NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 S 4.4589 8.1927 115.4139 57.5282 64.7412 173.9065 3 L 3.3154 8.5078 122.0968 57.6462 41.4273 177.6103 4 R 3.3483 7.6114 118.5141 59.1825 30.6819 177.8684 5 S 3.9028 7.4383 112.8482 61.5044 62.9083 175.6570 6 D 4.2720 8.1279 122.1358 56.9272 40.8095 178.2009 7 L 3.8303 7.6690 120.5911 58.0850 42.0953 178.7907 8 I 3.3256 7.5741 118.6672 63.9441 37.7134 177.6684 9 N 4.2555 7.8412 117.0227 56.0294 38.1031 177.2644 10 A 4.0043 7.6788 121.4371 55.0909 18.5349 179.4288 11 L 4.1249 7.7595 116.6105 58.2774 41.8382 178.9800 12 Y 4.5128 8.2101 115.7520 59.5706 38.1264 176.2427 13 D 4.7383 7.6603 121.5111 54.2686 42.7139 176.4115 14 E 4.0955 8.8123 122.5051 57.3076 29.2861 173.2311 *19 D 4.7214 8.1022 119.8040 51.6268 40.4018 173.4931 20 V 3.7729 8.2498 122.5305 62.3950 31.5485 176.7786 21 C 4.6054 8.3272 115.2724 56.9247 30.7986 172.9508 22 G 4.0184 7.1369 105.8595 46.5334 0.0000 172.4808 23 I 4.6933 8.5762 120.5333 59.3972 39.9759 174.9841 24 I 4.9006 8.5245 127.1036 59.5885 39.8928 175.0287 25 S 4.7975 8.9051 124.5616 56.4481 65.0973 175.1341 26 A 4.0176 8.5956 124.3452 55.7210 18.0566 178.5399 27 E 4.2949 8.1647 112.3379 56.6023 29.2898 177.4412 28 G 4.0660 8.3404 112.7215 45.9502 0.0000 175.6293 29 K 4.2739 7.7618 122.8299 55.3958 33.1438 180.6162 30 I 4.9838 8.5646 124.5125 59.2293 40.2660 174.1006 31 Y 5.1728 9.1085 125.0439 55.3579 40.4411 173.9385 32 P 4.5779 0.0000 0.0000 62.6329 32.0078 176.0067 33 L 3.9004 7.9655 120.8944 55.5455 42.2208 179.5358 34 G 3.7809 7.7166 106.0879 45.0004 0.0000 172.3680 35 S 4.3883 8.3352 113.4549 59.9551 63.9178 175.2581 36 D 4.0974 7.8031 124.5338 55.3269 40.0496 183.2017 *38 K 4.4020 8.2289 119.9031 55.0064 33.8084 181.0228 39 V 3.5671 7.8517 121.2599 66.1600 31.3073 178.1716 40 L 3.6572 7.7437 119.8849 56.6508 41.5151 179.7244 41 S 4.3599 8.0398 115.3352 61.8573 62.9856 176.5302 42 T 3.9577 7.9033 112.5235 64.7342 68.4580 176.6873 43 I 3.4412 7.7434 122.7690 64.1821 37.2143 178.3814 44 F 4.0721 7.8135 118.0250 59.8276 38.7655 177.7442 45 E 4.3585 8.1030 118.6138 59.1339 29.1150 179.0290 46 L 4.1318 7.8499 118.1755 58.0686 41.8675 179.4527 47 F 4.2987 8.2478 116.1008 60.4712 39.0447 177.5983 48 S 4.4114 7.9686 113.9045 61.2017 62.6360 176.2907 49 R 3.8575 7.9561 120.5146 59.2375 29.8606 176.6622 50 P 4.2092 0.0000 0.0000 65.9606 31.4185 178.4197 51 I 3.6710 7.7582 117.5818 64.6380 37.0605 178.3960 52 I 3.5462 7.5802 120.2403 64.4090 36.9813 178.0889 53 N 4.3624 8.4989 120.0979 56.9003 38.4072 178.0974 54 K 3.9406 8.3588 125.2463 60.1221 31.5968 180.9838 55 I 4.1006 7.5306 119.6032 63.6393 37.2829 178.0524 56 A 4.1976 8.2003 124.2682 55.8110 18.1769 179.7435 57 E 3.9312 8.1042 116.1412 61.5423 29.5867 181.3547 58 K 3.9735 7.8506 119.1401 59.2072 32.1702 177.3391 59 H 4.8598 8.4597 113.4402 55.0991 29.1602 175.5910 60 G 3.8431 8.2529 109.4128 45.6132 0.0000 172.9454 61 Y 4.5776 7.6786 116.1126 56.8293 39.3215 175.2780 62 I 4.0514 8.2358 124.4141 60.6429 38.9398 175.0545 63 V 4.7878 8.3709 125.8191 61.4396 33.3489 174.2933 64 E 4.9563 9.6841 127.9684 54.7428 32.5537 175.1206 65 E 5.2338 8.9472 120.8140 52.9797 33.1447 173.6519 66 P 4.5650 0.0000 0.0000 62.4597 32.8382 177.0206 67 K 4.0422 8.4146 122.7179 57.9374 32.9305 178.2271 68 Q 4.0936 8.2854 121.8148 60.9947 27.6503 180.2598 69 Q 2.8843 7.0758 121.7276 58.2463 30.2312 180.5451 70 N 4.5302 7.8191 112.2994 53.6785 37.8115 176.5812 71 H 5.2400 8.4983 115.6389 55.7684 30.5634 174.1317 72 Y 4.6289 8.8264 124.4998 56.4054 40.2232 172.6401 73 P 4.3392 0.0000 0.0000 60.4764 33.4936 174.4208 74 D 4.2778 8.6175 119.7371 57.1271 41.7789 177.4860 75 F 5.4001 8.3361 116.0431 56.1438 43.5925 173.6902 76 T 5.2614 9.0169 120.2700 61.8539 71.1226 173.3615 77 L 6.0028 9.1497 126.1813 52.2960 45.1661 175.1799 78 Y 5.2932 8.2493 119.2791 56.1317 41.5173 173.8220 79 K 4.1627 8.5267 120.0615 54.9610 33.2823 176.7267 80 P 4.3952 0.0000 0.0000 65.3459 31.6328 177.9604 81 S 4.2273 8.1328 112.1658 60.6772 63.0492 174.0982 82 E 4.5192 7.9262 120.7258 53.6356 29.5337 174.0174 83 P 4.4395 0.0000 0.0000 63.7895 32.2594 177.9904 84 N 4.4067 7.8356 115.0806 53.2161 38.3796 180.4307 85 K 4.6879 6.9823 115.3026 56.4380 31.1314 176.8638 86 K 4.2766 8.1120 120.6443 56.4293 33.9240 177.8470 87 I 4.4467 8.8050 123.7245 59.3443 40.0440 174.3835 88 A 4.9942 8.0173 127.5623 50.0985 21.6125 175.1055 89 I 5.0389 8.9984 124.0020 59.6526 40.2576 174.1266 90 D 5.2661 9.1920 127.3195 52.4759 43.9063 174.6713 91 I 4.9018 9.2051 126.8342 59.8390 38.7318 175.2465 92 K 4.9144 9.2217 126.6455 54.9047 35.5188 175.3767 93 T 5.4845 8.7154 118.6438 62.4591 72.1520 173.0488 94 T 4.7956 9.7542 119.4060 61.1431 71.6336 172.0207 95 Y 4.4190 7.1616 122.9517 55.5062 41.1302 174.1808 96 T 4.1389 7.9840 109.5409 62.0458 70.1002 174.4108 97 N 4.8666 9.2959 127.1336 54.5887 39.5746 176.0987 98 K 4.6437 7.6028 118.6791 52.1504 35.6285 181.1035 99 E 4.0082 8.7661 124.5133 56.7484 30.0639 175.8708 100 N 4.2457 8.7995 120.6832 54.3246 36.0924 173.4278 101 E 4.6602 8.0886 119.7259 54.2406 32.2360 175.8898 102 K 4.0660 8.6208 126.0074 54.8739 32.4260 173.4023 103 I 4.7369 9.0201 118.7840 59.0835 41.2970 174.8168 104 K 5.0242 7.7597 123.8732 54.2379 35.8990 174.4574 105 F 4.9753 9.4471 118.2116 56.9142 43.7637 173.5719 106 T 4.9793 8.7314 113.6280 60.3419 69.5290 173.4444 107 L 4.7709 8.6597 125.7127 54.4402 43.8381 177.7409 108 G 3.8495 7.9981 108.9408 44.1753 0.0000 173.6144 109 G 3.7930 8.3573 107.1111 46.2543 0.0000 172.8490 110 Y 4.5414 8.0873 118.3413 56.2116 38.7588 175.9018 111 T 4.4458 7.3475 109.0744 61.4019 72.0873 174.5012 112 S 4.6712 7.0118 119.6864 57.5731 62.0757 175.4116 113 F 4.1303 8.8477 116.5068 60.4791 36.7426 176.5388 114 I 2.7225 6.6249 118.1165 63.0228 36.8245 177.3070 115 R 4.4326 8.0572 117.0870 55.9609 31.9373 176.6057 116 N 4.7020 7.7492 114.2590 52.4506 40.0386 175.5624 117 N 4.8148 9.1757 120.9673 54.5148 40.0240 175.3647 118 T 4.5447 8.1574 107.8885 62.1804 70.6507 175.4776 119 K 4.0780 9.0409 124.8280 55.7816 32.2938 180.8026 120 N 4.0240 8.8925 117.9243 53.0400 36.5219 173.3411 121 I 4.9429 7.1249 115.8725 58.8353 40.3155 175.2610 122 V 3.5626 8.4090 126.1897 64.8092 31.7836 175.8471 123 Y 4.7521 7.8902 117.4319 55.1577 40.4914 174.1982 124 P 4.7222 0.0000 0.0000 62.6876 32.3565 177.3946 125 F 4.1739 9.5908 125.2938 61.5760 39.4536 177.3697 126 D 4.5028 8.0254 117.7603 56.2753 39.4057 177.4401 127 Q 3.9831 8.3617 117.9029 57.2292 28.8432 174.9233 128 Y 4.7892 7.5340 116.5204 56.2516 39.2970 175.6422 129 I 4.2075 8.3102 118.2744 62.5715 39.0909 175.8375 130 A 4.7731 7.5868 122.4241 50.6010 23.2644 175.0107 131 H 4.6485 8.8007 115.8702 53.8036 31.4209 172.3866 132 W 5.3692 9.1409 123.9479 55.9467 31.0695 175.3872 133 I 4.8847 9.3906 125.0590 59.6400 39.8288 174.4863 134 I 4.2521 8.6254 128.4110 59.5072 39.0138 174.7863 135 G 3.6177 6.9012 114.7553 44.1123 0.0000 171.1433 136 Y 4.9556 8.9405 122.6489 56.0415 40.7745 175.0457 137 V 4.8606 8.9769 123.9607 61.4455 34.3263 173.6288 138 Y 5.1425 8.8151 127.1162 55.6667 41.1695 174.9356 139 T 4.8616 8.3888 117.9760 62.2292 70.0580 174.6043 140 R 4.5588 9.0926 127.7952 56.8522 30.6907 175.5829 141 V 3.9655 8.8635 129.4678 62.8971 31.7372 180.1033 *149 K 4.0225 9.1307 114.4167 54.4732 33.2087 175.8020 150 T 4.8194 7.5323 113.8863 62.7877 72.8488 172.3452 151 Y 5.0575 8.4769 120.9831 57.6084 43.2587 174.9009 152 N 5.3061 9.2104 120.0760 51.0140 40.5965 176.1056 153 I 3.7818 8.4219 116.0574 64.8540 38.0632 176.0829 154 N 4.6651 8.0709 115.2723 54.1066 38.9179 175.0900 155 E 4.5361 8.1108 117.7479 56.5167 30.5928 178.5428 156 L 3.6037 7.5922 119.1319 57.8357 41.9187 178.1044 157 N 4.5016 8.1088 116.3142 55.4454 38.9853 176.5107 158 E 4.1405 8.6152 114.6362 57.5303 30.2822 181.8371 159 I 2.8261 7.2720 118.3741 60.3617 36.7278 173.8216 160 P 4.1475 0.0000 0.0000 62.9763 30.9219 176.3554 161 K 4.1445 8.4050 123.1281 55.2144 33.0879 175.7380 162 P 4.5539 0.0000 0.0000 63.9774 32.3334 174.7537 163 Y 5.5671 7.4810 117.8354 54.9361 41.5079 174.7588 164 K 4.7419 9.8096 117.5615 55.0468 31.8339 175.1312 165 G 4.1738 6.8624 106.0711 44.7642 0.0000 172.3121 166 V 4.6170 7.4656 121.1711 61.6863 34.1147 173.6665 167 K 4.7130 9.2394 128.0328 54.9830 35.0099 175.7238 168 V 5.5676 8.3595 120.1272 60.8950 34.2428 173.3063 169 F 5.1569 8.0619 117.0253 54.9909 42.0159 172.9039 170 L 4.8669 8.3236 120.4861 53.3614 44.4783 174.9876 171 Q 4.5619 9.1043 126.2339 54.9997 33.3651 172.7930 172 D 5.1445 8.8039 121.9901 53.4790 41.5146 177.3821 173 K 3.8652 9.4206 126.3441 59.7525 31.9961 179.1011 174 W 3.1368 7.9363 116.0775 59.2749 27.8977 178.1989 175 V 2.5166 6.4609 118.7243 64.1039 30.7066 176.9830 176 I 4.3498 7.0020 110.1342 59.6292 37.7920 175.2664 177 A 4.6143 7.2606 123.5678 52.2827 19.1379 177.7823 178 G 4.4032 8.4348 109.4204 44.0420 0.0000 173.4776 179 D 4.5687 8.4357 118.7860 52.0207 39.9360 175.6231 180 L 4.8096 8.0377 117.5273 55.0361 43.2828 174.7434 181 A 4.5116 8.8056 123.6974 52.1226 19.2315 178.2310 182 G 3.5775 9.3009 111.1212 48.5726 0.0000 174.1259 *188 N 4.6064 7.9107 118.2743 52.3936 40.1472 174.2230 189 I 3.3727 8.6923 125.6763 61.1191 38.7055 175.7557 190 G 4.5135 8.4184 112.1121 44.8861 0.0000 172.6167 191 S 5.5321 8.5428 115.9999 56.1327 65.5789 173.7835 192 I 3.8354 8.3786 113.7112 61.6939 38.0889 176.0117 193 H 5.0248 8.6972 123.5945 54.9677 29.6414 172.8710 194 A 4.5160 8.6081 125.9338 50.5440 23.4470 174.5879 195 H 4.8375 8.6328 114.6788 55.5920 29.8432 176.3035 196 Y 4.4249 9.0780 123.8840 61.2844 38.4573 178.6107 197 K 3.6921 8.4213 119.6202 60.0419 32.0366 178.0355 198 D 4.3912 8.3800 118.8418 56.6969 40.4248 178.6672 199 F 3.6532 7.4886 117.9507 59.7911 38.9389 177.8833 200 V 3.5587 7.0808 117.3070 66.0373 31.3715 177.7466 201 E 3.9948 8.1680 116.8489 56.8246 29.9719 176.5853 202 G 3.3305 7.5162 108.6953 47.0435 0.0000 176.1570 203 K 4.2455 8.3431 121.2565 52.5698 32.2365 177.2774 204 G 4.5257 8.2700 115.2126 42.0665 0.0000 170.0148 205 I 4.1477 8.0462 110.3317 61.9037 39.0982 176.4640 206 F 4.7886 7.8908 118.0311 57.6242 39.4915 174.6404 207 D 4.8283 9.3690 123.3867 56.3888 41.6102 177.3330 208 S 4.0272 7.5307 111.9435 55.5403 67.4503 174.3963 209 E 3.3734 7.1949 121.4597 58.9108 29.1875 178.1932 210 D 4.2881 7.7248 118.6167 57.3492 40.9882 178.1801 211 E 3.9711 7.8981 119.1010 59.2666 29.6587 178.3873 212 F 2.3000 7.8174 120.5291 60.9776 39.3642 177.0972 213 L 3.6761 8.2551 118.4289 57.0585 41.2941 178.9203 214 D 4.3466 8.3830 118.9272 57.2419 40.7973 177.5733 215 Y 3.3192 8.1177 120.3735 60.1554 38.5815 177.5538 216 W 4.1526 7.6916 116.7257 57.8855 29.4467 177.8465 217 R 4.3862 7.7178 116.8837 57.0828 30.0100 177.1868 218 N 4.9271 7.4454 114.3648 51.9086 39.4467 173.8623 219 Y 3.3565 6.9501 122.6851 57.0090 39.0497 173.3376 220 E 3.8733 6.9761 128.5035 57.1742 30.2846 176.3919 *229 K 4.3292 8.1213 119.5975 56.7298 35.1427 176.5676 230 Y 4.8363 6.6522 113.3461 56.0414 40.0723 173.5625 231 N 4.8279 9.0678 119.6319 52.6533 40.5511 173.9642 232 N 4.7858 7.9241 115.0254 50.7097 41.0111 174.7499 233 I 3.6440 8.3453 120.6492 64.4595 37.9576 177.4844 234 S 4.1081 8.7633 113.9414 61.7572 62.1540 176.0764 235 E 4.0956 8.4763 120.5345 59.3853 29.1763 178.7328 236 Y 3.7096 8.2914 119.9419 60.6735 38.8965 178.2456 237 R 3.3796 7.9440 118.9222 59.0877 29.9079 178.6876 238 N 4.6545 7.8341 114.8394 56.2347 38.6572 176.7835 239 W 4.3985 7.7543 128.5701 60.5747 30.8826 177.8719 240 I 3.3858 7.2350 111.3975 63.5202 36.9654 176.0439 241 Y 4.4879 7.3137 122.6224 58.2529 37.8864 175.1953 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 2 S 8.19 4.46 0.00 4.04 4.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3 L 8.51 3.32 0.00 1.76 1.73 0.47 0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 4 R 7.61 3.35 0.00 1.34 1.63 0.00 2.57 0.00 0.00 3.09 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.70 0.00 5 S 7.44 3.90 0.00 4.05 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 6 D 8.13 4.27 0.00 3.10 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 7 L 7.67 3.83 0.00 1.85 1.57 0.84 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 8 I 7.57 3.33 1.48 0.00 0.00 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.75 -0.36 0.66 0.00 0.00 9 N 7.84 4.26 0.00 2.73 2.83 0.00 0.00 6.90 7.37 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 10 A 7.68 4.00 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 11 L 7.76 4.12 0.00 1.75 1.77 0.76 1.15 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 12 Y 8.21 4.51 0.00 3.05 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 13 D 7.66 4.74 0.00 2.64 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 14 E 8.81 4.10 0.00 2.14 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 2.08 1.83 0.00 *19 D 8.10 4.72 0.00 2.72 2.57 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 20 V 8.25 3.77 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 -0.12 0.00 0.00 0.61 0.00 0.00 21 C 8.33 4.61 0.00 2.93 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 22 G 7.14 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 0.00 0.00 0.00 23 I 8.58 4.69 1.97 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 1.11 1.03 0.92 0.00 0.00 24 I 8.52 4.90 1.91 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 1.02 0.94 0.00 0.00 25 S 8.91 4.80 0.00 4.03 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 26 A 8.60 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 27 E 8.16 4.29 0.00 2.00 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 0.00 2.33 2.26 0.00 28 G 8.34 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 0.00 0.00 0.00 0.00 29 K 7.76 4.27 0.00 1.46 1.70 0.00 1.74 0.00 0.00 1.82 0.00 0.00 2.80 0.00 0.00 2.67 0.00 0.00 0.00 0.00 1.44 1.05 7.81 30 I 8.56 4.98 1.92 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 1.24 1.32 0.91 0.00 0.00 31 Y 9.11 5.17 0.00 2.84 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 32 P 0.00 4.58 0.00 2.18 2.04 0.00 3.98 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 2.09 2.20 0.00 33 L 7.97 3.90 0.00 1.44 1.52 0.59 0.83 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 34 G 7.72 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 0.00 0.00 0.00 35 S 8.34 4.39 0.00 3.98 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 36 D 7.80 4.10 0.00 2.73 2.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *38 K 8.23 4.40 0.00 1.70 1.84 0.00 1.76 0.00 0.00 1.87 0.00 0.00 2.97 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.34 1.01 7.81 39 V 7.85 3.57 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.72 0.00 0.00 0.81 0.00 0.00 40 L 7.74 3.66 0.00 1.67 1.71 0.12 0.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 41 S 8.04 4.36 0.00 4.14 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 42 T 7.90 3.96 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 1.31 0.00 0.00 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0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.12 0.88 0.00 0.00 52 I 7.58 3.55 1.57 0.00 0.00 -0.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.63 0.61 0.00 0.00 53 N 8.50 4.36 0.00 2.89 2.88 0.00 0.00 7.20 6.50 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 54 K 8.36 3.94 0.00 1.73 1.82 0.00 1.80 0.00 0.00 1.65 0.00 0.00 2.89 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.38 1.36 7.81 55 I 7.53 4.10 1.85 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 1.69 1.17 1.05 0.00 0.00 56 A 8.20 4.20 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 57 E 8.10 3.93 0.00 2.02 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 2.25 2.22 0.00 58 K 7.85 3.97 0.00 1.73 2.04 0.00 1.71 0.00 0.00 1.77 0.00 0.00 2.90 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.17 1.42 7.81 59 H 8.46 4.86 0.00 3.46 3.53 0.00 5.92 0.00 0.00 0.00 0.00 7.18 0.00 0.00 0.00 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68 Q 8.29 4.09 0.00 1.77 1.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.68 6.23 0.00 0.00 0.00 0.00 0.00 2.39 2.35 0.00 69 Q 7.08 2.88 0.00 2.04 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.94 6.98 0.00 0.00 0.00 0.00 0.00 2.33 1.96 0.00 70 N 7.82 4.53 0.00 2.77 2.76 0.00 0.00 7.16 7.20 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 71 H 8.50 5.24 0.00 3.06 3.27 0.00 5.63 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 Y 8.83 4.63 0.00 3.13 2.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 73 P 0.00 4.34 0.00 1.47 0.49 0.00 3.70 0.00 0.00 3.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.50 0.00 74 D 8.62 4.28 0.00 2.94 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 0.00 0.00 0.00 75 F 8.34 5.40 0.00 2.95 2.87 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 76 T 9.02 5.26 4.54 0.00 0.00 0.00 0.00 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93 T 8.72 5.48 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 1.68 0.00 0.00 94 T 9.75 4.80 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.46 0.00 0.00 95 Y 7.16 4.42 0.00 2.26 1.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 96 T 7.98 4.14 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 1.21 0.00 0.00 97 N 9.30 4.87 0.00 2.84 2.91 0.00 0.00 6.62 7.61 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 98 K 7.60 4.64 0.00 1.70 1.50 0.00 1.81 0.00 0.00 1.63 0.00 0.00 2.90 0.00 0.00 2.71 0.00 0.00 0.00 0.00 1.25 0.98 7.81 99 E 8.77 4.01 0.00 1.89 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 2.27 2.37 0.00 100 N 8.80 4.25 0.00 2.89 2.84 0.00 0.00 6.70 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 0.00 101 E 8.09 4.66 0.00 1.86 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 2.17 2.33 0.00 102 K 8.62 4.07 0.00 1.81 1.64 0.00 1.80 0.00 0.00 1.76 0.00 0.00 2.93 0.00 0.00 2.72 0.00 0.00 0.00 0.00 1.38 1.05 7.81 103 I 9.02 4.74 1.47 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.95 0.63 0.82 0.00 0.00 104 K 7.76 5.02 0.00 1.51 1.55 0.00 1.75 0.00 0.00 1.70 0.00 0.00 2.77 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.26 1.04 7.81 105 F 9.45 4.98 0.00 2.98 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 0.00 106 T 8.73 4.98 4.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 107 L 8.66 4.77 0.00 1.49 1.64 1.03 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 108 G 8.00 3.85 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 0.00 0.00 0.00 109 G 8.36 3.79 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 0.00 118 T 8.16 4.54 4.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 119 K 9.04 4.08 0.00 1.66 1.73 0.00 1.96 0.00 0.00 1.65 0.00 0.00 2.86 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.37 1.28 7.81 120 N 8.89 4.02 0.00 3.00 2.97 0.00 0.00 6.52 7.23 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 0.00 121 I 7.12 4.94 1.68 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.01 1.25 0.00 0.00 122 V 8.41 3.56 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 0.32 0.00 0.00 0.92 0.00 0.00 123 Y 7.89 4.75 0.00 2.93 2.87 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 0.00 124 P 0.00 4.72 0.00 2.33 2.10 0.00 3.78 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 2.20 2.19 0.00 125 F 9.59 4.17 0.00 3.38 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 0.00 126 D 8.03 4.50 0.00 2.93 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 0.00 127 Q 8.36 3.98 0.00 2.05 1.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.08 6.83 0.00 0.00 0.00 0.00 0.00 2.24 2.29 0.00 128 Y 7.53 4.79 0.00 2.57 2.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 129 I 8.31 4.21 1.87 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 1.30 0.48 0.87 0.00 0.00 130 A 7.59 4.77 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 0.00 131 H 8.80 4.65 0.00 3.18 3.39 0.00 5.61 0.00 0.00 0.00 0.00 6.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 132 W 9.14 5.37 0.00 3.26 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 0.00 133 I 9.39 4.88 1.90 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 1.10 0.66 0.00 0.00 134 I 8.63 4.25 1.78 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 1.03 0.59 0.53 0.00 0.00 135 G 6.90 3.62 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 136 Y 8.94 4.96 0.00 2.71 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 0.00 0.00 0.00 0.00 137 V 8.98 4.86 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 0.69 0.00 0.00 1.16 0.00 0.00 138 Y 8.82 5.14 0.00 3.40 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 0.00 139 T 8.39 4.86 4.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 140 R 9.09 4.56 0.00 2.00 2.03 0.00 2.43 0.00 0.00 3.25 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.91 0.00 141 V 8.86 3.97 2.25 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 0.64 0.00 0.00 1.01 0.00 0.00 *149 K 9.13 4.02 0.00 1.82 1.68 0.00 1.75 0.00 0.00 1.70 0.00 0.00 2.90 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.26 1.04 7.81 150 T 7.53 4.82 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 0.67 0.00 0.00 151 Y 8.48 5.06 0.00 2.81 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 0.00 152 N 9.21 5.31 0.00 2.38 2.69 0.00 0.00 7.07 8.58 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 0.00 153 I 8.42 3.78 1.87 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 1.42 1.10 0.91 0.00 0.00 154 N 8.07 4.67 0.00 2.76 2.85 0.00 0.00 6.85 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 0.00 155 E 8.11 4.54 0.00 2.15 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 0.00 2.31 2.55 0.00 156 L 7.59 3.60 0.00 1.62 1.69 0.92 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 0.00 0.00 0.00 0.00 0.00 0.00 157 N 8.11 4.50 0.00 2.68 2.86 0.00 0.00 6.75 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 0.00 158 E 8.62 4.14 0.00 1.94 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 2.23 2.14 0.00 159 I 7.27 2.83 1.53 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 -0.30 0.47 0.60 0.00 0.00 160 P 0.00 4.15 0.00 2.15 2.10 0.00 3.51 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.06 0.00 161 K 8.41 4.14 0.00 1.91 1.72 0.00 1.74 0.00 0.00 1.86 0.00 0.00 3.06 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.56 1.40 7.81 162 P 0.00 4.55 0.00 1.84 2.01 0.00 3.14 0.00 0.00 3.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 1.51 0.00 163 Y 7.48 5.57 0.00 3.05 3.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 164 K 9.81 4.74 0.00 1.77 1.93 0.00 1.66 0.00 0.00 1.75 0.00 0.00 2.75 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.40 1.43 7.81 165 G 6.86 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 0.00 166 V 7.47 4.62 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 0.64 0.00 0.00 0.16 0.00 0.00 167 K 9.24 4.71 0.00 1.20 0.82 0.00 0.61 0.00 0.00 1.22 0.00 0.00 2.54 0.00 0.00 2.57 0.00 0.00 0.00 0.00 0.95 1.04 7.81 168 V 8.36 5.57 1.75 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 0.80 0.00 0.00 0.31 0.00 0.00 169 F 8.06 5.16 0.00 2.97 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 0.00 170 L 8.32 4.87 0.00 1.35 1.25 0.66 -0.03 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 0.00 171 Q 9.10 4.56 0.00 2.37 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.78 0.00 0.00 0.00 0.00 0.00 2.26 2.29 0.00 172 D 8.80 5.14 0.00 2.38 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 0.00 173 K 9.42 3.87 0.00 2.03 1.87 0.00 1.76 0.00 0.00 1.90 0.00 0.00 3.15 0.00 0.00 3.32 0.00 0.00 0.00 0.00 1.37 1.52 7.81 174 W 7.94 3.14 0.00 3.16 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 0.00 175 V 6.46 2.52 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 0.52 0.00 0.00 -0.68 0.00 0.00 176 I 7.00 4.35 2.03 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.90 0.80 0.00 0.00 177 A 7.26 4.61 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 0.00 178 G 8.43 4.40 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 0.00 179 D 8.44 4.57 0.00 2.38 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 180 L 8.04 4.81 0.00 1.96 1.92 1.00 0.68 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 0.00 181 A 8.81 4.51 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 0.00 182 G 9.30 3.58 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 *188 N 7.91 4.61 0.00 2.75 2.83 0.00 0.00 7.06 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 0.00 189 I 8.69 3.37 1.59 0.00 0.00 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.05 0.59 0.22 0.00 0.00 190 G 8.42 4.51 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 0.00 191 S 8.54 5.53 0.00 4.43 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 0.00 192 I 8.38 3.84 1.71 0.00 0.00 0.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.21 0.89 0.00 0.00 193 H 8.70 5.02 0.00 3.17 3.19 0.00 5.72 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 0.00 194 A 8.61 4.52 0.95 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 0.00 0.00 195 H 8.63 4.84 0.00 3.33 3.26 0.00 5.68 0.00 0.00 0.00 0.00 6.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 196 Y 9.08 4.42 0.00 3.09 3.07 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 0.00 197 K 8.42 3.69 0.00 1.95 1.82 0.00 1.65 0.00 0.00 1.84 0.00 0.00 3.07 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.51 1.75 7.81 198 D 8.38 4.39 0.00 2.43 2.35 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 0.00 199 F 7.49 3.65 0.00 2.23 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 0.00 200 V 7.08 3.56 1.95 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 1.06 0.00 0.00 0.28 0.00 0.00 201 E 8.17 3.99 0.00 1.86 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 2.28 2.41 0.00 202 G 7.52 3.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 203 K 8.34 4.25 0.00 1.73 1.64 0.00 1.75 0.00 0.00 1.71 0.00 0.00 2.80 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.29 1.22 7.81 204 G 8.27 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 0.00 205 I 8.05 4.15 1.65 0.00 0.00 0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.06 0.77 0.00 0.00 206 F 7.89 4.79 0.00 3.43 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 0.00 207 D 9.37 4.83 0.00 2.91 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 0.00 208 S 7.53 4.03 0.00 3.69 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 209 E 7.19 3.37 0.00 1.16 1.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.44 2.12 0.00 210 D 7.72 4.29 0.00 2.67 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 0.00 211 E 7.90 3.97 0.00 2.16 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 2.60 2.75 0.00 212 F 7.82 2.30 0.00 2.37 2.93 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 0.00 213 L 8.26 3.68 0.00 1.79 1.63 1.10 0.93 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 0.00 214 D 8.38 4.35 0.00 2.93 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 0.00 215 Y 8.12 3.32 0.00 2.11 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 0.00 216 W 7.69 4.15 0.00 2.81 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 0.00 217 R 7.72 4.39 0.00 1.95 2.01 0.00 3.31 0.00 0.00 3.23 7.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.59 0.00 218 N 7.45 4.93 0.00 3.02 3.00 0.00 0.00 6.93 7.31 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 0.00 219 Y 6.95 3.36 0.00 2.28 2.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 220 E 6.98 3.87 0.00 1.53 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 2.07 2.05 0.00 *229 K 8.12 4.33 0.00 0.79 1.92 0.00 1.22 0.00 0.00 1.83 0.00 0.00 2.89 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.97 0.64 7.81 230 Y 6.65 4.84 0.00 3.00 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 0.00 231 N 9.07 4.83 0.00 2.80 2.85 0.00 0.00 6.85 8.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 232 N 7.92 4.79 0.00 3.10 2.95 0.00 0.00 5.84 7.61 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 0.00 233 I 8.35 3.64 1.64 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 1.27 1.21 0.86 0.00 0.00 234 S 8.76 4.11 0.00 4.04 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 0.00 235 E 8.48 4.10 0.00 2.37 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 0.00 2.46 2.43 0.00 236 Y 8.29 3.71 0.00 2.93 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 0.00 237 R 7.94 3.38 0.00 1.98 1.67 0.00 3.24 0.00 0.00 3.18 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.95 0.00 238 N 7.83 4.65 0.00 2.85 3.02 0.00 0.00 7.02 7.09 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 0.00 239 W 7.75 4.40 0.00 3.23 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 0.00 240 I 7.23 3.39 1.52 0.00 0.00 0.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.87 0.16 0.36 0.00 0.00 241 Y 7.31 4.49 0.00 3.23 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 * Residues marked with a * may have inaccurate shift predictions.