9168 120.6227 56.0299 30.0571 176.6774 140 E 4.4387 9.1654 123.6649 55.3632 29.9380 174.9535 141 P 4.6710 0.0000 0.0000 63.2359 32.5602 175.2385 142 S 4.6676 8.9996 115.2074 57.6064 67.2833 173.0238 143 T 4.9857 8.2119 115.5560 61.7942 70.8215 173.4979 144 E 4.4731 9.3545 129.0348 55.4388 31.5517 175.1644 145 K 4.5915 9.1370 126.3481 54.8181 34.2952 175.1160 146 L 5.1483 8.0860 126.1130 53.0629 44.3327 175.3098 147 Y 5.0556 8.0723 119.9124 55.6024 41.7360 174.1091 148 V 4.2645 8.3928 121.1364 62.7412 33.0145 175.5396 149 R 4.4893 8.8309 126.5747 56.3850 33.2613 174.6809 150 D 4.5289 9.8199 125.9506 55.5387 38.3864 174.8008 151 G 3.9159 8.3702 104.1782 45.7935 0.0000 173.0825 152 V 4.5704 7.6051 112.4631 59.3002 36.2058 173.6095 153 L 4.6086 7.9790 122.2009 53.4030 44.0856 175.4282 154 K 4.8461 8.6027 125.4799 54.5678 35.4313 175.6239 155 G 4.4862 8.7951 109.8558 43.9880 0.0000 171.1511 156 D 5.8268 9.2189 125.8828 52.6469 44.5961 175.7182 157 V 4.4334 8.3590 120.1039 60.5530 35.2791 173.0289 158 N 4.8257 8.7013 121.5382 52.8975 39.1115 174.3306 159 M 4.6789 8.8301 124.0169 53.6130 35.4730 175.2121 160 A 5.2275 8.5639 121.3843 50.7601 23.1337 174.8249 161 L 4.9563 9.0230 123.1735 52.8593 44.0018 176.3765 162 S 4.5453 8.9277 119.1502 58.2139 64.6762 173.2384 163 L 5.0811 8.3761 122.0151 52.6170 44.6208 175.6682 164 E 4.1615 8.7105 123.7316 57.6998 29.8001 177.3337 165 G 3.8883 8.5507 115.1202 44.0382 0.0000 172.7426 166 G 3.8646 8.2115 105.7482 45.2012 0.0000 174.4885 167 G 3.9778 8.9133 106.5385 45.1981 0.0000 171.6655 168 H 5.4699 8.3660 114.0978 53.9862 33.0413 173.0228 169 Y 5.0496 9.0799 121.1058 56.1631 41.2424 174.8085 170 R 4.8584 9.8042 126.8486 56.0178 32.1824 175.4308 171 C 4.8746 8.9126 121.6217 58.0839 35.6292 172.0955 172 D 5.3235 8.9723 125.7848 52.7673 42.9906 175.2051 173 F 5.2224 9.0523 122.5852 56.0019 41.6699 175.3135 174 K 4.7685 8.7168 121.4430 54.1203 35.5063 175.2862 175 T 4.9566 8.9069 122.4670 61.7509 71.9948 173.7113 176 T 4.7160 8.7296 121.4446 62.0122 71.9512 172.4141 177 Y 5.4433 9.3345 125.1447 56.4030 40.6747 175.1052 178 K 4.8476 9.7966 123.1643 54.3471 35.6301 175.6924 179 A 4.3605 9.3144 128.3661 51.6095 19.4116 177.8539 180 K 4.2012 8.5420 119.8733 56.3825 32.1426 176.6339 181 K 4.4380 7.0863 116.8893 55.3743 35.5254 175.4557 182 V 3.7018 8.1122 119.5590 62.8033 31.6566 175.3075 183 V 4.4916 7.8290 119.0253 59.0339 35.5364 175.0810 184 Q 4.1280 8.7899 120.7918 55.9621 28.9855 176.3068 185 L 4.5120 8.2581 122.5285 52.9577 42.9451 175.0201 186 P 4.5381 0.0000 0.0000 62.1171 32.4731 175.2399 187 D 4.7223 8.1714 119.1540 52.9191 42.0853 175.7219 188 Y 4.3210 8.4180 121.6157 59.1382 39.1331 174.9585 189 H 4.5130 8.0111 120.5238 54.8476 32.6785 171.7975 190 F 5.2738 8.9938 115.7862 55.7717 43.3498 175.0645 191 V 4.6070 8.4946 119.7967 61.4386 34.5579 174.1457 192 D 5.1096 9.1184 129.0269 54.5064 42.1274 175.4472 193 H 5.3110 9.4553 119.0667 54.5798 33.6845 172.7808 194 H 4.8771 8.7256 121.5118 55.7129 32.3421 171.6982 195 I 5.0600 8.5267 126.3061 59.4431 40.2314 174.4621 196 E 4.8840 9.2557 127.1796 55.0493 34.4824 174.4474 197 I 4.4876 8.4975 124.7719 60.6117 37.0926 175.9752 198 K 4.2899 8.9928 128.7850 59.2538 32.6548 177.6252 199 S 4.6476 7.5778 112.0016 58.0263 65.8842 173.5887 200 H 4.8703 7.9517 114.1559 54.9976 30.6964 173.0170 201 D 4.4186 8.1074 120.0724 52.2336 41.4238 177.4080 202 K 3.9079 8.3706 117.1712 59.5140 32.1160 177.4258 203 D 4.8360 7.8738 115.5083 53.0674 39.5958 175.7716 204 Y 3.2931 7.7931 114.7243 59.6394 35.9926 171.4282 205 S 4.3975 8.1920 119.1317 60.8691 64.3909 174.2415 206 N 5.5334 8.9315 117.0568 51.2889 41.9914 174.1602 207 V 4.6605 8.6567 122.3665 61.1714 35.6185 173.1787 208 N 5.3003 9.2625 127.0742 52.0291 40.6038 172.9586 209 L 5.3265 9.0265 128.9477 53.6913 45.1237 174.7769 210 H 5.4799 9.3323 121.8383 54.3386 33.2719 172.0255 211 E 5.3571 8.9775 120.9000 55.2967 33.6424 173.5248 212 H 5.5808 9.0710 120.0471 54.2057 32.1997 172.0508 213 A 5.4418 9.3016 123.0190 49.5874 23.1266 174.6181 214 E 5.0020 8.4199 118.0213 54.8081 34.0460 174.7326 215 A 4.9088 8.5775 126.6095 51.7273 20.3278 175.9253 216 H 4.9943 8.8417 114.1037 54.8010 32.5949 174.2130 217 S 4.5331 8.4941 112.9554 58.7950 63.0996 173.7949 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 M 8.30 4.43 0.00 2.05 1.92 0.00 0.00 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.42 2.11 0.00 2 S 8.35 4.35 0.00 3.96 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 3 V 9.02 3.85 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.80 0.00 0.00 1.04 0.00 0.00 4 I 7.46 4.19 2.07 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.80 0.60 0.00 0.00 5 K 8.28 4.86 0.00 1.76 1.75 0.00 1.80 0.00 0.00 1.73 0.00 0.00 3.28 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.38 1.42 7.81 6 P 0.00 4.64 0.00 2.24 2.23 0.00 3.60 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.13 0.00 7 D 8.07 5.48 0.00 2.56 2.61 0.00 0.00 0.00 0.00 0.00 0.00 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 M 9.18 5.05 0.00 2.00 2.16 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.82 2.45 0.00 9 K 9.25 5.10 0.00 1.63 1.71 0.00 1.60 0.00 0.00 1.64 0.00 0.00 2.85 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.37 1.39 7.81 10 I 8.67 5.13 1.88 0.00 0.00 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.93 0.52 0.00 0.00 11 K 8.55 5.06 0.00 1.72 1.53 0.00 1.63 0.00 0.00 1.68 0.00 0.00 2.91 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.31 1.51 7.81 12 L 9.00 5.28 0.00 2.00 1.64 1.10 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 13 R 8.79 5.09 0.00 1.89 1.81 0.00 3.14 0.00 0.00 3.23 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.65 0.00 14 M 9.83 5.30 0.00 2.42 2.16 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.47 0.00 15 E 8.59 4.86 0.00 1.86 1.69 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 2.18 2.21 0.00 16 G 7.90 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 17 A 8.41 5.47 1.26 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 18 V 8.53 4.66 1.82 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 0.78 0.00 0.00 0.18 0.00 0.00 19 N 10.40 4.31 0.00 2.96 2.96 0.00 0.00 7.23 7.33 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 20 G 8.66 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 21 H 8.06 4.99 0.00 3.39 3.39 0.00 5.62 0.00 0.00 0.00 0.00 6.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 P 0.00 5.16 0.00 2.11 2.08 0.00 3.93 0.00 0.00 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.02 0.00 23 F 8.81 5.20 0.00 3.40 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 A 9.24 5.26 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 25 I 9.26 5.26 2.29 0.00 0.00 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.38 0.98 0.00 0.00 26 E 9.17 5.29 0.00 1.90 1.82 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 2.26 2.27 0.00 27 G 8.71 4.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 V 8.44 4.92 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 0.71 0.00 0.00 0.90 0.00 0.00 29 G 8.85 4.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 L 8.30 5.01 0.00 1.84 1.74 0.88 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 31 G 8.64 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 0.00 0.00 0.00 32 K 9.40 5.82 0.00 1.77 1.89 0.00 1.77 0.00 0.00 1.88 0.00 0.00 3.00 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.71 1.27 7.81 33 P 0.00 4.24 0.00 1.64 1.90 0.00 4.11 0.00 0.00 4.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.02 0.00 34 F 8.13 4.49 0.00 3.14 3.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 E 8.42 4.45 0.00 2.17 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 0.00 2.41 2.47 0.00 36 G 7.81 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 37 K 7.92 5.34 0.00 1.72 1.68 0.00 1.74 0.00 0.00 1.90 0.00 0.00 2.91 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.46 1.67 7.81 38 Q 8.72 4.88 0.00 1.49 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.68 0.00 0.00 0.00 0.00 0.00 2.20 2.17 0.00 39 S 8.70 5.15 0.00 3.48 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 40 M 8.94 5.07 0.00 2.02 2.17 0.00 0.00 0.00 0.00 0.00 2.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.47 2.53 0.00 41 D 9.00 5.34 0.00 2.62 2.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 L 9.01 5.10 0.00 1.47 1.38 0.72 -0.21 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 43 K 9.04 5.06 0.00 1.74 1.60 0.00 1.63 0.00 0.00 1.58 0.00 0.00 2.81 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.34 1.36 7.81 44 V 8.71 4.23 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 0.90 0.00 0.00 1.08 0.00 0.00 45 K 9.29 4.56 0.00 1.70 1.87 0.00 1.75 0.00 0.00 1.74 0.00 0.00 2.93 0.00 0.00 3.18 0.00 0.00 0.00 0.00 1.62 1.59 7.81 46 E 7.92 4.62 0.00 2.02 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 2.33 2.35 0.00 47 G 9.24 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 0.00 0.00 0.00 48 G 7.74 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 49 P 0.00 4.41 0.00 2.16 2.20 0.00 3.78 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.97 0.00 50 L 8.36 3.64 0.00 1.13 0.32 0.54 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 51 P 0.00 4.59 0.00 2.17 2.09 0.00 3.55 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 1.97 0.00 52 F 6.53 4.90 0.00 2.80 2.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53 A 8.54 3.75 1.18 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 54 Y 8.21 3.80 0.00 2.47 2.72 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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 66 R 8.22 3.88 0.00 0.75 0.66 0.00 3.22 0.00 0.00 3.12 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.79 1.18 0.00 67 V 7.82 3.66 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 -0.44 0.00 0.00 0.67 0.00 0.00 68 F 7.58 4.58 0.00 3.22 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 69 A 7.26 4.81 1.23 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 70 K 9.12 4.21 0.00 1.98 1.76 0.00 1.69 0.00 0.00 1.86 0.00 0.00 2.87 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.49 1.67 7.81 71 Y 8.54 4.76 0.00 3.04 2.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 P 0.00 4.56 0.00 2.37 2.02 0.00 3.67 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 2.10 0.00 73 E 8.68 4.04 0.00 1.95 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 0.00 2.32 2.39 0.00 74 N 8.16 4.68 0.00 2.91 2.95 0.00 0.00 5.82 7.81 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 75 I 7.29 4.51 2.09 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 1.25 0.76 0.94 0.00 0.00 76 V 8.43 3.48 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 0.71 0.00 0.00 0.91 0.00 0.00 77 D 8.16 3.71 0.00 2.41 2.33 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 78 Y 7.78 3.69 0.00 2.44 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 79 F 7.22 3.82 0.00 3.05 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 80 K 8.40 4.18 0.00 1.73 1.84 0.00 1.65 0.00 0.00 1.24 0.00 0.00 2.13 0.00 0.00 2.46 0.00 0.00 0.00 0.00 1.31 1.60 7.81 81 Q 7.54 4.10 0.00 1.93 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 7.00 0.00 0.00 0.00 0.00 0.00 2.32 2.39 0.00 82 S 7.52 3.94 0.00 3.74 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 83 F 7.41 4.90 0.00 3.20 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 84 P 0.00 4.73 0.00 2.26 2.27 0.00 3.83 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 2.03 2.03 0.00 85 E 8.34 3.94 0.00 2.06 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 0.00 2.29 2.38 0.00 86 G 9.21 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 0.00 0.00 0.00 87 Y 7.45 5.14 0.00 3.18 2.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 88 S 9.19 5.05 0.00 3.83 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 89 W 8.66 5.88 0.00 3.26 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 90 E 9.28 5.35 0.00 1.90 1.82 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 2.17 2.21 0.00 91 R 9.06 5.05 0.00 1.74 1.85 0.00 2.51 0.00 0.00 2.25 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 1.39 0.00 92 S 8.84 4.98 0.00 3.84 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 93 M 9.15 4.71 0.00 1.60 1.83 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 0.81 0.00 94 N 8.91 4.95 0.00 2.75 2.67 0.00 0.00 6.85 8.22 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 95 Y 8.97 4.65 0.00 3.23 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 96 E 8.97 4.06 0.00 2.14 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.49 0.00 97 D 8.48 4.78 0.00 2.92 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 98 G 8.34 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 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0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 1.05 0.96 0.00 0.00 116 Y 8.99 5.41 0.00 2.91 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 0.00 117 E 9.06 4.80 0.00 2.06 1.77 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 2.16 2.25 0.00 118 I 8.65 4.98 2.06 0.00 0.00 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 1.00 0.91 0.00 0.00 119 R 8.55 5.14 0.00 1.82 1.61 0.00 3.20 0.00 0.00 3.03 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.64 0.00 120 F 8.97 5.17 0.00 3.13 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 0.00 121 D 8.77 5.06 0.00 2.49 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 0.00 122 G 9.19 4.58 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 0.00 0.00 0.00 123 V 8.27 4.88 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 0.71 0.00 0.00 0.89 0.00 0.00 124 N 8.69 4.31 0.00 2.72 2.82 0.00 0.00 6.95 7.45 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 0.00 125 F 8.09 4.45 0.00 3.22 2.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 126 P 0.00 4.37 0.00 2.21 2.00 0.00 3.85 0.00 0.00 4.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.13 0.00 127 A 8.76 4.02 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 0.00 128 N 8.05 4.70 0.00 2.80 2.91 0.00 0.00 6.00 7.00 0.00 0.00 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 7.83 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 0.00 0.00 0.00 130 P 0.00 4.12 0.00 1.50 1.79 0.00 3.03 0.00 0.00 3.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 1.81 0.00 131 V 7.24 3.29 1.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.31 0.00 0.00 0.61 0.00 0.00 132 M 7.80 4.08 0.00 2.02 2.34 0.00 0.00 0.00 0.00 0.00 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.66 2.64 0.00 133 Q 7.71 4.29 0.00 2.03 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.62 0.00 0.00 0.00 0.00 0.00 2.29 2.56 0.00 134 K 7.54 3.66 0.00 1.76 1.69 0.00 1.62 0.00 0.00 1.56 0.00 0.00 2.86 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.24 1.32 7.81 135 R 8.41 4.69 0.00 1.57 1.80 0.00 3.05 0.00 0.00 3.17 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.63 0.00 136 T 7.75 4.59 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 1.09 0.00 0.00 137 V 8.39 4.21 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 0.81 0.00 0.00 0.93 0.00 0.00 138 K 7.26 4.34 0.00 2.03 1.91 0.00 1.42 0.00 0.00 1.72 0.00 0.00 2.96 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.26 1.39 7.81 139 W 8.92 5.12 0.00 3.27 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 0.00 140 E 9.17 4.44 0.00 1.94 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 2.61 2.50 0.00 141 P 0.00 4.67 0.00 1.86 1.85 0.00 3.63 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 1.89 1.59 0.00 142 S 9.00 4.67 0.00 3.70 3.80 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 0.00 143 T 8.21 4.99 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 0.00 144 E 9.35 4.47 0.00 2.05 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 2.28 2.43 0.00 145 K 9.14 4.59 0.00 1.78 1.58 0.00 1.80 0.00 0.00 1.75 0.00 0.00 3.31 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.57 1.59 7.81 146 L 8.09 5.15 0.00 1.02 1.28 0.81 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 147 Y 8.07 5.06 0.00 3.10 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 0.00 148 V 8.39 4.26 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 0.76 0.00 0.00 0.89 0.00 0.00 149 R 8.83 4.49 0.00 1.94 1.62 0.00 3.39 0.00 0.00 3.22 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.65 0.00 150 D 9.82 4.53 0.00 2.81 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 0.00 151 G 8.37 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 0.00 152 V 7.61 4.57 2.29 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 0.72 0.00 0.00 0.99 0.00 0.00 153 L 7.98 4.61 0.00 0.57 0.84 0.63 -0.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 0.00 0.00 0.00 0.00 154 K 8.60 4.85 0.00 0.79 1.06 0.00 1.52 0.00 0.00 1.46 0.00 0.00 2.76 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.02 1.16 7.81 155 G 8.80 4.49 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 0.00 0.00 0.00 156 D 9.22 5.83 0.00 2.70 2.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 157 V 8.36 4.43 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 0.36 0.00 0.00 0.76 0.00 0.00 158 N 8.70 4.83 0.00 2.58 2.77 0.00 0.00 6.88 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 0.00 159 M 8.83 4.68 0.00 1.43 1.57 0.00 0.00 0.00 0.00 0.00 0.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 1.56 0.00 160 A 8.56 5.23 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 0.00 161 L 9.02 4.96 0.00 1.71 1.42 0.69 -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 0.00 162 S 8.93 4.55 0.00 3.81 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 0.00 163 L 8.38 5.08 0.00 1.77 1.53 0.90 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 164 E 8.71 4.16 0.00 1.85 1.83 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 2.30 2.28 0.00 165 G 8.55 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 0.00 166 G 8.21 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 0.00 167 G 8.91 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 0.00 168 H 8.37 5.47 0.00 3.03 3.26 0.00 5.84 0.00 0.00 0.00 0.00 6.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 169 Y 9.08 5.05 0.00 2.92 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 0.00 170 R 9.80 4.86 0.00 1.85 1.80 0.00 3.55 0.00 0.00 3.10 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.75 0.00 171 C 8.91 4.87 0.00 2.38 2.74 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 0.00 172 D 8.97 5.32 0.00 2.64 2.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173 F 9.05 5.22 0.00 2.84 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 0.00 174 K 8.72 4.77 0.00 1.63 1.65 0.00 1.61 0.00 0.00 1.75 0.00 0.00 2.85 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.51 1.24 7.81 175 T 8.91 4.96 3.80 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 0.23 0.00 0.00 176 T 8.73 4.72 4.19 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 1.18 0.00 0.00 177 Y 9.33 5.44 0.00 2.83 3.18 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 0.00 178 K 9.80 4.85 0.00 1.74 1.79 0.00 1.71 0.00 0.00 1.69 0.00 0.00 2.85 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.41 1.45 7.81 179 A 9.31 4.36 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 180 K 8.54 4.20 0.00 1.80 1.81 0.00 1.86 0.00 0.00 1.73 0.00 0.00 2.99 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.45 1.43 7.81 181 K 7.09 4.44 0.00 1.89 1.69 0.00 1.55 0.00 0.00 1.73 0.00 0.00 2.94 0.00 0.00 2.75 0.00 0.00 0.00 0.00 1.21 1.26 7.81 182 V 8.11 3.70 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 0.80 0.00 0.00 0.91 0.00 0.00 183 V 7.83 4.49 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 0.57 0.00 0.00 0.48 0.00 0.00 184 Q 8.79 4.13 0.00 2.21 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.23 6.71 0.00 0.00 0.00 0.00 0.00 2.38 2.30 0.00 185 L 8.26 4.51 0.00 1.63 1.56 0.92 1.16 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 0.00 186 P 0.00 4.54 0.00 2.16 2.16 0.00 3.61 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 1.89 1.85 0.00 187 D 8.17 4.72 0.00 2.74 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 0.00 188 Y 8.42 4.32 0.00 2.92 2.82 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 0.00 189 H 8.01 4.51 0.00 3.37 3.32 0.00 5.26 0.00 0.00 0.00 0.00 6.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 190 F 8.99 5.27 0.00 2.54 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 0.00 191 V 8.49 4.61 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 0.71 0.00 0.00 0.79 0.00 0.00 192 D 9.12 5.11 0.00 2.61 2.53 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 0.00 193 H 9.46 5.31 0.00 2.89 3.06 0.00 5.62 0.00 0.00 0.00 0.00 6.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 194 H 8.73 4.88 0.00 3.01 2.99 0.00 5.54 0.00 0.00 0.00 0.00 6.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 195 I 8.53 5.06 1.93 0.00 0.00 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 1.54 1.35 1.07 0.00 0.00 196 E 9.26 4.88 0.00 1.92 1.80 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 2.29 2.21 0.00 197 I 8.50 4.49 2.00 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 1.52 0.70 1.03 0.00 0.00 198 K 8.99 4.29 0.00 1.56 1.77 0.00 1.63 0.00 0.00 1.67 0.00 0.00 2.88 0.00 0.00 2.72 0.00 0.00 0.00 0.00 1.27 0.85 7.81 199 S 7.58 4.65 0.00 3.74 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 0.00 200 H 7.95 4.87 0.00 2.56 2.96 0.00 5.71 0.00 0.00 0.00 0.00 6.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 201 D 8.11 4.42 0.00 2.77 2.76 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 0.00 202 K 8.37 3.91 0.00 1.73 1.87 0.00 1.71 0.00 0.00 1.72 0.00 0.00 3.04 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.40 1.40 7.81 203 D 7.87 4.84 0.00 2.77 2.75 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 0.00 204 Y 7.79 3.29 0.00 3.01 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 0.00 205 S 8.19 4.40 0.00 3.90 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 0.00 206 N 8.93 5.53 0.00 2.73 2.60 0.00 0.00 6.30 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 0.00 207 V 8.66 4.66 1.86 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 0.81 0.00 0.00 0.31 0.00 0.00 208 N 9.26 5.30 0.00 2.82 2.65 0.00 0.00 6.34 6.27 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 0.00 209 L 9.03 5.33 0.00 1.88 1.54 1.18 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 210 H 9.33 5.48 0.00 3.07 3.15 0.00 5.68 0.00 0.00 0.00 0.00 6.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 211 E 8.98 5.36 0.00 2.09 1.76 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 2.26 2.32 0.00 212 H 9.07 5.58 0.00 3.37 3.37 0.00 5.46 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 213 A 9.30 5.44 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 0.00 214 E 8.42 5.00 0.00 1.87 1.77 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 2.31 2.35 0.00 215 A 8.58 4.91 0.40 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 0.00 216 H 8.84 4.99 0.00 3.21 3.35 0.00 5.21 0.00 0.00 0.00 0.00 6.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 217 S 8.49 4.53 0.00 4.07 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 * Residues marked with a * may have inaccurate shift predictions.