NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 16 V 4.1228 7.9127 120.3975 62.3214 32.0782 174.3060 17 V 4.1749 8.2587 129.0087 62.7276 32.0554 174.6923 18 G 4.1173 8.3268 117.0854 46.1126 0.0000 171.2038 19 G 4.2887 7.7480 103.7447 44.6565 0.0000 172.6461 20 T 4.7373 8.1604 110.2704 59.6482 72.1682 173.3974 21 R 4.5919 7.8475 120.4556 55.3238 30.6929 177.1451 22 A 4.3487 8.5983 126.4354 51.9631 19.1165 177.3699 23 A 4.0469 9.1923 125.8888 51.3855 19.2085 176.9055 24 Q 4.1184 8.5292 122.3835 57.9441 29.2538 177.3098 25 G 3.8984 8.9105 113.3352 45.3381 0.0000 173.6584 26 E 3.6188 7.3051 120.2957 57.7521 29.9617 177.4506 27 F 4.2695 7.0365 123.3565 55.3759 38.1749 174.1247 28 P 4.5941 0.0000 0.0000 62.5750 31.9264 177.0961 29 F 4.7475 6.6140 113.7053 57.8648 39.1644 175.3668 30 M 4.7872 7.1925 120.7495 55.7593 32.6188 175.9833 31 V 4.7091 9.2940 122.7868 61.1129 35.5246 173.8920 32 R 4.6950 8.5071 127.4636 54.5835 31.9215 174.4699 33 L 5.0738 8.6418 126.4691 53.0682 44.6749 175.7142 34 I 4.3053 8.0834 122.8169 59.7293 40.6546 174.1640 35 N 5.0363 8.8160 128.3279 51.0403 37.9560 175.2740 36 E 4.0167 8.3134 117.9197 56.8375 30.0052 176.8558 37 E 4.4004 9.6839 120.3661 57.5913 31.0403 176.6195 38 N 4.6818 8.0220 111.7252 52.0673 37.9888 174.0553 39 E 3.7399 8.2804 116.3945 57.9691 26.3258 174.3299 40 G 4.3344 7.7058 104.1748 44.4590 0.0000 172.5482 41 F 5.3439 9.1663 122.0430 56.0605 41.6628 174.9712 42 C 5.2055 9.0675 121.2728 55.0983 44.4325 173.3613 43 G 4.5326 9.1875 108.8604 45.4785 0.0000 172.7867 44 G 4.5773 8.3976 104.5559 45.0053 0.0000 172.3496 45 A 5.5227 8.9783 121.7472 49.7501 22.9442 175.9850 46 L 4.4749 8.9144 121.3131 55.0624 41.6875 177.7899 47 Y 3.9535 9.4110 125.9941 59.9819 39.2910 175.8085 48 A 4.9829 7.6812 120.8116 49.7809 21.6841 177.0674 49 Q 4.1606 8.5744 117.9860 58.4590 28.9689 177.9235 50 D 5.1083 8.1462 115.5467 52.6151 41.5399 174.7988 51 I 5.1165 8.0691 120.4517 59.9179 40.7234 174.3854 52 V 4.8762 8.9365 127.4063 61.1191 33.8194 174.2357 53 L 4.6502 9.9769 130.4520 55.1525 43.8225 175.5658 54 T 4.7000 8.2934 118.4854 61.7857 71.3886 171.7105 55 A 4.3793 8.3958 123.5254 51.2589 19.6420 178.4992 56 A 3.4649 8.2779 125.4185 55.2960 18.3241 179.2480 57 H 4.2631 7.3311 107.5410 56.5319 28.7610 176.4236 58 C 4.4256 7.2829 117.0808 57.8001 40.3876 173.1926 59 V 4.5008 7.1236 111.9261 60.2318 35.5740 174.7812 60 S 4.5123 8.6563 115.0849 59.8535 64.0115 174.6323 60A G 4.1678 7.4834 105.2963 43.9129 0.0000 171.4980 60B S 4.5215 8.1335 115.5172 57.1572 64.6060 172.2974 60C G 3.7586 8.2957 105.7481 44.3407 0.0000 172.5281 60D N 4.8558 8.4090 115.9996 52.9634 39.2848 174.8036 61 N 4.6372 8.7688 121.4802 53.2598 41.3515 174.1038 62 T 5.1154 8.3937 114.8451 61.3001 69.5592 175.4692 63 S 4.2531 8.2552 117.6636 60.5674 62.9615 174.1912 64 I 4.3323 7.9919 121.5119 60.6634 38.9347 175.5639 65 T 4.8535 8.4721 122.2092 61.7155 71.0670 172.7513 66 A 4.7223 8.4595 129.1757 51.3963 20.2929 175.9675 67 T 4.8916 8.8513 119.9187 61.9884 71.5482 174.1969 68 G 4.3876 8.4098 111.3099 45.8094 0.0000 172.7031 69 G 4.2658 9.1632 108.8977 45.2927 0.0000 174.3955 70 V 4.6830 7.6759 111.3582 59.8305 33.8770 176.1360 71 V 4.3882 8.3910 115.0606 62.2734 33.1363 174.9921 72 D 5.2303 8.1108 120.2064 52.3739 41.8006 176.2195 73 L 3.7648 9.1083 127.8173 57.4630 41.9585 179.5687 *75 Q 4.4217 8.0621 116.3584 56.7329 30.7916 175.6203 76 S 3.7652 8.7639 111.1227 57.8106 62.3642 176.1526 77 S 3.7269 8.0362 122.7248 61.0725 64.5324 175.9306 *79 S 4.3481 8.1288 114.0975 57.9010 64.5591 173.5541 80 A 4.0413 7.3477 122.3907 50.9510 19.2023 176.8139 81 V 4.2625 8.2485 119.9408 61.2112 33.5292 174.5221 82 K 4.8950 8.5545 128.1245 55.2424 33.5213 176.4976 83 V 4.4366 8.5879 124.6260 61.0596 35.0292 174.6558 84 R 4.8227 8.5621 126.6999 55.4778 31.6593 176.3210 85 S 4.7423 9.0949 118.5332 59.2865 64.0378 174.2215 86 T 4.4453 8.7063 109.5853 62.7704 71.0838 173.9054 87 K 5.1078 7.8133 119.8574 54.7261 36.6790 174.7441 88 V 4.6798 9.3668 122.1324 61.0436 34.6712 173.9892 89 L 4.8031 9.0180 130.2666 53.3349 43.9351 174.4555 90 Q 4.2233 8.7891 128.5094 55.2486 29.9203 174.7740 91 A 2.8067 6.7672 127.4824 50.2335 18.3684 174.9732 92 P 4.2046 0.0000 0.0000 64.2320 32.0197 177.1345 93 G 3.9795 8.8877 110.3967 44.9724 0.0000 173.0789 94 F 4.8946 7.8728 122.4417 57.2485 39.9287 174.4431 95 T 3.9749 7.8217 118.0433 59.2046 70.0835 174.8237 96 K 3.6265 8.0058 128.2823 59.3796 32.2338 178.2644 97 E 4.0111 7.9522 117.0074 58.9633 29.4096 177.4971 98 T 4.3521 7.6857 104.7294 60.2854 70.5461 173.2023 99 Y 4.0254 7.8230 117.6878 59.0735 36.5137 170.5061 100 G 3.8811 7.7906 108.8178 46.3734 0.0000 174.7597 101 K 3.7575 8.8297 121.7047 57.5693 28.9987 177.2108 102 D 4.5702 7.9808 119.0535 52.6860 40.0482 174.8104 103 W 5.4655 7.3533 118.3652 54.8021 32.2018 173.7897 104 A 4.7281 9.0908 121.5212 51.1543 22.6331 175.4020 105 L 5.2396 9.0435 120.8903 53.3785 45.1346 175.7673 106 I 4.9996 8.2200 120.4494 59.6814 41.5657 174.6353 107 K 4.8141 9.3637 128.4493 55.6642 33.8599 175.5281 108 L 4.9015 9.0401 126.1315 53.3399 43.7078 176.9012 109 A 4.0646 8.4066 123.2357 55.3118 18.7108 178.9432 110 Q 4.3392 7.7051 112.6230 54.9422 29.9060 173.6567 111 P 4.9060 0.0000 0.0000 61.1405 33.2436 175.3950 112 I 4.2508 9.0165 123.2993 60.1209 38.3254 176.9447 113 N 4.4223 8.3579 126.7632 52.3441 37.1522 173.0719 *118 Q 5.0173 7.4465 119.3404 54.9590 30.5865 172.8637 119 P 4.6361 0.0000 0.0000 62.2076 32.2196 176.2581 120 T 4.6146 8.2322 112.1579 60.0909 70.9989 173.1291 121 L 4.2538 7.7823 123.9023 53.0412 43.1161 176.1103 122 K 4.3028 8.5314 127.8842 56.3330 33.6312 175.1460 123 I 4.8484 8.1252 118.6225 58.6581 39.6432 175.0670 124 A 4.3341 8.6995 127.4650 52.4326 19.2619 178.0550 125 T 4.2160 8.6236 110.1400 61.8718 69.8490 173.3964 *128 T 4.1386 7.7672 115.5985 62.7762 68.2845 172.9124 129 T 4.6491 8.2590 109.6368 60.3265 69.4472 176.0811 130 A 3.6681 8.0873 126.3516 55.3109 18.2246 178.1032 131 Y 4.7996 7.7002 110.6249 58.2043 38.4643 175.4881 132 N 4.9964 8.0985 117.1308 53.6186 38.9892 174.5862 133 Q 4.3008 7.5778 114.9822 54.8721 34.1623 177.2017 134 G 3.6448 8.2705 105.1548 46.5322 0.0000 173.3164 135 T 4.5714 8.1639 120.9319 62.0672 69.8938 174.3376 136 F 5.1219 8.3578 125.9603 56.4602 41.3819 175.2382 137 T 4.6513 8.9635 119.9963 62.5850 70.1629 174.3941 138 V 4.4470 8.1081 117.8013 59.7603 35.8800 174.3565 139 A 4.9632 6.9275 121.6234 52.0235 22.2587 175.9508 140 G 3.7559 7.5380 104.8501 46.5375 0.0000 173.7070 141 W 4.6874 8.5331 118.4116 56.2144 29.3868 176.7995 142 G 4.3187 8.5265 109.1432 44.3168 0.0000 173.3304 143 A 4.7501 8.7497 122.4081 51.7259 18.8591 177.6498 144 N 4.7510 9.0104 117.8435 52.6006 38.7066 175.0292 145 R 4.7913 7.5374 115.3378 53.5571 32.2329 174.6696 146 E 4.0542 8.5903 121.2053 56.5837 29.7291 177.6097 *148 G 4.2334 8.0699 114.3944 45.0199 0.0000 172.4515 149 G 3.8929 7.7380 109.0368 44.7499 0.0000 173.3558 150 S 4.4852 8.2028 114.5775 57.8042 64.5453 174.5294 151 Q 4.4079 8.4914 120.4659 56.5337 29.8998 176.3847 152 Q 4.8162 9.1030 121.7299 55.6598 30.2906 175.3567 153 R 4.4475 8.7469 118.2064 56.9385 32.7547 174.9275 154 Y 5.4237 7.9463 115.5071 55.4909 40.5440 175.7130 155 L 3.0986 9.1799 126.4228 55.6174 43.0751 175.7473 156 L 5.3016 8.2408 125.9205 52.8984 44.5991 175.5611 157 K 4.9891 9.0244 120.9822 55.5035 35.9295 174.7125 158 A 4.8824 8.5935 121.6135 51.2990 23.1099 174.7484 159 N 5.4045 9.5457 117.1459 51.9019 41.2173 175.3808 160 V 4.3264 8.4609 115.0772 59.1994 36.4396 172.8845 161 P 4.5965 0.0000 0.0000 62.0302 32.9593 175.3294 162 F 4.4096 8.5058 124.6778 58.4528 39.9550 174.3846 163 V 3.8983 7.2687 126.3164 60.2630 33.2185 175.7209 164 S 4.2816 8.0754 121.8749 58.0698 63.6569 174.1604 165 D 4.2832 8.9148 119.9664 57.9605 40.9342 178.0788 166 A 3.9458 8.1012 119.4559 55.6753 18.1381 178.9281 167 A 3.9391 8.0003 118.1247 55.4736 18.3848 178.8592 168 C 4.4033 8.1406 117.9699 59.2259 38.3168 175.2180 169 R 3.9732 8.6280 120.8726 59.9953 29.3282 178.3374 170 S 4.1755 7.8187 113.1129 61.6581 63.0439 176.7027 171 S 4.3151 8.0086 114.9537 59.1433 62.9125 173.3883 172 S 4.9631 7.3595 117.3742 57.0108 63.8163 173.7366 173 S 4.5545 8.8724 121.6151 58.5318 63.3387 173.7580 174 F 4.7594 7.9500 118.2473 55.2280 41.7006 174.4908 175 I 4.3974 8.1484 115.0166 59.6592 38.8381 174.8481 176 L 4.8132 8.4865 124.1864 53.3239 44.1764 175.7716 177 V 4.0372 9.2735 125.8608 62.5730 31.6422 177.5919 177A A 3.1577 7.4088 125.4973 52.1491 20.4874 176.5482 178 N 4.7053 8.5180 118.1390 53.0272 40.4058 176.5885 179 E 4.4427 8.2244 118.0102 58.4342 30.1557 176.1082 180 M 5.5038 8.0745 116.8829 53.4575 35.7678 175.2148 181 I 4.7882 9.0711 121.8221 59.6170 41.9494 173.3050 182 C 5.5754 8.6239 124.9212 55.7248 39.9607 172.4331 183 A 4.7756 8.9392 121.6972 52.0520 22.5748 175.1312 184 G 3.6430 7.5374 106.4010 44.3756 0.0000 172.7762 185 Y 4.9122 8.2272 117.5611 55.9260 41.1357 175.3190 185A D 4.3002 8.8738 120.6722 57.0430 41.6944 177.9855 185B T 4.3168 7.6904 106.9716 62.0204 70.9546 174.6262 186 K 3.6176 8.1340 121.4539 56.9913 32.8405 177.0233 187 Q 4.2708 8.3460 125.4828 55.1306 27.2593 176.6750 188 E 5.4441 7.4500 117.5902 55.0839 32.3756 174.1944 189 D 4.8385 8.4075 125.1229 53.4898 44.8017 174.5412 190 T 4.6327 8.5431 112.8857 61.7343 70.6227 173.7231 191 C 4.7778 9.8354 121.5758 54.6505 47.0635 172.5181 192 Q 4.0412 8.5988 121.6689 58.2612 28.4401 177.5616 193 G 4.2196 9.3353 113.1381 45.0736 0.0000 172.9994 194 D 4.8772 8.1300 118.6674 54.0700 42.6031 176.6650 195 S 4.4875 8.0699 115.3915 60.6212 63.3502 174.4691 196 G 3.9566 8.6702 111.8791 46.5419 0.0000 174.0052 197 G 4.1609 8.0456 106.7501 45.7926 0.0000 171.3272 198 P 5.0980 0.0000 0.0000 62.5846 32.7767 175.0878 199 M 4.3419 9.3746 124.4981 54.4270 33.7205 174.8591 200 F 5.4000 7.7447 120.2371 56.0279 42.4848 172.7493 201 R 5.2919 8.9722 114.0478 55.5171 32.8893 174.2741 202 K 4.6199 8.9940 119.4076 56.6326 32.1599 176.8725 203 D 4.6073 8.6221 123.5192 51.8511 42.0010 176.6431 204 N 4.4999 9.1693 114.3949 55.8428 38.6673 175.4473 204A A 4.5359 7.4177 121.1506 52.8265 19.7074 176.1483 205 D 4.2135 7.9221 115.1402 57.0879 40.0496 172.8197 206 E 4.6435 8.2867 116.5455 53.7239 33.7761 176.8481 207 W 5.0078 8.5490 123.2192 57.0244 29.9052 175.8674 208 V 4.5981 9.4325 124.1197 59.8499 34.5864 174.1163 209 Q 4.8679 8.7687 124.1410 55.4688 29.9463 176.1482 210 V 4.1516 8.5416 118.9815 61.6231 34.5969 175.7434 211 G 4.9417 8.5582 106.4010 45.1917 0.0000 171.6991 212 I 5.0553 8.1902 121.1452 58.7952 40.2633 175.3358 213 V 3.4708 8.7499 126.7497 64.3295 31.7923 174.2156 214 S 4.9201 8.2204 120.2783 58.4719 64.1872 173.7436 215 W 4.8614 6.6679 113.3975 56.9747 31.3163 172.0388 216 G 4.1178 8.3799 105.6148 45.2019 0.0000 173.1503 217 E 4.1655 8.2935 119.1653 56.0233 30.2706 176.7469 215 G 4.1614 6.7479 100.8975 44.5747 0.0000 170.8388 216 C 4.7078 8.3699 115.4148 58.3019 30.4093 172.8504 217 A 4.1355 8.1135 122.7653 51.9233 19.4706 177.9469 222 R 3.9950 7.8585 117.4245 57.0261 30.8495 176.1495 223 K 3.8815 8.5200 120.8307 57.8700 31.7185 176.8368 223A G 4.0290 8.8249 112.0317 45.2929 0.0000 172.6135 224 K 4.3546 7.6295 118.1202 54.4486 34.9002 175.1364 225 Y 4.8342 8.1778 119.6228 56.4153 41.2773 174.4337 226 G 4.0095 8.4383 106.7540 44.8340 0.0000 172.9593 227 V 4.4689 7.6272 123.9533 61.2326 33.9100 173.9770 228 Y 5.1156 8.6056 123.6312 56.1516 42.5200 174.8880 229 T 4.3498 9.1246 121.0720 64.0810 69.8108 173.8422 230 E 4.9524 10.0415 129.4074 55.1131 28.1542 177.3381 231 V 3.6032 8.7887 125.4400 65.4813 32.3458 178.2162 232 S 4.3883 8.1855 112.0463 61.0120 62.6365 175.7794 233 T 3.7517 7.8293 116.6455 65.4375 68.3474 175.6319 234 F 4.5090 7.6490 117.5036 57.1550 39.7150 177.2155 235 A 3.8183 8.0338 122.0205 55.7657 18.0793 178.9582 236 S 3.9678 8.1290 110.2639 61.9044 62.1331 176.0468 237 A 4.0813 7.8000 123.6536 54.8554 18.4186 179.3823 238 I 3.1414 7.7711 118.6148 64.0913 37.4727 177.8882 239 A 4.4034 8.1881 123.1953 54.9512 17.9382 179.9331 240 S 4.2551 7.9938 111.5735 61.0756 63.0050 176.1710 241 A 4.3240 8.3412 123.9341 54.3308 18.6207 179.3158 242 A 4.0119 7.9413 118.9506 55.5619 18.4016 179.7941 243 R 4.1948 7.5362 113.9473 59.0707 30.1769 178.4485 244 T 4.2952 7.5837 107.8200 62.7268 69.4056 174.7347 245 L 4.2237 8.1759 126.7082 54.9844 41.7745 176.3758 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 16 V 7.91 4.12 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 0.98 0.00 0.00 0.97 0.00 0.00 17 V 8.26 4.17 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 0.90 0.00 0.00 0.95 0.00 0.00 18 G 8.33 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 19 G 7.75 4.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 T 8.16 4.74 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 21 R 7.85 4.59 0.00 1.62 1.88 0.00 3.24 0.00 0.00 3.26 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.63 0.00 22 A 8.60 4.35 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 23 A 9.19 4.05 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 24 Q 8.53 4.12 0.00 2.04 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.61 0.00 0.00 0.00 0.00 0.00 2.38 2.45 0.00 25 G 8.91 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 26 E 7.31 3.62 0.00 1.74 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 1.47 1.83 0.00 27 F 7.04 4.27 0.00 2.48 1.71 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 28 P 0.00 4.59 0.00 2.31 2.10 0.00 3.78 0.00 0.00 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.05 0.00 29 F 6.61 4.75 0.00 3.18 3.53 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 30 M 7.19 4.79 0.00 2.08 2.12 0.00 0.00 0.00 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.40 2.35 0.00 31 V 9.29 4.71 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.95 0.00 0.00 0.99 0.00 0.00 32 R 8.51 4.70 0.00 0.67 0.83 0.00 3.18 0.00 0.00 3.18 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.75 1.23 0.00 33 L 8.64 5.07 0.00 1.74 1.45 0.90 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 34 I 8.08 4.31 1.54 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 0.37 0.44 0.08 0.00 0.00 35 N 8.82 5.04 0.00 2.60 2.68 0.00 0.00 6.76 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 E 8.31 4.02 0.00 1.94 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 2.22 2.28 0.00 37 E 9.68 4.40 0.00 1.82 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 2.19 2.18 0.00 38 N 8.02 4.68 0.00 2.89 2.89 0.00 0.00 7.19 7.68 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 39 E 8.28 3.74 0.00 2.20 2.21 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 2.23 2.31 0.00 40 G 7.71 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 41 F 9.17 5.34 0.00 2.89 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 42 C 9.07 5.21 0.00 2.84 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 43 G 9.19 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 44 G 8.40 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 45 A 8.98 5.52 1.34 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 0.00 0.00 0.00 46 L 8.91 4.47 0.00 1.75 1.89 1.01 0.66 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 47 Y 9.41 3.95 0.00 2.92 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 48 A 7.68 4.98 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 49 Q 8.57 4.16 0.00 2.13 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.72 6.81 0.00 0.00 0.00 0.00 0.00 2.63 2.36 0.00 50 D 8.15 5.11 0.00 2.77 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 51 I 8.07 5.12 2.06 0.00 0.00 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 1.19 0.87 1.10 0.00 0.00 52 V 8.94 4.88 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 0.99 0.00 0.00 0.97 0.00 0.00 53 L 9.98 4.65 0.00 1.87 1.56 0.92 0.51 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 54 T 8.29 4.70 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 1.24 0.00 0.00 55 A 8.40 4.38 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 A 8.28 3.46 0.20 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 57 H 7.33 4.26 0.00 2.95 2.55 0.00 5.52 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 C 7.28 4.43 0.00 2.95 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 59 V 7.12 4.50 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 0.59 0.00 0.00 0.78 0.00 0.00 60 S 8.66 4.51 0.00 3.81 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 60A G 7.48 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 60B S 8.13 4.52 0.00 3.82 3.77 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 60C G 8.30 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 60D N 8.41 4.86 0.00 2.72 2.85 0.00 0.00 6.49 8.00 0.00 0.00 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 N 8.77 4.64 0.00 2.58 2.63 0.00 0.00 7.17 7.78 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 62 T 8.39 5.12 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 1.20 0.00 0.00 63 S 8.26 4.25 0.00 3.89 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 64 I 7.99 4.33 1.81 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.49 0.83 0.00 0.00 65 T 8.47 4.85 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 1.13 0.00 0.00 66 A 8.46 4.72 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 67 T 8.85 4.89 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 68 G 8.41 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 0.00 0.00 0.00 0.00 69 G 9.16 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 70 V 7.68 4.68 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 0.79 0.00 0.00 1.02 0.00 0.00 71 V 8.39 4.39 2.20 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 0.79 0.00 0.00 1.14 0.00 0.00 72 D 8.11 5.23 0.00 2.96 2.71 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 73 L 9.11 3.76 0.00 1.52 1.52 0.54 -0.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 *75 Q 8.06 4.42 0.00 2.02 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.54 0.00 0.00 0.00 0.00 0.00 2.08 2.32 0.00 76 S 8.76 3.77 0.00 3.95 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 77 S 8.04 3.73 0.00 4.07 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 *79 S 8.13 4.35 0.00 3.92 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 80 A 7.35 4.04 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 V 8.25 4.26 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 0.99 0.00 0.00 0.93 0.00 0.00 82 K 8.55 4.89 0.00 1.61 1.68 0.00 1.56 0.00 0.00 1.58 0.00 0.00 2.93 0.00 0.00 2.71 0.00 0.00 0.00 0.00 1.32 1.40 7.81 83 V 8.59 4.44 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 1.04 0.00 0.00 0.92 0.00 0.00 84 R 8.56 4.82 0.00 1.79 1.95 0.00 3.16 0.00 0.00 3.36 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.60 0.00 85 S 9.09 4.74 0.00 3.89 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 86 T 8.71 4.45 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 87 K 7.81 5.11 0.00 1.91 2.01 0.00 1.45 0.00 0.00 1.75 0.00 0.00 3.00 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.39 1.44 7.81 88 V 9.37 4.68 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 0.88 0.00 0.00 0.89 0.00 0.00 89 L 9.02 4.80 0.00 1.69 1.54 0.96 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 90 Q 8.79 4.22 0.00 1.89 1.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.36 0.00 0.00 0.00 0.00 0.00 2.08 1.90 0.00 91 A 6.77 2.81 -0.20 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 92 P 0.00 4.20 0.00 2.06 1.97 0.00 3.66 0.00 0.00 3.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.05 0.00 93 G 8.89 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 94 F 7.87 4.89 0.00 2.86 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 95 T 7.82 3.97 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 1.17 0.00 0.00 96 K 8.01 3.63 0.00 1.73 1.77 0.00 1.84 0.00 0.00 1.86 0.00 0.00 2.95 0.00 0.00 3.23 0.00 0.00 0.00 0.00 1.55 1.67 7.81 97 E 7.95 4.01 0.00 1.89 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 2.26 2.29 0.00 98 T 7.69 4.35 4.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 99 Y 7.82 4.03 0.00 2.82 3.22 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 0.00 100 G 7.79 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 101 K 8.83 3.76 0.00 2.06 2.00 0.00 2.09 0.00 0.00 1.83 0.00 0.00 3.47 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.91 2.03 7.81 102 D 7.98 4.57 0.00 3.08 2.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 W 7.35 5.47 0.00 3.22 2.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 104 A 9.09 4.73 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 105 L 9.04 5.24 0.00 1.67 1.63 1.02 0.61 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 0.00 106 I 8.22 5.00 1.88 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.67 0.90 0.00 0.00 107 K 9.36 4.81 0.00 1.85 1.78 0.00 1.76 0.00 0.00 1.68 0.00 0.00 2.95 0.00 0.00 3.36 0.00 0.00 0.00 0.00 1.40 1.47 7.81 108 L 9.04 4.90 0.00 1.64 1.63 0.93 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 109 A 8.41 4.06 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 0.00 110 Q 7.71 4.34 0.00 2.05 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.65 6.75 0.00 0.00 0.00 0.00 0.00 2.36 2.37 0.00 111 P 0.00 4.91 0.00 2.03 1.96 0.00 3.66 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 2.08 0.00 112 I 9.02 4.25 1.99 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.54 0.93 0.00 0.00 113 N 8.36 4.42 0.00 2.81 2.72 0.00 0.00 7.15 6.73 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 *118 Q 7.45 5.02 0.00 2.15 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.78 6.65 0.00 0.00 0.00 0.00 0.00 2.31 2.32 0.00 119 P 0.00 4.64 0.00 2.17 2.04 0.00 3.71 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.10 0.00 120 T 8.23 4.61 4.56 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 1.21 0.00 0.00 121 L 7.78 4.25 0.00 0.57 1.30 0.28 0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 0.00 0.00 0.00 0.00 122 K 8.53 4.30 0.00 1.82 1.74 0.00 1.68 0.00 0.00 1.81 0.00 0.00 2.85 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.47 1.40 7.81 123 I 8.13 4.85 1.89 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.92 1.03 0.00 0.00 124 A 8.70 4.33 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 0.00 125 T 8.62 4.22 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 1.29 0.00 0.00 *128 T 7.77 4.14 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 1.21 0.00 0.00 129 T 8.26 4.65 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 1.17 0.00 0.00 130 A 8.09 3.67 0.68 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 0.00 131 Y 7.70 4.80 0.00 3.02 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 0.00 132 N 8.10 5.00 0.00 2.75 2.73 0.00 0.00 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0.00 0.00 0.00 0.00 150 S 8.20 4.49 0.00 3.80 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 151 Q 8.49 4.41 0.00 1.90 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.83 0.00 0.00 0.00 0.00 0.00 2.29 2.02 0.00 152 Q 9.10 4.82 0.00 2.15 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.62 6.77 0.00 0.00 0.00 0.00 0.00 2.69 2.52 0.00 153 R 8.75 4.45 0.00 1.76 1.64 0.00 2.97 0.00 0.00 2.93 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.95 1.36 0.00 154 Y 7.95 5.42 0.00 2.95 2.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 155 L 9.18 3.10 0.00 0.69 1.34 -0.07 0.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.00 0.00 0.00 0.00 0.00 0.00 156 L 8.24 5.30 0.00 1.59 1.50 1.03 0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 157 K 9.02 4.99 0.00 1.76 2.02 0.00 1.60 0.00 0.00 2.14 0.00 0.00 2.93 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.41 1.43 7.81 158 A 8.59 4.88 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 159 N 9.55 5.40 0.00 2.64 2.78 0.00 0.00 6.73 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 0.00 160 V 8.46 4.33 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 0.76 0.00 0.00 0.93 0.00 0.00 161 P 0.00 4.60 0.00 1.91 2.01 0.00 2.61 0.00 0.00 3.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.61 0.00 162 F 8.51 4.41 0.00 2.76 2.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 163 V 7.27 3.90 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 0.08 0.00 0.00 0.21 0.00 0.00 164 S 8.08 4.28 0.00 4.13 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 0.00 165 D 8.91 4.28 0.00 2.89 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 0.00 166 A 8.10 3.95 1.34 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 0.00 0.00 0.00 167 A 8.00 3.94 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 168 C 8.14 4.40 0.00 2.87 3.22 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 0.00 169 R 8.63 3.97 0.00 2.13 2.17 0.00 3.19 0.00 0.00 3.21 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.77 0.00 170 S 7.82 4.18 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 0.00 171 S 8.01 4.32 0.00 4.34 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 0.00 172 S 7.36 4.96 0.00 4.08 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 0.00 173 S 8.87 4.55 0.00 3.94 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 0.00 174 F 7.95 4.76 0.00 2.88 2.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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1.91 1.04 0.00 0.00 182 C 8.62 5.58 0.00 2.78 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 0.00 183 A 8.94 4.78 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 0.00 184 G 7.54 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 0.00 185 Y 8.23 4.91 0.00 3.00 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 185A D 8.87 4.30 0.00 2.77 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 185B T 7.69 4.32 4.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 186 K 8.13 3.62 0.00 1.43 1.21 0.00 1.26 0.00 0.00 0.61 0.00 0.00 2.80 0.00 0.00 2.70 0.00 0.00 0.00 0.00 1.01 1.23 7.81 187 Q 8.35 4.27 0.00 2.16 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.87 6.61 0.00 0.00 0.00 0.00 0.00 2.43 2.39 0.00 188 E 7.45 5.44 0.00 1.81 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.41 0.00 189 D 8.41 4.84 0.00 2.81 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 0.00 190 T 8.54 4.63 4.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 191 C 9.84 4.78 0.00 2.89 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 0.00 192 Q 8.60 4.04 0.00 2.11 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 5.23 0.00 0.00 0.00 0.00 0.00 2.49 2.38 0.00 193 G 9.34 4.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 194 D 8.13 4.88 0.00 2.89 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 0.00 195 S 8.07 4.49 0.00 3.93 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 0.00 196 G 8.67 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 0.00 197 G 8.05 4.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 198 P 0.00 5.10 0.00 2.33 2.18 0.00 3.94 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 2.41 2.24 0.00 199 M 9.37 4.34 0.00 1.76 1.47 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 1.84 0.00 200 F 7.74 5.40 0.00 3.21 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 0.00 201 R 8.97 5.29 0.00 2.14 2.48 0.00 3.21 0.00 0.00 3.68 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.75 0.00 202 K 8.99 4.62 0.00 1.60 1.62 0.00 1.39 0.00 0.00 1.28 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.58 0.95 7.81 203 D 8.62 4.61 0.00 2.19 2.06 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 0.00 204 N 9.17 4.50 0.00 2.87 2.98 0.00 0.00 6.68 7.35 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 204A A 7.42 4.54 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 0.00 205 D 7.92 4.21 0.00 2.62 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 0.00 206 E 8.29 4.64 0.00 1.77 1.70 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 2.39 2.32 0.00 207 W 8.55 5.01 0.00 2.94 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 0.00 208 V 9.43 4.60 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 0.41 0.00 0.00 0.85 0.00 0.00 209 Q 8.77 4.87 0.00 2.12 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.62 0.00 0.00 0.00 0.00 0.00 2.30 2.61 0.00 210 V 8.54 4.15 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 0.66 0.00 0.00 0.04 0.00 0.00 211 G 8.56 4.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 212 I 8.19 5.06 1.95 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 1.28 0.76 0.96 0.00 0.00 213 V 8.75 3.47 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.90 0.00 0.00 1.17 0.00 0.00 214 S 8.22 4.92 0.00 4.00 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 0.00 215 W 6.67 4.86 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 0.00 216 G 8.38 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 0.00 217 E 8.29 4.17 0.00 2.13 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 2.56 2.56 0.00 215 G 6.75 4.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 216 C 8.37 4.71 0.00 2.60 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 0.00 217 A 8.11 4.14 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 0.00 222 R 7.86 4.00 0.00 1.86 1.83 0.00 3.19 0.00 0.00 3.35 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.65 0.00 223 K 8.52 3.88 0.00 1.71 1.80 0.00 1.81 0.00 0.00 1.70 0.00 0.00 2.97 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.44 1.47 7.81 223A G 8.82 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 0.00 224 K 7.63 4.35 0.00 1.62 1.63 0.00 1.75 0.00 0.00 1.78 0.00 0.00 2.86 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.47 1.51 7.81 225 Y 8.18 4.83 0.00 2.84 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 0.00 226 G 8.44 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 0.00 227 V 7.63 4.47 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 0.72 0.00 0.00 -0.14 0.00 0.00 228 Y 8.61 5.12 0.00 3.02 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 0.00 229 T 9.12 4.35 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 1.24 0.00 0.00 230 E 10.04 4.95 0.00 2.15 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 0.00 2.34 2.31 0.00 231 V 8.79 3.60 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 1.05 0.00 0.00 0.95 0.00 0.00 232 S 8.19 4.39 0.00 4.07 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 0.00 233 T 7.83 3.75 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 0.53 0.00 0.00 234 F 7.65 4.51 0.00 2.69 2.50 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 0.00 235 A 8.03 3.82 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 0.00 236 S 8.13 3.97 0.00 3.85 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 0.00 237 A 7.80 4.08 1.44 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 0.00 0.00 238 I 7.77 3.14 1.60 0.00 0.00 0.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 -0.36 0.26 0.00 0.00 239 A 8.19 4.40 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 0.00 240 S 7.99 4.26 0.00 4.03 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 0.00 241 A 8.34 4.32 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 0.00 242 A 7.94 4.01 1.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 243 R 7.54 4.19 0.00 1.91 2.07 0.00 3.18 0.00 0.00 3.31 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.72 0.00 244 T 7.58 4.30 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 0.00 245 L 8.18 4.22 0.00 1.86 1.66 0.97 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.