NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 16 I 4.2487 7.8827 121.4536 61.2333 38.6110 173.7926 17 V 4.2722 8.7927 126.3846 62.0339 32.5617 174.6977 18 G 3.7338 8.6084 114.2048 46.7977 0.0000 173.1075 19 G 4.2223 7.6406 109.4448 44.0630 0.0000 172.5939 20 Y 4.9752 7.9004 116.5228 55.0629 42.6593 175.0036 21 T 4.2471 8.5872 117.1745 64.3313 68.8967 175.8515 22 C 4.0965 8.7375 125.4548 59.5565 35.6057 175.4873 23 G 4.0148 7.8979 105.5934 44.8086 0.0000 172.8410 24 A 4.2710 8.5347 126.1855 53.9204 18.6011 176.8477 25 N 4.3079 8.9286 118.9903 54.4878 35.9687 175.3372 26 T 4.1935 7.6932 107.4754 62.7855 69.8051 175.1756 27 V 4.0893 7.0346 121.8630 60.3086 31.3255 173.6761 28 P 4.4801 0.0000 0.0000 64.4438 32.0571 178.1511 29 Y 5.0048 6.9433 115.7609 56.5580 38.7793 174.6024 30 Q 4.5950 7.3939 123.5969 56.1916 29.6864 175.1988 31 V 4.8106 8.9765 125.5889 61.1836 35.6791 173.6587 32 S 5.0818 8.6602 119.5230 56.4903 64.7673 172.5888 33 L 4.6796 8.4010 127.6607 53.3360 43.1405 175.0189 34 N 5.6593 8.8632 122.6277 49.8547 41.9604 174.9237 *37 S 4.1692 8.3767 121.0590 58.2994 64.0536 174.4754 38 G 4.0073 10.0750 108.3709 45.9439 0.0000 172.3816 39 Y 4.5459 6.6942 114.9779 56.1936 39.9957 172.6745 40 H 4.5486 8.8649 121.8625 56.2023 30.3294 174.7778 41 F 5.0174 7.8278 119.9259 56.7288 39.4695 173.8972 42 C 4.6826 6.8681 115.0584 56.2855 44.7351 173.4417 43 G 4.4400 8.5330 109.4386 45.7963 0.0000 172.0680 44 G 4.5506 7.9107 105.1689 46.5112 0.0000 172.4272 45 S 5.4042 8.6338 115.1162 56.4207 66.8279 173.7647 46 L 4.7649 9.2370 127.9460 54.9938 42.3494 177.1072 47 I 4.5170 8.7779 119.5103 60.9765 39.5423 174.4439 48 N 4.8618 7.5782 117.0660 52.3098 39.3522 174.5127 49 S 4.4253 8.7609 111.3152 60.6122 63.4757 174.3833 50 Q 4.6189 9.0009 121.0704 55.2957 30.8977 174.2431 51 W 5.5964 8.4290 116.1415 55.5506 33.6538 174.2651 52 V 5.0698 9.1631 123.4036 61.0711 34.5944 174.3226 53 V 4.9399 8.8409 126.6276 60.5056 33.5003 174.9231 54 S 5.0807 8.9749 117.5575 57.5486 66.2310 171.9962 55 A 4.5856 8.5024 120.7324 50.8284 20.0929 178.4583 56 A 3.8026 8.3576 124.6061 55.3871 18.3930 179.1591 57 H 4.5692 8.3345 109.0464 57.2142 28.6920 175.3405 58 C 4.6692 7.8303 117.2093 57.3680 40.5257 173.3207 59 Y 4.2408 7.7344 122.3966 57.8851 38.6638 175.2242 60 K 3.7230 7.2886 124.1409 55.7257 35.1902 174.8258 61 S 4.2411 7.9299 114.1680 58.4028 64.1691 173.7383 62 G 3.7408 8.5631 107.1519 46.1999 0.0000 173.2660 63 I 4.1292 7.5777 120.2988 60.4038 38.8183 174.5347 64 Q 4.7910 8.9035 128.5613 54.3629 31.1665 174.2048 65 V 4.4006 8.8728 127.0717 61.8950 33.5542 174.6060 66 R 5.0198 9.0817 127.1850 54.6425 32.4521 174.9758 67 L 4.7687 9.1364 124.8794 52.7315 44.6368 177.7014 *69 G 4.0232 8.2851 108.3969 45.3411 0.0000 172.8668 70 E 4.3404 8.2050 118.4371 55.7298 29.8887 174.2187 71 D 4.8611 7.9156 117.3725 55.3731 44.3377 174.4145 72 N 5.0232 8.7668 118.5007 53.3220 39.3625 176.0330 73 I 3.9267 8.3789 119.4318 61.9041 37.9587 176.1209 74 N 4.8046 8.7076 118.0362 53.0508 39.4855 174.7319 75 V 4.3397 7.3486 116.6087 60.6437 34.3454 174.9671 76 V 4.0967 8.4438 126.6505 62.7040 31.2282 175.1579 77 E 4.4495 9.7724 127.0592 55.4466 31.1026 177.1016 78 G 3.9262 8.2362 105.6615 46.3593 0.0000 174.0365 79 N 4.5735 8.9039 116.1156 52.8147 36.6916 174.4286 80 E 4.6042 7.7826 117.5028 56.4721 30.5894 176.2357 81 Q 4.5716 9.0705 121.7556 54.1341 32.3254 174.2679 82 F 5.5891 8.8337 122.5969 55.9726 41.1581 175.1971 83 I 4.6991 8.8564 124.5433 59.3524 41.1547 175.4271 84 S 4.5441 8.7381 122.3706 58.2800 64.2131 173.3190 85 A 4.4695 8.3999 125.7404 52.2237 18.1506 177.8468 86 S 4.5105 9.1833 118.1350 60.2011 64.4332 174.9081 87 K 4.7271 7.6047 117.4578 55.3880 35.8397 175.1262 88 S 5.1421 8.7992 117.8073 56.9819 66.0405 173.6873 89 I 4.4699 9.3632 126.0406 59.3280 38.8495 174.9526 90 V 4.0726 8.2549 127.1418 62.3551 32.6159 175.1492 91 H 3.9501 8.7096 127.3799 56.0235 29.9621 174.5818 92 P 4.3208 0.0000 0.0000 65.3005 31.4021 177.1751 93 S 4.6116 7.9523 111.9549 58.0782 63.0393 173.4290 94 Y 4.3407 7.8850 122.8466 57.8968 38.9435 174.9471 95 N 4.5381 8.1286 125.1696 51.2650 40.4499 175.2925 96 S 3.6710 8.0092 120.9150 60.7758 63.5007 175.2918 97 N 4.3771 8.9055 119.2036 55.2407 38.4835 175.9790 98 T 4.0354 7.6764 105.0342 60.4368 70.0500 174.7079 99 L 3.7122 7.9732 120.6917 55.3138 40.2348 173.9403 100 N 4.3223 7.4541 117.3321 55.0111 39.4471 174.6256 101 N 4.9705 8.6951 121.2428 54.0490 35.7343 175.7132 102 D 4.6484 7.8595 117.8628 52.8423 40.1547 174.6544 103 I 4.7266 7.1836 121.1842 59.4034 42.0803 172.4615 104 M 5.4172 9.0802 127.0798 54.1489 36.2613 173.2356 105 L 5.3931 9.3168 124.9358 53.1917 44.8274 175.3462 106 I 4.8983 9.0871 124.0337 59.4166 40.3778 174.2968 107 K 3.7415 8.4743 128.9786 54.5694 33.3891 175.7340 108 L 4.4141 8.2674 128.3115 54.3166 41.8368 177.2782 109 K 4.1654 8.7379 124.7115 58.8882 32.6195 177.1628 110 S 4.6625 7.7227 111.3323 55.7110 66.1416 173.1375 111 A 4.3630 8.4151 123.4510 51.8355 18.6470 177.5225 112 A 4.1496 9.1251 124.4494 52.1126 19.6002 177.7455 113 S 4.5268 9.1402 117.1097 57.1917 63.1834 174.6159 114 L 4.4297 8.4775 125.7148 54.6394 42.6397 176.6065 115 N 4.7852 8.7574 118.6275 52.4814 39.8393 174.9303 116 S 4.3292 8.7164 111.7058 60.9071 63.3336 174.9261 117 R 4.2976 8.7365 118.8686 56.1297 30.8791 176.2146 118 V 4.4510 7.7672 116.1558 61.0044 33.4524 173.7189 119 A 5.1368 8.5300 128.3567 50.5341 22.9283 175.2489 120 S 5.0205 8.6932 114.2064 57.8617 64.8417 173.0643 121 I 4.4089 8.2798 121.5604 59.1608 39.6731 175.4932 122 S 4.4077 8.4004 124.4846 58.3265 64.0320 173.8658 123 L 4.2291 8.3743 123.5253 53.6164 42.3537 175.2999 124 P 4.5351 0.0000 0.0000 62.9218 32.1383 176.2411 125 T 4.2234 8.2064 108.4059 62.1639 70.0408 174.4839 *127 S 4.3185 7.5660 115.1064 58.0576 64.0417 174.1886 128 C 4.4095 8.4370 118.2904 56.8224 40.6879 173.4761 129 A 4.4375 8.0342 124.8924 51.3265 19.7805 177.2379 130 S 4.4014 8.0372 113.9063 56.6728 65.1832 173.1544 *132 A 4.2420 8.1978 123.0950 53.4747 19.1476 177.4435 133 G 3.9500 9.2096 111.1172 45.2039 0.0000 174.1039 134 T 3.9908 7.5970 117.6411 63.7955 69.5239 173.4141 135 Q 4.7594 8.5544 124.8368 55.2634 30.1342 175.7419 136 C 5.2459 9.3648 120.3748 55.0474 46.2137 172.4117 137 L 5.1808 9.0872 122.9433 53.6260 43.7408 175.0536 138 I 5.1480 9.1371 127.4560 58.8088 39.9514 174.8656 139 S 4.8855 8.3878 119.4568 56.6539 66.3640 173.0670 140 G 3.7954 7.6437 108.3598 46.1204 0.0000 173.1514 141 W 4.6379 8.7502 117.3756 56.2580 29.4376 177.0757 142 G 4.1760 8.4279 109.2984 44.2600 0.0000 173.5583 143 N 4.0236 8.9308 118.4966 54.2660 38.9934 174.6063 144 T 5.1579 8.2408 113.0116 60.5303 69.4876 174.3629 145 K 4.6469 7.7954 121.3298 54.7880 34.9284 176.2527 146 S 4.2172 8.8317 119.4851 60.4087 63.7068 174.8334 147 S 4.4823 8.0520 117.1428 58.7696 63.4456 176.1215 148 G 3.7998 9.1555 114.2669 44.1375 0.0000 172.1010 149 T 4.5178 8.0036 111.6936 59.5861 71.6751 170.5537 150 S 4.3537 9.4212 122.6964 56.5635 64.6389 171.7661 151 Y 5.0084 8.4622 124.3955 55.8626 39.2338 174.0115 152 P 4.7722 0.0000 0.0000 62.0764 33.2982 175.8533 153 D 4.5469 8.7538 118.8032 56.6403 41.2323 177.0514 154 V 5.4839 7.3966 109.5678 58.3553 34.8126 175.5627 155 L 3.2729 8.4163 123.8170 54.9591 42.9513 175.9094 156 K 4.9600 8.2605 125.0952 54.8813 35.2159 174.5683 157 C 5.2591 8.6192 119.5314 55.0889 41.9089 172.9960 158 L 5.0048 8.6598 123.1651 53.6450 45.4611 174.7826 159 K 5.1082 9.0251 125.5442 55.5112 33.4797 175.9773 160 A 4.7980 9.1967 126.4145 49.7555 23.0405 173.4592 161 P 5.0062 0.0000 0.0000 61.7652 34.0359 175.1285 162 I 4.3576 8.2047 122.7061 61.4684 37.9563 175.9364 163 L 4.7947 8.8335 127.8782 53.3483 43.2952 176.9384 164 S 4.3917 8.4242 114.8488 58.0578 63.9730 175.1136 165 D 4.4071 8.6385 121.3252 57.5878 40.5017 179.0743 166 S 4.1191 7.9960 113.3585 61.4620 62.4858 176.2476 167 S 4.1740 8.0581 117.6067 61.3697 62.6448 175.7618 168 C 4.2889 8.3838 121.3329 59.8767 39.9521 175.9835 169 K 3.9839 8.4797 120.2145 59.4347 31.3294 179.6429 170 S 4.1395 8.0696 114.8786 61.3750 62.7726 176.1606 171 A 3.9763 7.8545 122.9019 54.0296 19.6511 177.4384 172 Y 4.9354 7.8410 113.3596 55.6654 38.5244 173.4384 173 P 4.7243 0.0000 0.0000 63.5195 32.2645 178.0215 174 G 3.9803 8.9635 109.2321 46.0438 0.0000 173.6752 175 Q 4.4587 8.1850 116.9565 55.5578 29.8473 175.3362 176 I 4.4183 7.8189 119.9100 59.9496 38.2151 175.4887 177 T 4.4928 8.1926 116.0127 59.8898 70.8200 175.0472 178 S 4.3323 8.5204 114.5177 60.1717 62.5495 173.8183 179 N 4.9718 7.9243 115.8715 53.8555 38.5369 173.8764 180 M 5.5443 7.8947 117.2007 53.6911 36.0331 174.6020 181 F 5.1247 8.7838 115.4075 55.7364 42.2426 172.6231 182 C 5.4422 8.9893 116.4389 55.9103 42.0090 172.6351 183 A 5.0619 9.4902 122.5916 50.8503 22.4054 174.9270 184 G 4.0525 7.1412 106.5990 44.5662 0.0000 173.6453 184A Y 4.6444 8.4065 120.5648 56.2503 41.3565 176.1241 185 L 4.1391 8.7010 125.7210 57.2524 42.0175 178.6373 186 E 4.0781 8.2316 114.8018 56.7471 30.0505 177.3375 187 G 3.8809 7.5533 106.1076 45.5227 0.0000 173.4729 188 G 3.9666 10.2120 106.9172 44.7601 0.0000 173.4997 188A K 5.4467 7.2983 117.7913 55.0366 35.6480 174.9102 189 D 4.7154 8.4559 123.1171 53.5123 44.7567 174.6611 190 S 4.8560 8.7894 117.0519 58.3809 64.9377 173.1442 191 C 4.7797 9.4180 119.1573 55.2924 43.0259 172.3102 192 Q 4.3201 8.6642 117.7494 58.1794 28.1221 177.5101 193 G 4.4287 9.3047 110.6277 45.5200 0.0000 173.7379 194 D 4.6795 8.4351 118.7891 55.3530 41.6205 176.7178 195 S 4.4731 8.0781 115.5470 60.5317 63.5269 175.4350 196 G 3.9689 8.8936 112.7114 46.4547 0.0000 173.7858 197 G 4.4222 7.8678 107.3839 45.0844 0.0000 171.2294 198 P 5.1519 0.0000 0.0000 62.2790 33.4589 175.5720 199 V 4.6149 8.6471 121.6320 61.4409 33.9930 174.1148 200 V 4.8053 8.7287 128.8033 61.2490 34.2712 173.7092 201 C 5.0228 8.8787 124.7525 55.4221 43.8852 174.6324 202 S 3.6725 9.6588 121.5529 59.7533 59.8785 173.4263 203 G 3.9384 8.3411 104.7322 45.5903 0.0000 173.5202 204 K 4.7609 7.5763 118.1211 53.0703 35.2585 175.4342 *209 L 4.3364 8.2831 122.8334 55.4861 42.0630 175.8514 210 Q 4.5814 9.0053 125.9266 56.3478 31.1614 175.7165 211 G 5.3409 8.0124 104.7175 45.8232 0.0000 171.3786 212 I 5.3198 8.1786 119.5276 58.8730 41.0794 175.3209 213 V 3.6286 9.0725 127.5311 63.9789 31.8055 174.3435 214 S 4.8207 8.3986 120.8687 58.6122 64.2212 173.8851 215 W 4.8875 7.4488 114.0529 56.1283 32.0719 172.2469 216 G 3.4927 7.9714 106.0588 45.8152 0.0000 172.2373 217 S 4.5442 8.2744 114.7326 56.5001 63.5038 173.1253 *219 G 4.2106 8.0638 118.1764 45.6158 0.0000 170.8631 220 C 5.0212 8.0760 115.5117 56.3529 41.0179 173.8351 221 A 4.3421 9.2678 125.2817 53.2149 16.5780 177.1419 221A Q 4.4936 7.5475 119.6101 56.9728 29.7184 176.9072 222 K 4.2149 8.4408 122.4537 56.0506 32.2244 176.3564 223 N 4.2967 9.0876 119.5495 53.8702 38.0347 175.1160 224 K 4.2818 7.5812 115.5748 53.2210 32.5290 173.9857 225 P 4.6366 0.0000 0.0000 61.8913 33.0691 176.9041 226 G 3.6670 8.4957 106.3021 46.1874 0.0000 172.7246 227 V 4.4509 7.6335 121.8806 60.6953 34.1103 174.1045 228 Y 4.9365 8.1087 124.1100 55.9651 42.1660 174.9793 229 T 4.2918 8.4700 120.3148 63.6520 70.0292 174.1345 230 K 5.0466 9.2473 128.1048 55.4837 31.7520 177.3777 231 V 3.9798 9.0643 127.4639 65.6820 31.3909 174.9816 232 C 4.4183 8.2868 112.7343 58.0023 41.6157 174.7648 233 N 4.2364 8.1230 117.6011 54.5663 38.4783 174.9910 234 Y 4.7934 7.9703 117.6102 57.5033 39.3222 177.6235 235 V 3.6993 8.0382 121.7942 66.1687 31.5432 178.0619 236 S 4.1434 8.1096 113.5968 61.0556 62.9080 176.0824 237 W 4.1285 8.3006 131.5072 60.2720 30.4954 177.7593 238 I 3.2491 8.3847 120.1039 64.2720 36.5923 178.5666 239 K 3.7642 8.0611 119.1694 59.5596 31.4418 179.4744 240 Q 3.8955 8.1077 118.4259 59.2485 28.3611 179.0800 241 T 3.6190 7.2213 115.8057 66.3857 68.6643 176.7851 242 I 2.7707 7.3726 121.8340 63.7335 36.7392 178.1758 243 A 4.1152 7.6932 120.6171 53.7044 18.2587 178.6484 244 S 4.6479 7.2730 110.2753 58.1525 63.5524 174.0142 245 N 4.6825 7.8356 125.1210 53.8359 39.1278 174.0443 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 I 7.88 4.25 1.80 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 1.38 0.79 0.86 0.00 0.00 17 V 8.79 4.27 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 0.97 0.00 0.00 0.89 0.00 0.00 18 G 8.61 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 0.00 0.00 0.00 19 G 7.64 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 20 Y 7.90 4.98 0.00 2.93 2.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 T 8.59 4.25 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 22 C 8.74 4.10 0.00 2.76 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 23 G 7.90 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 24 A 8.53 4.27 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 N 8.93 4.31 0.00 2.90 2.95 0.00 0.00 7.15 7.54 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 26 T 7.69 4.19 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 1.24 0.00 0.00 27 V 7.03 4.09 1.73 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 0.22 0.00 0.00 0.75 0.00 0.00 28 P 0.00 4.48 0.00 2.39 2.36 0.00 3.63 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 2.18 1.99 0.00 29 Y 6.94 5.00 0.00 3.23 3.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 Q 7.39 4.60 0.00 1.80 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.62 6.72 0.00 0.00 0.00 0.00 0.00 1.94 2.47 0.00 31 V 8.98 4.81 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 0.00 0.00 0.99 0.00 0.00 32 S 8.66 5.08 0.00 3.16 3.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 L 8.40 4.68 0.00 0.36 0.93 0.77 0.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 34 N 8.86 5.66 0.00 2.41 2.45 0.00 0.00 6.77 7.19 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 *37 S 8.38 4.17 0.00 3.79 3.67 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 38 G 10.08 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 39 Y 6.69 4.55 0.00 3.03 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 40 H 8.86 4.55 0.00 2.82 3.12 0.00 5.86 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 F 7.83 5.02 0.00 3.01 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 42 C 6.87 4.68 0.00 2.22 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 43 G 8.53 4.44 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 0.00 44 G 7.91 4.55 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 0.00 0.00 0.00 45 S 8.63 5.40 0.00 3.83 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 L 9.24 4.76 0.00 1.87 1.68 1.06 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 47 I 8.78 4.52 1.90 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 1.57 0.92 0.95 0.00 0.00 48 N 7.58 4.86 0.00 3.00 3.01 0.00 0.00 6.03 7.64 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 49 S 8.76 4.43 0.00 4.22 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 50 Q 9.00 4.62 0.00 2.10 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.80 0.00 0.00 0.00 0.00 0.00 1.96 2.17 0.00 51 W 8.43 5.60 0.00 3.41 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 52 V 9.16 5.07 2.14 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 1.12 0.00 0.00 0.98 0.00 0.00 53 V 8.84 4.94 2.17 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 0.83 0.00 0.00 1.07 0.00 0.00 54 S 8.97 5.08 0.00 3.88 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 A 8.50 4.59 1.15 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 0.00 0.00 0.00 0.00 0.00 0.00 56 A 8.36 3.80 0.32 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 0.00 0.00 57 H 8.33 4.57 0.00 3.37 3.56 0.00 5.55 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 C 7.83 4.67 0.00 3.22 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 59 Y 7.73 4.24 0.00 2.92 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 60 K 7.29 3.72 0.00 1.50 1.36 0.00 0.71 0.00 0.00 1.25 0.00 0.00 2.34 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.83 1.03 7.81 61 S 7.93 4.24 0.00 3.93 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 G 8.56 3.74 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 0.00 0.00 0.00 63 I 7.58 4.13 1.85 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.94 0.90 0.00 0.00 64 Q 8.90 4.79 0.00 2.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.88 0.00 0.00 0.00 0.00 0.00 2.08 2.21 0.00 65 V 8.87 4.40 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 0.97 0.00 0.00 0.88 0.00 0.00 66 R 9.08 5.02 0.00 1.46 1.65 0.00 2.62 0.00 0.00 2.44 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.72 1.13 0.00 67 L 9.14 4.77 0.00 1.61 1.63 0.96 0.64 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 *69 G 8.29 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 70 E 8.21 4.34 0.00 2.10 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 2.36 2.04 0.00 71 D 7.92 4.86 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 72 N 8.77 5.02 0.00 2.84 2.86 0.00 0.00 7.19 7.10 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 73 I 8.38 3.93 1.42 0.00 0.00 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.52 -0.47 0.00 0.00 74 N 8.71 4.80 0.00 2.79 2.87 0.00 0.00 6.62 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 75 V 7.35 4.34 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 0.78 0.00 0.00 0.95 0.00 0.00 76 V 8.44 4.10 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 0.84 0.00 0.00 0.94 0.00 0.00 77 E 9.77 4.45 0.00 1.93 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 2.26 2.42 0.00 78 G 8.24 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 N 8.90 4.57 0.00 2.96 3.07 0.00 0.00 6.93 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 80 E 7.78 4.60 0.00 1.60 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 2.69 2.48 0.00 81 Q 9.07 4.57 0.00 2.01 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.77 0.00 0.00 0.00 0.00 0.00 2.24 2.29 0.00 82 F 8.83 5.59 0.00 2.77 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 83 I 8.86 4.70 1.87 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 1.24 0.74 0.89 0.00 0.00 84 S 8.74 4.54 0.00 3.75 3.74 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 85 A 8.40 4.47 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 86 S 9.18 4.51 0.00 3.76 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 87 K 7.60 4.73 0.00 1.83 1.90 0.00 1.45 0.00 0.00 1.79 0.00 0.00 2.84 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.28 1.35 7.81 88 S 8.80 5.14 0.00 4.03 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 89 I 9.36 4.47 2.06 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 1.03 1.07 0.00 0.00 90 V 8.25 4.07 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 0.66 0.00 0.00 0.71 0.00 0.00 91 H 8.71 3.95 0.00 2.95 3.08 0.00 5.65 0.00 0.00 0.00 0.00 6.70 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 4.32 0.00 2.09 2.14 0.00 3.27 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.23 0.00 93 S 7.95 4.61 0.00 3.94 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 94 Y 7.88 4.34 0.00 2.94 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 95 N 8.13 4.54 0.00 2.60 2.43 0.00 0.00 6.62 6.92 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 96 S 8.01 3.67 0.00 3.92 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 97 N 8.91 4.38 0.00 2.63 2.78 0.00 0.00 6.88 7.59 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 98 T 7.68 4.04 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 1.10 0.00 0.00 99 L 7.97 3.71 0.00 1.46 1.83 0.84 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 100 N 7.45 4.32 0.00 2.89 2.67 0.00 0.00 7.23 6.59 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 0.00 101 N 8.70 4.97 0.00 2.93 2.59 0.00 0.00 7.21 8.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 102 D 7.86 4.65 0.00 3.07 2.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 I 7.18 4.73 1.47 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 1.05 0.11 0.00 0.00 104 M 9.08 5.42 0.00 2.13 1.83 0.00 0.00 0.00 0.00 0.00 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.74 2.63 0.00 105 L 9.32 5.39 0.00 1.83 1.95 0.32 0.66 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 0.00 106 I 9.09 4.90 1.91 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.95 0.88 0.00 0.00 107 K 8.47 3.74 0.00 0.79 1.12 0.00 1.23 0.00 0.00 1.34 0.00 0.00 2.65 0.00 0.00 2.84 0.00 0.00 0.00 0.00 0.67 0.21 7.81 108 L 8.27 4.41 0.00 1.43 1.60 0.96 0.79 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 0.00 109 K 8.74 4.17 0.00 1.80 1.79 0.00 1.72 0.00 0.00 1.72 0.00 0.00 2.93 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.42 1.35 7.81 110 S 7.72 4.66 0.00 3.93 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 0.00 111 A 8.42 4.36 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 0.00 112 A 9.13 4.15 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 0.00 113 S 9.14 4.53 0.00 3.85 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 0.00 114 L 8.48 4.43 0.00 1.66 1.62 0.96 1.12 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 0.00 115 N 8.76 4.79 0.00 2.89 2.93 0.00 0.00 6.65 7.25 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 0.00 116 S 8.72 4.33 0.00 4.02 4.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 R 8.74 4.30 0.00 1.89 2.03 0.00 3.16 0.00 0.00 3.16 7.35 0.00 0.00 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0.00 1.20 0.00 0.00 *127 S 7.57 4.32 0.00 4.00 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 128 C 8.44 4.41 0.00 2.94 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 0.00 129 A 8.03 4.44 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 130 S 8.04 4.40 0.00 3.96 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *132 A 8.20 4.24 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 0.00 133 G 9.21 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 0.00 0.00 0.00 134 T 7.60 3.99 4.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 135 Q 8.55 4.76 0.00 1.92 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.70 6.80 0.00 0.00 0.00 0.00 0.00 2.32 2.34 0.00 136 C 9.36 5.25 0.00 2.80 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 0.00 137 L 9.09 5.18 0.00 1.75 1.58 0.95 1.12 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 0.00 138 I 9.14 5.15 1.88 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.79 1.41 0.97 0.00 0.00 139 S 8.39 4.89 0.00 3.50 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 0.00 140 G 7.64 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 0.00 0.00 0.00 141 W 8.75 4.64 0.00 3.10 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 0.00 142 G 8.43 4.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 143 N 8.93 4.02 0.00 2.24 2.63 0.00 0.00 7.12 7.71 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 0.00 144 T 8.24 5.16 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 0.00 145 K 7.80 4.65 0.00 1.80 1.80 0.00 1.72 0.00 0.00 1.73 0.00 0.00 3.06 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.27 1.29 7.81 146 S 8.83 4.22 0.00 4.19 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 0.00 147 S 8.05 4.48 0.00 3.62 3.68 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 0.00 148 G 9.16 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 0.00 0.00 0.00 149 T 8.00 4.52 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 150 S 9.42 4.35 0.00 3.74 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 151 Y 8.46 5.01 0.00 2.96 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 0.00 152 P 0.00 4.77 0.00 2.45 2.11 0.00 4.21 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 2.16 2.06 0.00 153 D 8.75 4.55 0.00 2.80 2.96 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 0.00 154 V 7.40 5.48 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 1.11 0.00 0.00 0.97 0.00 0.00 155 L 8.42 3.27 0.00 1.38 1.27 -0.81 0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 156 K 8.26 4.96 0.00 1.66 1.51 0.00 1.63 0.00 0.00 1.70 0.00 0.00 2.81 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.45 1.49 7.81 157 C 8.62 5.26 0.00 1.43 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 0.00 0.00 0.00 158 L 8.66 5.00 0.00 1.67 1.44 1.02 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 159 K 9.03 5.11 0.00 1.82 1.82 0.00 1.86 0.00 0.00 1.82 0.00 0.00 2.82 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.64 1.51 7.81 160 A 9.20 4.80 1.15 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 0.00 0.00 0.00 0.00 0.00 0.00 161 P 0.00 5.01 0.00 2.01 2.26 0.00 3.13 0.00 0.00 3.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.74 0.00 162 I 8.20 4.36 1.86 0.00 0.00 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 0.98 0.45 0.78 0.00 0.00 163 L 8.83 4.79 0.00 1.53 1.60 0.93 0.76 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 0.00 164 S 8.42 4.39 0.00 4.00 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 165 D 8.64 4.41 0.00 2.81 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 0.00 166 S 8.00 4.12 0.00 3.90 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 0.00 167 S 8.06 4.17 0.00 3.96 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 0.00 168 C 8.38 4.29 0.00 3.21 3.30 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 0.00 169 K 8.48 3.98 0.00 1.97 1.90 0.00 1.86 0.00 0.00 1.69 0.00 0.00 3.00 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.53 1.55 7.81 170 S 8.07 4.14 0.00 3.97 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 0.00 171 A 7.85 3.98 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 172 Y 7.84 4.94 0.00 3.12 3.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173 P 0.00 4.72 0.00 2.22 2.10 0.00 3.52 0.00 0.00 2.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 1.96 0.00 174 G 8.96 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 0.00 175 Q 8.19 4.46 0.00 2.46 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.99 6.61 0.00 0.00 0.00 0.00 0.00 2.29 2.57 0.00 176 I 7.82 4.42 1.99 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.97 1.00 0.00 0.00 177 T 8.19 4.49 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 1.25 0.00 0.00 178 S 8.52 4.33 0.00 3.87 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 179 N 7.92 4.97 0.00 3.17 3.06 0.00 0.00 6.63 7.54 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 0.00 180 M 7.89 5.54 0.00 1.81 2.10 0.00 0.00 0.00 0.00 0.00 2.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.65 2.60 0.00 181 F 8.78 5.12 0.00 3.07 3.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 182 C 8.99 5.44 0.00 2.99 3.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 183 A 9.49 5.06 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 184 G 7.14 4.05 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 0.00 0.00 0.00 184A Y 8.41 4.64 0.00 3.06 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 0.00 185 L 8.70 4.14 0.00 1.74 1.73 0.92 0.92 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 0.00 186 E 8.23 4.08 0.00 2.10 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 2.32 2.26 0.00 187 G 7.55 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 0.00 188 G 10.21 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 0.00 0.00 0.00 188A K 7.30 5.45 0.00 1.44 1.69 0.00 1.16 0.00 0.00 1.58 0.00 0.00 2.66 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.35 1.03 7.81 189 D 8.46 4.72 0.00 2.82 2.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 190 S 8.79 4.86 0.00 4.00 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 191 C 9.42 4.78 0.00 2.93 3.09 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 0.00 192 Q 8.66 4.32 0.00 2.44 2.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 5.13 0.00 0.00 0.00 0.00 0.00 2.47 2.55 0.00 193 G 9.30 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 0.00 194 D 8.44 4.68 0.00 2.96 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 0.00 195 S 8.08 4.47 0.00 3.97 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 0.00 196 G 8.89 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 0.00 0.00 0.00 197 G 7.87 4.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 198 P 0.00 5.15 0.00 2.32 2.35 0.00 3.74 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 2.23 0.00 199 V 8.65 4.61 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.95 0.00 0.00 0.66 0.00 0.00 200 V 8.73 4.81 2.14 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 0.84 0.00 0.00 0.66 0.00 0.00 201 C 8.88 5.02 0.00 2.78 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 0.00 202 S 9.66 3.67 0.00 3.96 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 0.00 203 G 8.34 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 204 K 7.58 4.76 0.00 1.81 1.65 0.00 1.85 0.00 0.00 1.63 0.00 0.00 2.86 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.50 1.40 7.81 *209 L 8.28 4.34 0.00 1.51 1.64 1.01 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 210 Q 9.01 4.58 0.00 1.97 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.58 6.37 0.00 0.00 0.00 0.00 0.00 2.24 2.33 0.00 211 G 8.01 5.34 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 0.00 212 I 8.18 5.32 1.91 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 1.29 0.73 0.97 0.00 0.00 213 V 9.07 3.63 2.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.00 0.00 1.22 0.00 0.00 214 S 8.40 4.82 0.00 3.89 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 215 W 7.45 4.89 0.00 3.32 2.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 216 G 7.97 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 0.00 0.00 0.00 217 S 8.27 4.54 0.00 4.22 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 *219 G 8.06 4.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 220 C 8.08 5.02 0.00 2.95 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 0.00 221 A 9.27 4.34 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 221A Q 7.55 4.49 0.00 2.13 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.73 6.92 0.00 0.00 0.00 0.00 0.00 2.40 2.47 0.00 222 K 8.44 4.21 0.00 1.77 1.60 0.00 1.96 0.00 0.00 1.63 0.00 0.00 2.88 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.36 1.00 7.81 223 N 9.09 4.30 0.00 2.74 2.83 0.00 0.00 6.94 6.44 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 0.00 224 K 7.58 4.28 0.00 1.74 1.73 0.00 1.82 0.00 0.00 1.75 0.00 0.00 3.07 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.31 1.46 7.81 225 P 0.00 4.64 0.00 2.14 2.11 0.00 3.59 0.00 0.00 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 1.99 0.00 226 G 8.50 3.67 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 0.00 0.00 0.00 227 V 7.63 4.45 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 0.32 0.00 0.00 -0.72 0.00 0.00 228 Y 8.11 4.94 0.00 1.43 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 0.00 0.00 0.00 0.00 229 T 8.47 4.29 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 1.19 0.00 0.00 230 K 9.25 5.05 0.00 2.12 1.92 0.00 1.84 0.00 0.00 1.84 0.00 0.00 2.90 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.52 1.64 7.81 231 V 9.06 3.98 2.34 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 1.23 0.00 0.00 1.11 0.00 0.00 232 C 8.29 4.42 0.00 3.17 3.23 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 0.00 233 N 8.12 4.24 0.00 2.43 2.38 0.00 0.00 6.79 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 0.00 234 Y 7.97 4.79 0.00 3.20 3.15 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 0.00 0.00 0.00 0.00 235 V 8.04 3.70 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 1.11 0.00 0.00 1.04 0.00 0.00 236 S 8.11 4.14 0.00 4.12 4.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 237 W 8.30 4.13 0.00 3.53 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 0.00 238 I 8.38 3.25 2.03 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.09 0.77 0.00 0.00 239 K 8.06 3.76 0.00 1.73 1.77 0.00 1.65 0.00 0.00 1.62 0.00 0.00 2.93 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.38 1.50 7.81 240 Q 8.11 3.90 0.00 1.98 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.82 0.00 0.00 0.00 0.00 0.00 2.33 2.53 0.00 241 T 7.22 3.62 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 0.79 0.00 0.00 242 I 7.37 2.77 1.37 0.00 0.00 0.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 0.07 0.38 0.00 0.00 243 A 7.69 4.12 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 0.00 244 S 7.27 4.65 0.00 4.01 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 0.00 245 N 7.84 4.68 0.00 3.11 3.02 0.00 0.00 6.74 8.20 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 * Residues marked with a * may have inaccurate shift predictions.