NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 81 H 4.6680 8.4444 120.4031 55.8177 31.7483 173.0751 82 F 4.6097 8.2087 120.6626 56.7282 40.4027 173.3483 83 K 4.2931 8.4607 127.6174 54.0965 33.8543 175.7180 84 A 3.8389 8.3288 127.5348 51.1697 19.2182 177.1277 85 G 3.5135 7.9966 107.8721 46.1778 0.0000 171.6912 86 T 4.3386 7.6435 116.7172 62.3061 68.4201 173.9354 87 Y 4.9690 8.4053 123.8158 55.7879 41.2509 174.9076 88 R 4.6984 8.3346 117.5539 54.3891 31.3895 175.4293 89 F 4.6619 8.7977 120.8144 55.6134 40.3918 175.6829 90 T 4.2774 8.3752 116.4213 60.3159 69.6396 172.8994 91 P 4.2698 0.0000 0.0000 65.2027 31.3742 176.1695 92 Q 4.3056 7.8733 120.1989 54.0910 29.6722 174.4671 *94 T 4.1774 8.1325 114.9576 61.1696 69.9053 174.2302 95 V 3.7088 8.3261 122.1282 65.9318 32.0542 177.2034 96 R 4.0697 8.3377 119.9275 59.6715 29.8577 178.5700 97 E 4.1184 8.0169 115.6309 56.8732 29.3383 178.9535 *99 L 4.2235 8.0758 120.7614 54.8183 43.8363 179.3279 100 K 3.9627 7.7765 119.0347 59.3551 31.7295 178.6160 101 L 3.8257 7.9948 120.8121 58.1215 42.0438 178.7200 102 L 3.4438 7.6449 117.2806 56.4205 41.4624 178.3697 103 E 4.3641 7.4131 117.1568 58.1235 30.1632 178.1084 104 S 4.2627 7.6651 113.6272 59.4366 63.0932 175.7768 105 G 4.1865 7.7195 108.8222 45.3938 0.0000 174.9801 106 K 4.2711 7.5986 119.8644 55.9367 29.7046 176.3309 107 E 3.8673 7.6912 122.2539 54.8841 30.9405 176.1606 108 A 4.0072 8.5932 122.7360 52.2016 18.7431 177.3052 109 Q 4.3607 8.2554 121.4123 54.5210 30.4586 175.0916 110 F 4.7771 8.6079 122.6527 54.9093 41.1916 173.4945 111 P 4.9507 0.0000 0.0000 62.1505 33.1350 175.4130 112 L 4.6869 9.0158 123.7141 53.7779 45.2227 175.5046 113 R 4.8562 8.8221 126.8455 55.4023 30.3354 176.3103 114 L 4.3129 8.8044 126.1180 53.2127 42.8910 176.4713 115 V 4.2254 8.4926 124.4927 60.9122 32.6644 175.4072 116 E 4.0431 8.4818 124.7341 57.9209 30.2232 177.2675 117 G 3.6094 8.9083 110.1853 46.1892 0.0000 173.0448 *119 R 4.1322 7.5958 116.2234 55.1539 31.8611 176.9471 120 L 3.4708 8.7079 120.8799 58.2569 41.8771 179.3034 121 S 4.2760 8.2148 113.7298 61.5715 62.9354 176.1900 122 D 4.3604 7.6927 122.5342 57.3989 40.5481 178.3044 123 Y 4.5928 7.4222 118.1574 60.5811 37.8838 178.1992 124 L 3.9748 8.3523 120.4522 57.6257 41.1613 179.5007 125 K 3.9647 8.0459 119.3918 59.6211 31.8287 178.9531 126 Q 4.0756 7.9852 117.9115 58.9081 28.3585 178.7466 127 L 4.0510 7.7985 119.3886 57.6446 41.7043 179.4093 128 R 3.9879 7.7804 116.9371 58.1368 30.0574 177.7256 129 E 4.4544 7.4448 114.6424 54.9404 30.5743 175.7490 130 A 4.3340 7.0746 122.2632 50.4279 18.1303 175.8805 131 P 3.9161 0.0000 0.0000 63.9285 32.1095 176.1553 132 Y 3.8434 7.7954 116.8176 59.1748 35.2544 168.5908 133 I 4.6150 6.8871 120.0749 59.7765 38.7375 175.6293 134 K 3.9896 8.6347 129.2426 56.2756 33.0110 175.8059 135 H 5.1197 8.6502 126.5753 55.4294 27.9740 175.0395 136 T 4.3274 8.6906 113.6988 61.9269 70.0907 175.7580 137 L 4.0790 7.8008 122.8386 54.4367 42.0173 176.8087 138 S 4.2214 8.8449 119.2101 61.0238 62.4516 173.1124 139 D 4.7014 7.5607 115.8816 52.7419 41.9407 173.9297 140 D 4.8476 8.4054 116.1808 54.2368 41.2506 177.8307 141 K 4.2241 7.6899 118.6227 56.6743 33.7889 177.7191 142 Y 4.2807 8.8093 120.0709 61.1247 37.9149 178.7856 143 A 4.0727 8.1289 121.5358 55.1483 18.4808 179.7122 144 T 3.7944 7.8689 113.9841 66.8711 68.7037 176.8819 145 V 3.5631 7.7566 119.5974 65.9897 31.6600 177.8839 146 A 4.0172 8.3842 120.8435 55.0671 18.1150 179.4837 147 Q 3.8569 8.1315 117.8334 59.3585 28.9845 178.2853 148 A 4.0307 7.9817 120.6382 54.8546 18.5041 178.9451 149 L 4.0989 7.9932 115.4255 54.4771 43.0782 176.4611 150 E 3.7211 7.5741 117.4038 57.2667 27.1659 174.7838 151 L 4.1731 7.5871 117.2579 54.2625 43.0797 178.1556 152 E 3.8183 8.6720 122.1844 59.1316 29.8020 177.3615 153 N 4.5571 7.3487 120.7238 50.7265 38.8852 173.8088 154 P 4.4613 0.0000 0.0000 64.1329 31.6092 177.5324 155 E 4.4228 8.0182 116.8038 57.3668 30.1998 177.1666 156 W 4.8194 7.7571 120.5229 55.1149 27.9460 174.2374 157 I 4.3769 7.9063 119.8897 62.2044 39.9053 175.0519 158 E 4.3459 8.3835 119.9397 57.6361 29.8020 176.7935 159 G 3.9987 9.4164 114.6074 45.1775 0.0000 173.2916 160 W 4.7373 8.0719 119.7126 56.2071 29.6149 175.9703 161 F 5.2762 8.0168 115.6531 55.3625 42.2895 174.5398 162 W 4.6451 9.1833 135.0000 56.7364 31.1455 173.5779 163 P 4.6886 0.0000 0.0000 62.5613 32.0835 174.7021 164 D 4.3381 8.4100 121.4630 53.8636 45.7965 174.1220 165 T 4.6897 8.4020 117.4366 63.0278 68.7749 174.7210 166 W 4.7350 9.2158 131.2679 55.5708 32.6344 175.0045 *168 Y 5.0576 8.2822 117.7082 57.9544 39.0377 175.0020 169 T 4.8621 8.5369 111.0885 60.9010 70.8442 173.9407 170 A 3.9231 8.6113 125.5054 53.6628 18.8799 177.4790 171 N 4.3517 8.9672 118.1026 54.0420 38.6916 174.7276 172 T 4.0316 7.5398 114.7320 64.0782 69.1296 174.2574 173 T 4.5986 8.2751 116.4993 61.1284 71.1696 175.3692 174 D 4.2188 8.4557 123.0505 56.8258 39.2070 179.1268 175 V 3.5077 7.7347 119.0365 65.6414 31.5430 177.7337 176 A 3.9521 7.9421 120.3583 54.8472 18.2081 179.4318 177 L 3.8028 7.6243 119.2594 58.1954 42.1873 179.1662 178 L 3.9324 7.7794 119.0202 57.4678 41.5089 179.3659 179 K 4.0447 8.3250 119.9937 59.5402 32.2462 179.1350 180 R 3.9359 7.7797 117.8008 59.0679 29.9499 178.9568 181 A 3.7610 7.3711 120.4382 55.1586 18.1391 179.0959 182 H 4.4889 8.5056 117.2649 58.9520 30.2482 177.2873 183 K 4.1443 8.1174 120.2150 59.1394 31.8131 179.8830 184 K 3.7740 7.9005 117.1146 56.8376 31.9131 178.6289 *186 V 4.3063 7.7455 118.5894 62.5027 33.5166 177.4991 187 K 3.9572 8.1040 118.8393 59.5162 31.8243 179.2340 188 A 3.9975 7.9650 121.0249 55.0637 18.2960 179.9483 189 V 3.5515 7.7553 116.3274 66.2365 31.7429 177.7971 190 D 4.5934 8.4272 118.8386 57.5780 40.4933 178.8444 191 S 4.1793 8.2397 113.2919 61.1161 62.1501 176.1133 192 A 4.0702 7.9053 122.8973 54.7482 18.2985 179.0535 193 W 4.3279 8.7966 127.2787 60.9412 30.6364 178.1751 194 E 3.9381 8.3359 117.0648 58.9639 29.0119 178.1130 195 G 3.9521 7.7090 105.4333 45.2879 0.0000 173.9157 196 R 4.0016 7.2551 116.5784 55.6048 30.1095 176.6529 197 A 4.2713 8.1917 122.6292 52.0438 19.0629 177.2028 198 D 4.2782 8.5574 119.7981 53.4332 40.8863 176.2368 199 G 3.7802 8.5439 107.5128 46.6144 0.0000 173.5624 200 L 4.1070 7.4325 119.0094 53.1083 42.5263 175.6296 201 P 4.5110 0.0000 0.0000 63.0147 31.6192 175.8677 202 Y 4.7447 6.7126 116.4435 58.5555 38.4320 176.0071 203 K 4.4169 9.4185 124.1907 58.2096 33.1692 176.2798 204 D 4.7460 7.6564 115.8872 50.2662 42.9206 176.1742 205 K 3.2740 7.6751 117.4489 59.1442 31.6906 179.0584 206 N 4.1112 7.1548 116.8874 56.4284 38.3724 176.8185 207 Q 3.8127 7.4566 118.5986 58.4238 28.8483 177.8753 208 L 2.9576 6.8147 119.4618 57.8034 42.4251 178.9219 209 V 3.4298 7.2497 118.1112 65.9622 31.2928 178.1188 210 T 3.6365 7.5041 111.2669 64.5504 67.7496 175.7063 *212 A 4.2429 7.9281 126.6863 52.1845 20.7499 179.9974 213 S 4.0607 7.9164 111.0241 61.3913 62.8563 176.9239 214 I 3.5541 7.5513 123.4087 64.2101 36.8467 178.3681 215 I 3.9034 7.5978 120.1851 64.2863 36.7438 177.8458 216 E 4.0039 8.0009 120.5930 58.6436 29.6320 178.5598 217 K 4.2223 7.8144 115.2049 57.5648 32.3920 177.6401 218 E 4.6173 7.4590 117.5079 56.4547 30.8534 176.1228 219 T 3.9473 7.6944 116.1419 63.4659 68.7339 173.7909 220 A 4.5966 8.6379 128.7237 51.9232 21.4267 176.3952 221 V 4.3767 7.4542 115.0418 60.6889 34.1621 176.1403 222 A 4.0551 8.6954 130.1372 55.1853 18.4687 179.0982 223 S 4.2949 8.0189 108.4171 60.0517 63.6465 175.0139 224 E 4.4502 7.9952 120.2002 56.1596 29.7790 177.4803 225 R 3.8567 7.5840 120.6349 59.7754 30.2312 178.1779 226 D 4.3911 8.0087 117.8144 57.1226 40.8125 178.4884 227 Q 3.9105 7.8108 118.3292 58.2016 28.9275 178.3016 228 V 3.3612 7.8958 119.2446 65.8583 31.5707 177.6103 229 A 4.1905 8.0935 120.5775 55.5433 18.1379 179.4250 230 S 4.0359 8.0215 111.2707 61.5324 62.4239 176.4556 231 V 3.8992 7.7217 122.0825 65.6561 31.2939 178.0694 232 F 4.4489 7.9604 117.0263 60.7421 38.7331 177.8713 233 I 3.8106 8.1880 119.5772 64.1165 36.8658 177.9941 234 N 4.2661 8.5605 117.9035 56.6007 38.4765 177.5211 235 R 3.8679 8.0721 119.1098 59.1897 29.9354 178.8918 236 L 3.9546 7.8585 118.9546 58.0323 42.1397 178.6314 237 R 3.9921 7.9267 117.9040 59.0607 30.2099 177.7745 238 I 4.4127 7.4519 108.9323 59.8692 38.6127 174.8428 239 G 3.5817 7.8372 110.4206 46.1388 0.0000 172.7966 *241 R 4.0836 7.8798 123.1156 55.4889 31.3199 176.6068 242 L 4.0771 8.5182 121.4819 56.0181 42.4946 177.1062 243 Q 2.5200 7.4845 116.8603 56.9068 26.1601 173.9450 244 T 4.6535 7.5815 111.6632 60.0587 70.0165 174.2273 245 D 4.5881 9.0402 129.0275 57.1822 40.8763 176.7479 246 P 4.2627 0.0000 0.0000 65.9240 31.3530 178.5943 247 T 3.9844 7.7318 107.3950 64.3952 68.5169 177.1605 248 V 3.6674 7.6809 120.2244 65.8522 31.7707 177.4430 249 I 3.4926 7.4456 118.3053 64.5863 37.0101 177.1184 250 Y 3.9702 7.9365 119.0951 60.5181 38.7162 179.6133 251 G 3.9783 7.8369 105.7718 44.0593 0.0000 174.6977 *253 G 3.8511 8.5140 113.6915 45.0949 0.0000 175.9179 254 E 4.2710 8.7553 123.0625 56.8379 29.8241 177.4978 255 R 3.9408 7.7544 118.2256 58.2007 30.4257 175.8378 256 Y 4.3295 7.4976 119.6353 56.8792 37.8856 174.8114 257 N 4.2496 8.2178 125.7292 53.7000 37.9356 175.1310 258 G 3.1533 5.9547 105.6104 44.7389 0.0000 173.6603 259 K 4.6088 7.1194 118.9307 54.1764 35.5220 175.2669 260 L 4.9036 8.5387 123.3111 53.3457 44.5574 175.5231 261 S 4.8587 8.9030 120.4915 55.8750 65.9239 174.7592 262 R 3.8296 8.4173 118.4128 59.4024 29.3768 178.1252 263 A 3.9932 7.8706 119.6220 55.1192 18.2092 178.8508 264 D 4.4462 7.7807 116.3882 57.6006 40.7155 179.0659 265 L 3.8112 7.6374 118.1234 56.9973 41.5999 178.4318 266 E 4.5416 7.6343 115.9420 55.5713 30.0441 176.0411 267 T 4.2722 7.0146 116.4182 61.7562 68.9310 172.9583 268 P 4.4433 0.0000 0.0000 62.6280 32.0088 175.7579 269 T 4.7676 8.1987 111.2160 59.4180 72.1414 174.4917 270 A 4.0114 8.7579 123.8218 54.9452 18.3487 178.0587 271 Y 4.2002 7.5986 110.4194 58.3319 38.8115 175.4863 272 N 4.6139 8.0036 119.5993 53.4558 38.1530 174.7700 273 T 4.4312 8.4155 114.0354 62.4585 68.9092 175.8797 274 Y 4.2530 8.6223 120.4972 59.0924 38.7029 176.3513 275 T 4.4570 8.0686 108.6610 62.2504 70.6810 174.8370 276 I 4.2323 7.7387 114.2034 59.8958 38.9891 174.9625 277 T 4.3508 8.2916 118.4331 63.3068 70.0592 176.2969 278 G 3.8049 8.5171 112.9698 44.4257 0.0000 172.7733 279 L 4.1596 8.1124 118.2148 53.4035 42.0190 175.2402 280 P 4.2412 0.0000 0.0000 62.0139 31.7040 175.0753 281 P 4.3942 0.0000 0.0000 63.3023 31.2879 175.6253 282 G 3.9308 6.9411 105.3985 44.9641 0.0000 173.0309 283 A 4.1451 8.4833 122.8740 51.9658 18.8430 177.4445 284 I 3.0338 7.7383 111.1523 60.3734 38.7606 174.7464 285 A 4.4379 7.1910 120.8262 51.7579 22.4028 175.2312 286 T 4.4314 8.1961 115.6450 62.1486 69.5406 173.5367 287 P 4.6093 0.0000 0.0000 62.5292 32.7868 176.5738 288 G 3.8039 9.0190 110.3488 43.4254 0.0000 174.6506 289 A 4.0897 8.0675 120.1589 54.7292 18.1491 179.5892 290 D 4.2785 7.9289 117.5982 56.9799 39.1033 178.9685 291 S 4.1239 7.9090 116.6301 60.8474 62.9012 176.1255 292 L 3.9594 7.9589 123.1074 57.9307 41.7600 179.0932 293 K 4.0784 8.1022 119.1688 59.5483 32.0213 178.8221 294 A 4.2576 7.8269 119.3589 54.9362 18.3045 179.1093 295 A 4.1880 8.2291 118.5789 54.4877 18.7107 178.8119 296 A 4.5119 7.6589 117.3070 52.8920 20.6979 176.3807 297 H 5.0465 8.4818 113.7030 53.4612 29.2566 171.3287 298 P 4.4597 0.0000 0.0000 61.7594 32.5635 177.1652 299 A 3.9844 8.2169 122.3296 52.2382 18.7338 178.3850 300 K 4.2300 8.3618 121.8430 55.7087 31.0279 176.4286 301 T 4.4833 7.8038 112.7748 59.1075 71.8431 171.9559 302 P 4.6397 0.0000 0.0000 62.8155 31.4521 175.2305 303 Y 4.8945 7.3931 116.8283 58.6087 38.4224 175.7704 304 L 4.8167 9.1621 121.1313 54.3498 43.9815 176.1004 305 Y 4.7260 7.9514 116.3870 56.1410 42.4395 174.0344 306 F 5.2842 7.9149 116.4291 55.4043 41.2261 173.8947 307 V 4.5848 8.4025 118.8423 59.6788 35.1683 174.3283 308 A 4.0667 8.1681 125.3724 52.5420 18.4826 177.6434 309 D 4.4440 8.3376 121.7165 54.0806 40.0136 177.2923 310 G 4.2876 8.6232 108.5766 45.0545 0.0000 173.6188 311 K 4.5857 8.3249 118.3304 55.7760 32.3472 176.7722 312 G 4.0102 8.4234 107.8339 45.7308 0.0000 172.4561 313 G 4.3075 7.4964 106.9163 45.0817 0.0000 172.2972 314 H 5.3793 8.8601 115.8948 54.2965 32.9994 173.2899 315 T 4.5672 8.9331 118.5409 61.9819 70.5663 173.5373 316 F 5.0057 8.6933 124.8045 56.1538 40.4584 174.9079 317 N 5.3962 9.2564 118.9727 52.2224 42.7930 175.3218 318 T 4.6851 8.9906 110.1981 62.6587 70.4881 174.7538 319 N 5.2371 7.7575 118.6814 50.1858 41.8690 174.8204 320 L 3.3508 8.3761 121.8607 57.6804 42.1777 178.8118 321 A 3.9162 7.9094 120.3953 55.4402 18.4497 179.6208 322 S 4.0787 8.5237 113.6987 61.8461 62.7484 176.6293 323 H 4.2460 7.8314 121.8923 58.8962 29.7455 177.1836 324 N 4.2060 8.3255 118.5719 55.9572 38.1973 177.6365 325 K 3.9373 7.9860 120.0871 59.7138 32.2045 179.5830 326 S 4.1104 7.9699 115.3289 61.3039 62.6268 177.0060 327 V 3.6048 7.9216 121.3017 66.1969 31.2343 178.0665 328 Q 4.0073 7.9329 117.4290 59.1630 28.2890 178.6785 329 D 4.3854 8.3481 119.9762 57.5151 40.8738 178.2673 330 Y 4.2308 8.1505 120.1267 60.7026 38.9447 177.8546 331 L 3.7561 8.1270 119.8345 57.2259 41.5556 179.6539 332 K 3.9604 7.8196 118.6903 59.1864 32.0125 179.3938 333 V 3.5482 7.4284 118.4235 66.1703 31.4602 178.1923 334 L 3.9651 7.6404 118.3407 57.1392 41.3253 179.5268 335 K 3.8592 7.7283 119.6853 59.6034 31.9926 178.8090 336 E 3.9814 8.0946 117.6751 59.0762 29.3619 179.0953 337 K 4.0743 7.7754 118.9672 59.4513 32.4429 178.1839 338 N 4.4992 7.9119 114.8416 54.2629 39.2910 175.7367 339 A 4.4254 7.3845 122.0244 51.3556 19.8830 177.1996 340 Q 4.2211 8.4212 118.8377 56.0904 29.4524 175.7112 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 81 H 8.44 4.67 0.00 3.13 3.50 0.00 5.88 0.00 0.00 0.00 0.00 6.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 F 8.21 4.61 0.00 3.09 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 83 K 8.46 4.29 0.00 1.59 1.66 0.00 1.94 0.00 0.00 1.70 0.00 0.00 2.94 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.30 1.29 7.81 84 A 8.33 3.84 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 G 8.00 3.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 86 T 7.64 4.34 4.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 87 Y 8.41 4.97 0.00 2.95 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 88 R 8.33 4.70 0.00 1.90 1.90 0.00 2.94 0.00 0.00 3.15 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.57 0.00 89 F 8.80 4.66 0.00 3.01 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 90 T 8.38 4.28 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 1.21 0.00 0.00 91 P 0.00 4.27 0.00 2.22 2.25 0.00 3.77 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.98 0.00 92 Q 7.87 4.31 0.00 2.01 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.43 6.64 0.00 0.00 0.00 0.00 0.00 2.26 2.39 0.00 *94 T 8.13 4.18 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 95 V 8.33 3.71 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.79 0.00 0.00 0.94 0.00 0.00 96 R 8.34 4.07 0.00 1.92 1.93 0.00 3.27 0.00 0.00 3.33 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.73 0.00 97 E 8.02 4.12 0.00 2.26 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 2.31 2.27 0.00 *99 L 8.08 4.22 0.00 1.97 1.75 0.93 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 100 K 7.78 3.96 0.00 1.93 1.89 0.00 1.62 0.00 0.00 1.55 0.00 0.00 2.93 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.41 1.42 7.81 101 L 7.99 3.83 0.00 1.77 1.29 0.56 0.97 0.00 0.00 0.00 0.00 0.00 0.00 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0.00 2.19 2.24 0.00 110 F 8.61 4.78 0.00 1.61 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 0.00 111 P 0.00 4.95 0.00 2.15 2.08 0.00 3.86 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 1.98 0.00 112 L 9.02 4.69 0.00 2.07 1.75 0.98 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 113 R 8.82 4.86 0.00 1.78 1.92 0.00 3.28 0.00 0.00 3.25 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.71 0.00 114 L 8.80 4.31 0.00 1.37 0.36 0.44 0.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 115 V 8.49 4.23 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.86 0.00 0.00 0.99 0.00 0.00 116 E 8.48 4.04 0.00 2.13 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.41 0.00 117 G 8.91 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *119 R 7.60 4.13 0.00 1.88 2.16 0.00 3.11 0.00 0.00 3.35 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 1.63 0.00 120 L 8.71 3.47 0.00 1.44 1.19 0.05 0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 121 S 8.21 4.28 0.00 4.13 4.32 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 0.00 122 D 7.69 4.36 0.00 2.66 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 0.00 123 Y 7.42 4.59 0.00 2.93 2.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 124 L 8.35 3.97 0.00 1.81 1.70 0.92 0.32 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 0.00 125 K 8.05 3.96 0.00 2.01 1.96 0.00 1.64 0.00 0.00 1.66 0.00 0.00 2.95 0.00 0.00 3.19 0.00 0.00 0.00 0.00 1.43 1.47 7.81 126 Q 7.99 4.08 0.00 2.42 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.58 0.00 0.00 0.00 0.00 0.00 2.43 2.60 0.00 127 L 7.80 4.05 0.00 1.77 1.67 0.80 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 128 R 7.78 3.99 0.00 1.91 1.92 0.00 3.21 0.00 0.00 3.10 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.84 0.00 129 E 7.44 4.45 0.00 1.94 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 0.00 2.24 2.27 0.00 130 A 7.07 4.33 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 0.00 131 P 0.00 3.92 0.00 1.40 1.79 0.00 3.90 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 1.96 0.00 132 Y 7.80 3.84 0.00 2.97 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 0.00 133 I 6.89 4.61 1.74 0.00 0.00 0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.82 0.47 0.77 0.00 0.00 134 K 8.63 3.99 0.00 1.83 1.65 0.00 1.62 0.00 0.00 1.63 0.00 0.00 2.81 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.40 1.40 7.81 135 H 8.65 5.12 0.00 3.08 3.24 0.00 5.73 0.00 0.00 0.00 0.00 7.00 0.00 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0.00 0.00 0.00 0.00 144 T 7.87 3.79 4.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 145 V 7.76 3.56 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 0.00 0.00 0.98 0.00 0.00 146 A 8.38 4.02 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 147 Q 8.13 3.86 0.00 2.28 2.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.75 0.00 0.00 0.00 0.00 0.00 2.35 2.41 0.00 148 A 7.98 4.03 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 0.00 149 L 7.99 4.10 0.00 1.65 1.67 1.09 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 150 E 7.57 3.72 0.00 2.04 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 2.28 2.29 0.00 151 L 7.59 4.17 0.00 1.56 1.41 0.83 0.32 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 0.00 152 E 8.67 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0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.52 1.47 7.81 204 D 7.66 4.75 0.00 2.88 2.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 205 K 7.68 3.27 0.00 1.71 1.90 0.00 1.53 0.00 0.00 1.89 0.00 0.00 2.91 0.00 0.00 2.57 0.00 0.00 0.00 0.00 0.96 0.21 7.81 206 N 7.15 4.11 0.00 1.44 1.78 0.00 0.00 7.25 7.39 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 0.00 207 Q 7.46 3.81 0.00 2.24 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.05 6.72 0.00 0.00 0.00 0.00 0.00 2.32 2.52 0.00 208 L 6.81 2.96 0.00 1.46 1.70 0.86 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 209 V 7.25 3.43 1.65 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 0.35 0.00 0.00 -0.07 0.00 0.00 210 T 7.50 3.64 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 1.20 0.00 0.00 *212 A 7.93 4.24 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 213 S 7.92 4.06 0.00 4.11 4.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 214 I 7.55 3.55 1.62 0.00 0.00 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 1.34 1.09 0.16 0.00 0.00 215 I 7.60 3.90 2.01 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.99 0.96 0.00 0.00 216 E 8.00 4.00 0.00 2.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.47 2.24 0.00 217 K 7.81 4.22 0.00 1.78 1.84 0.00 1.74 0.00 0.00 1.63 0.00 0.00 2.99 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.45 1.61 7.81 218 E 7.46 4.62 0.00 2.29 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.87 2.60 0.00 219 T 7.69 3.95 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 220 A 8.64 4.60 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 0.00 221 V 7.45 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0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.57 0.00 238 I 7.45 4.41 1.85 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 1.65 0.73 0.89 0.00 0.00 239 G 7.84 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 *241 R 7.88 4.08 0.00 1.77 2.08 0.00 3.26 0.00 0.00 3.30 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.65 0.00 242 L 8.52 4.08 0.00 1.58 1.78 0.85 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 243 Q 7.48 2.52 0.00 1.74 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.60 0.00 0.00 0.00 0.00 0.00 1.82 2.11 0.00 244 T 7.58 4.65 4.36 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 1.02 0.00 0.00 245 D 9.04 4.59 0.00 2.83 2.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 246 P 0.00 4.26 0.00 2.14 2.11 0.00 3.65 0.00 0.00 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.19 0.00 247 T 7.73 3.98 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 1.17 0.00 0.00 248 V 7.68 3.67 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 0.90 0.00 0.00 1.19 0.00 0.00 249 I 7.45 3.49 1.79 0.00 0.00 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.71 0.56 0.00 0.00 0.00 250 Y 7.94 3.97 0.00 2.90 2.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 251 G 7.84 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 *253 G 8.51 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 0.00 254 E 8.76 4.27 0.00 2.05 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 2.20 2.29 0.00 255 R 7.75 3.94 0.00 1.84 2.04 0.00 3.21 0.00 0.00 3.15 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.60 0.00 256 Y 7.50 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0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 273 T 8.42 4.43 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 0.00 274 Y 8.62 4.25 0.00 3.24 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 0.00 275 T 8.07 4.46 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 1.28 0.00 0.00 276 I 7.74 4.23 1.86 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 1.43 0.61 1.01 0.00 0.00 277 T 8.29 4.35 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 0.00 278 G 8.52 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 0.00 279 L 8.11 4.16 0.00 1.63 1.55 1.05 0.95 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 0.00 280 P 0.00 4.24 0.00 1.90 2.08 0.00 3.61 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 2.00 1.95 0.00 281 P 0.00 4.39 0.00 2.12 2.08 0.00 2.31 0.00 0.00 3.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.65 0.00 282 G 6.94 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 0.00 283 A 8.48 4.15 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 0.00 284 I 7.74 3.03 1.66 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.64 0.68 0.00 0.00 285 A 7.19 4.44 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 286 T 8.20 4.43 4.36 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 1.39 0.00 0.00 287 P 0.00 4.61 0.00 1.97 1.97 0.00 3.81 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 1.79 0.00 288 G 9.02 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 0.00 289 A 8.07 4.09 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 0.00 290 D 7.93 4.28 0.00 2.95 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 0.00 291 S 7.91 4.12 0.00 3.84 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 0.00 292 L 7.96 3.96 0.00 1.83 1.74 0.81 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 293 K 8.10 4.08 0.00 2.08 1.97 0.00 1.71 0.00 0.00 1.67 0.00 0.00 2.94 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.49 1.50 7.81 294 A 7.83 4.26 1.46 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 0.00 0.00 295 A 8.23 4.19 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 0.00 296 A 7.66 4.51 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 0.00 297 H 8.48 5.05 0.00 3.14 3.20 0.00 5.66 0.00 0.00 0.00 0.00 6.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 298 P 0.00 4.46 0.00 2.18 2.09 0.00 3.76 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 1.97 1.96 0.00 299 A 8.22 3.98 1.24 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 0.00 0.00 300 K 8.36 4.23 0.00 1.71 1.75 0.00 1.66 0.00 0.00 1.71 0.00 0.00 2.99 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.39 1.39 7.81 301 T 7.80 4.48 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 302 P 0.00 4.64 0.00 2.09 2.04 0.00 2.77 0.00 0.00 3.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.76 0.00 303 Y 7.39 4.89 0.00 3.19 3.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 304 L 9.16 4.82 0.00 1.28 1.24 0.99 0.57 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 0.00 305 Y 7.95 4.73 0.00 2.93 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 0.00 306 F 7.91 5.28 0.00 1.99 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 0.00 0.00 0.00 307 V 8.40 4.58 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 0.62 0.00 0.00 0.79 0.00 0.00 308 A 8.17 4.07 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 309 D 8.34 4.44 0.00 2.80 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 0.00 310 G 8.62 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 0.00 311 K 8.32 4.59 0.00 1.89 1.96 0.00 1.37 0.00 0.00 1.68 0.00 0.00 2.98 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.48 1.49 7.81 312 G 8.42 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 0.00 313 G 7.50 4.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 314 H 8.86 5.38 0.00 2.76 2.65 0.00 5.82 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 315 T 8.93 4.57 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 1.20 0.00 0.00 316 F 8.69 5.01 0.00 1.95 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 0.00 317 N 9.26 5.40 0.00 2.71 2.73 0.00 0.00 6.60 7.91 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 0.00 318 T 8.99 4.69 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 1.36 0.00 0.00 319 N 7.76 5.24 0.00 2.98 2.96 0.00 0.00 5.93 6.67 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 0.00 320 L 8.38 3.35 0.00 1.72 1.64 0.73 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 321 A 7.91 3.92 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 0.00 322 S 8.52 4.08 0.00 3.88 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 0.00 323 H 7.83 4.25 0.00 2.86 2.84 0.00 5.83 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 324 N 8.33 4.21 0.00 2.86 2.80 0.00 0.00 7.09 6.54 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 0.00 325 K 7.99 3.94 0.00 1.99 1.84 0.00 1.66 0.00 0.00 1.64 0.00 0.00 2.94 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.44 1.55 7.81 326 S 7.97 4.11 0.00 3.95 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 0.00 327 V 7.92 3.60 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 1.07 0.00 0.00 0.79 0.00 0.00 328 Q 7.93 4.01 0.00 2.31 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.57 0.00 0.00 0.00 0.00 0.00 2.36 2.54 0.00 329 D 8.35 4.39 0.00 2.90 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 0.00 330 Y 8.15 4.23 0.00 3.10 3.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 331 L 8.13 3.76 0.00 1.82 1.60 0.90 0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 332 K 7.82 3.96 0.00 1.91 1.83 0.00 1.66 0.00 0.00 1.56 0.00 0.00 2.87 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.43 1.63 7.81 333 V 7.43 3.55 2.26 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 1.05 0.00 0.00 1.03 0.00 0.00 334 L 7.64 3.97 0.00 1.64 1.53 0.46 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 335 K 7.73 3.86 0.00 1.95 1.92 0.00 1.60 0.00 0.00 1.62 0.00 0.00 2.91 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.40 1.44 7.81 336 E 8.09 3.98 0.00 2.06 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 2.35 0.00 337 K 7.78 4.07 0.00 1.87 1.80 0.00 1.79 0.00 0.00 1.70 0.00 0.00 3.03 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.44 1.47 7.81 338 N 7.91 4.50 0.00 2.86 2.83 0.00 0.00 7.04 7.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 339 A 7.38 4.43 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 0.00 340 Q 8.42 4.22 0.00 2.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.90 6.60 0.00 0.00 0.00 0.00 0.00 2.23 2.29 0.00 * Residues marked with a * may have inaccurate shift predictions.