NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 16 I 4.2518 7.8827 121.4440 61.2061 38.6530 173.7581 17 V 4.3805 8.8265 126.0506 61.8195 32.7700 174.6572 18 G 4.2476 8.5779 114.1134 46.6441 0.0000 173.2918 19 G 4.2902 7.6407 109.4652 44.2737 0.0000 172.6009 20 Y 4.9505 7.8415 116.7261 55.0706 42.0958 175.0746 21 T 4.1792 8.6940 117.4460 64.5770 68.4563 174.6319 22 C 4.1852 8.6348 125.3907 60.5923 36.9139 175.2468 23 G 4.1161 8.4975 105.5319 44.1973 0.0000 172.7883 24 A 4.1580 8.4992 124.5098 53.5028 18.6402 177.0876 25 N 4.2513 8.8863 119.3385 54.5079 36.2262 175.2800 26 T 4.1956 7.5273 107.3008 62.6403 69.9418 175.0343 27 V 4.0794 7.0335 121.8369 60.4539 31.3164 173.8143 28 P 4.4554 0.0000 0.0000 64.6737 32.1166 178.3101 29 Y 5.1668 6.9628 115.7611 57.1307 38.7214 174.5248 30 Q 4.5587 7.4450 123.7202 56.3275 29.4135 175.5583 31 V 4.8392 9.0414 119.6939 59.7305 35.6275 174.2826 32 S 4.8651 8.7811 117.3254 56.6800 64.5806 172.7008 33 L 4.6866 8.6231 127.6298 53.4333 43.2216 175.0107 34 N 6.0181 9.1795 122.8517 50.1447 42.0464 175.0189 *37 S 4.2753 8.5111 120.7298 58.6211 64.2036 174.4540 38 G 3.9914 9.2398 109.0981 46.4721 0.0000 173.5932 39 Y 4.5609 6.7180 114.9585 56.0428 40.0023 172.8748 40 H 4.6021 8.9503 122.0220 56.5853 30.2772 174.7996 41 F 5.0629 8.1629 119.8766 56.5295 39.4364 173.8487 42 C 4.7849 6.9510 114.7489 56.3439 44.5244 173.6601 43 G 4.3517 9.1701 109.9440 45.8706 0.0000 172.1780 44 G 4.4416 8.0769 105.2896 46.2461 0.0000 172.3416 45 S 5.3938 8.9123 115.5463 56.2925 66.4117 173.8788 46 L 4.7338 9.3247 128.6927 55.1740 42.3759 177.2236 47 I 4.4748 8.6477 119.5215 60.8835 39.1490 174.3471 48 N 4.6549 7.5355 117.3940 52.3299 39.4699 174.8703 49 S 4.3369 8.5969 111.6775 60.4133 63.2427 175.1300 50 Q 4.5211 8.9273 119.1973 55.2769 30.2080 174.7628 51 W 5.5062 8.2663 117.8553 54.7928 33.6463 174.3143 52 V 4.9566 9.2139 123.1412 61.1739 34.4846 174.1304 53 V 4.8474 8.9149 127.0682 61.6360 33.7490 174.6579 54 S 5.2658 8.9038 120.9928 57.1187 66.6335 172.1538 55 A 4.6367 8.6844 120.9877 50.1360 19.8070 178.4847 56 A 3.8117 8.2601 124.0510 55.2627 18.4397 179.3217 57 H 4.5487 8.2807 109.5818 57.4322 28.7327 175.4530 58 C 4.6638 7.8747 117.1046 57.4121 40.5685 173.2971 59 Y 4.3267 7.6831 121.9661 58.2030 38.5864 175.3642 60 K 3.1857 7.3730 123.8371 55.9978 34.9087 174.2382 61 S 4.4318 7.9192 114.5421 57.6966 64.8397 173.6716 62 G 3.7414 8.5576 105.6459 46.2832 0.0000 173.2163 63 I 4.2345 7.5641 120.0159 60.1831 38.9758 174.5163 64 Q 4.8550 8.8343 127.7512 54.2588 31.6022 174.1585 65 V 4.3209 8.9364 127.1067 61.8723 33.4493 174.6004 66 R 5.1374 8.9765 127.4166 54.7617 32.2559 175.1502 67 L 4.7537 9.1640 124.8146 52.6011 44.9257 177.5475 *69 G 4.1564 8.2349 107.1859 45.4711 0.0000 172.5700 70 E 4.5444 8.1442 118.9287 54.9401 30.3666 174.2066 71 D 5.0295 8.1437 118.2869 55.1396 44.2996 174.7677 72 N 5.0815 8.3832 118.9331 53.3836 39.5290 175.6682 73 I 4.1260 8.3628 118.9148 61.2382 37.8883 176.1124 74 N 4.7757 9.0854 118.2507 53.0485 39.3550 174.6899 75 V 4.3078 7.4569 118.3795 60.6677 34.1360 174.9920 76 V 4.1450 8.4687 126.9195 62.6876 31.1024 175.1773 77 E 4.3879 9.5013 127.4552 55.7729 30.2968 177.2049 78 G 4.0273 8.4198 106.3128 45.2214 0.0000 174.0058 79 N 4.8942 8.0817 115.9164 53.0073 39.9357 174.5201 80 E 4.5823 7.9978 118.5393 56.4141 30.7923 176.1961 81 Q 4.4272 9.0890 121.5373 54.1835 32.2467 174.3050 82 F 5.6081 8.6457 123.0405 56.0327 40.9360 175.3615 83 I 4.6705 8.9015 124.8065 59.3586 41.0175 175.4794 84 S 4.5669 8.7497 122.6744 58.2774 64.1832 173.3846 85 A 4.5831 8.5859 125.8367 52.1747 18.2347 177.8508 86 S 4.5376 8.8964 117.4116 60.1127 64.4569 174.4089 87 K 4.6654 7.4711 117.0549 55.9910 35.4588 174.8379 88 S 5.2732 8.6526 116.0650 57.0671 67.1802 174.0617 89 I 4.5843 9.0875 123.0819 59.7621 40.5184 174.7282 90 V 4.1922 8.4454 127.5460 62.0499 32.6975 175.1622 91 H 3.6725 8.7067 127.0966 56.0274 29.9364 174.4133 92 P 4.2970 0.0000 0.0000 65.3060 31.2456 177.0755 93 S 4.6065 7.7762 112.2709 57.8802 63.3568 173.3511 94 Y 4.3520 7.8795 123.6337 58.0177 38.9251 174.5072 95 N 4.5868 8.5834 125.9728 51.4653 39.9454 175.0694 96 S 3.7666 7.7426 120.0870 59.4810 63.7035 175.2545 97 N 4.3806 8.3531 119.4645 55.4300 38.3889 175.9038 98 T 4.1049 7.6117 104.6862 60.1881 70.2116 174.0497 99 L 3.7845 7.8583 121.0487 55.6127 39.9382 173.9661 100 N 4.4263 7.9151 116.9530 54.6758 39.8650 174.2615 101 N 4.8364 8.6985 120.9737 54.0417 35.6835 175.9839 102 D 4.6367 7.5549 119.0735 52.7392 40.5122 174.6634 103 I 4.9266 7.1228 121.0992 59.4638 42.1954 172.8156 104 M 5.4916 9.3882 124.7023 54.1915 35.2806 173.2789 105 L 5.4781 9.2054 119.3578 53.1550 45.4451 175.6817 106 I 5.0320 9.0957 123.1445 59.4814 40.6953 174.2216 107 K 3.9671 8.5206 128.5718 54.3774 33.8724 175.3577 108 L 4.4898 8.0099 127.6761 54.2317 41.7464 177.3692 109 K 4.1689 9.1752 125.5461 58.7348 32.7085 177.1899 110 S 4.6246 7.7414 111.9963 55.5874 66.0268 173.2969 111 A 4.3075 8.5131 124.0634 52.1706 18.5664 177.3948 112 A 4.1238 8.8904 124.8290 51.9178 19.5690 177.4512 113 S 4.4467 8.9911 116.1643 57.1489 62.5933 174.0317 114 L 4.5147 8.4688 128.0083 54.5605 42.3998 176.2384 115 N 4.7727 8.4844 118.2248 52.3024 40.0024 175.1132 116 S 4.1576 8.7531 111.9450 60.9369 63.0234 174.9796 117 R 4.3437 8.7071 118.2993 55.8627 31.0882 176.2034 118 V 4.3852 7.8321 117.3297 60.8659 32.8278 173.5452 119 A 5.2160 8.6444 128.3593 50.1257 22.8450 175.3183 120 S 5.0202 8.7585 114.7450 57.9101 64.8217 173.0221 121 I 4.4271 8.2409 121.3340 59.1586 39.7915 175.4784 122 S 4.4243 8.3840 124.3092 58.2869 64.0529 173.9373 123 L 4.3480 8.3448 122.9610 53.5672 42.3756 175.4210 124 P 4.4104 0.0000 0.0000 63.0691 31.7723 176.8053 125 T 4.1487 8.1984 110.2894 62.3242 69.6181 174.5514 *127 S 4.2079 7.6220 116.0003 58.0514 63.9625 173.6462 128 C 4.4597 8.4477 118.3151 56.7920 40.7377 172.6929 129 A 4.7359 7.9527 123.2465 50.5283 21.2186 176.1078 130 S 4.4577 8.0128 113.2786 56.6570 65.0854 173.3358 *132 A 4.2041 8.2380 123.8859 53.4848 19.2416 177.3910 133 G 3.9802 8.9867 111.0389 45.3760 0.0000 174.2129 134 T 4.0374 7.6878 117.4715 63.7121 69.5390 173.6480 135 Q 4.6142 8.5630 124.7977 55.6026 29.9947 175.7985 136 C 5.2595 9.2536 120.1018 55.0704 45.3612 172.3927 137 L 5.1910 9.0901 122.8098 53.5818 43.8234 175.0664 138 I 5.2303 9.1282 127.3510 58.8316 40.1087 174.8336 139 S 4.8629 8.4788 119.1369 56.4366 66.3503 173.1762 140 G 3.8040 7.4364 109.1549 46.2718 0.0000 172.8506 141 W 4.5498 8.5609 116.9480 56.2457 29.2502 177.0018 142 G 4.0802 8.4964 109.6122 44.2544 0.0000 173.3032 143 N 3.6542 7.9025 117.8204 54.3187 38.8823 174.5594 144 T 5.0185 8.5367 115.7574 61.1190 69.6080 174.8170 145 K 4.5909 7.6658 123.6505 52.8123 34.1421 181.2084 146 S 4.2778 8.8274 118.4561 60.0483 62.5490 174.0917 147 S 4.4298 7.9094 115.5994 59.6517 63.5070 171.0181 148 G 3.7800 8.5274 114.0635 44.2022 0.0000 171.2746 149 T 4.7903 8.2290 114.6337 61.8659 72.0870 174.1418 150 S 4.5176 9.8768 121.6944 57.4699 65.8974 172.0114 151 Y 4.9036 8.7970 125.5544 55.8310 39.2037 174.1920 152 P 4.7117 0.0000 0.0000 62.5797 32.9378 175.3149 153 D 4.8615 8.6161 117.3776 55.1189 42.6826 176.9654 154 V 5.1147 7.7160 110.3333 58.6094 34.1333 175.7085 155 L 3.1361 8.4169 124.8380 55.0403 42.9888 175.9971 156 K 4.9053 8.1903 125.1340 54.8711 35.1905 174.5908 157 C 5.3095 8.5063 119.6666 55.1961 42.1436 172.9254 158 L 5.0227 8.6153 122.3682 53.8676 45.5992 174.4988 159 K 5.1217 8.9876 125.4850 55.4606 33.4641 175.9449 160 A 4.6877 8.9283 125.8821 50.0165 23.2072 173.6484 161 P 4.9924 0.0000 0.0000 61.7495 33.8886 175.3957 162 I 4.1961 8.7766 122.9525 61.7164 37.9594 175.7686 163 L 4.9052 8.6919 127.2246 52.8998 43.6773 176.8499 164 S 4.2883 8.4747 115.0537 58.4454 63.6963 175.3376 165 D 4.4426 8.7501 122.5365 57.3756 40.4363 179.3331 166 S 4.1416 8.0382 114.9479 61.4680 63.0571 176.5449 167 S 4.0912 8.1853 118.1610 61.0234 62.1065 175.7195 168 C 4.2930 8.3262 122.0867 59.6639 41.7579 175.8599 169 K 3.9997 8.8094 120.2738 59.2608 31.3507 179.4131 170 S 4.2036 8.2062 113.1070 61.1647 62.3526 175.7184 171 A 3.9728 7.6640 122.7039 53.9125 19.6505 177.3027 172 Y 4.8903 7.5281 112.8059 55.4600 38.4528 173.0736 173 P 4.6214 0.0000 0.0000 63.6528 32.1461 177.5313 174 G 4.0279 9.2076 111.4982 45.6062 0.0000 173.2833 175 Q 4.5388 8.1514 116.7383 55.5335 30.5395 175.5609 176 I 4.4300 7.8564 119.3824 60.0713 38.6596 175.2055 177 T 4.6386 8.2006 114.8964 59.4427 71.1261 175.1086 178 S 4.3279 8.5385 115.0934 60.4990 63.1503 174.4553 179 N 4.9302 7.9486 117.5273 53.5099 38.4768 173.9347 180 M 5.6084 7.9453 117.0775 53.7920 36.3053 174.5505 181 F 5.1009 8.6706 114.6090 55.8949 42.0401 172.5994 182 C 5.8253 9.2200 116.5993 55.2697 39.9063 172.5593 183 A 5.0544 9.0285 122.0364 50.5025 22.3403 173.9716 184 G 4.1325 7.0406 107.0879 44.3880 0.0000 174.7458 184A Y 4.6843 8.4408 122.3109 56.2529 41.4220 176.0286 185 L 4.1462 8.8379 127.5155 57.8165 42.0951 179.6756 186 E 3.7101 8.1904 113.7975 56.9513 29.9313 182.4850 187 G 3.8819 7.5553 103.7676 45.4152 0.0000 172.0177 188 G 4.1020 9.5028 105.4044 44.7412 0.0000 173.6699 188A K 5.0184 7.2633 117.2956 54.9246 35.6524 175.3579 189 D 4.5943 8.7978 123.3722 53.9268 45.7608 175.0657 190 S 4.8639 8.1406 114.7662 58.0674 65.1875 171.6186 191 C 4.7278 9.0465 118.4997 55.5394 47.2809 172.3267 192 Q 4.2128 8.5174 119.2612 58.0964 28.4405 178.6316 193 G 4.3065 9.3042 110.9329 45.6476 0.0000 173.8021 194 D 4.6915 8.4365 118.5309 54.9521 41.6799 176.5730 195 S 4.4100 8.0826 115.6739 60.5670 63.2494 175.5999 196 G 4.2021 8.8209 112.7105 46.3459 0.0000 173.6297 197 G 4.1992 7.7892 107.5060 44.9499 0.0000 171.2390 198 P 5.0595 0.0000 0.0000 62.3324 33.4334 175.5216 199 V 4.5435 8.7629 122.1701 61.4146 33.8353 174.1944 200 V 4.8076 8.7793 129.1526 61.2856 34.0035 173.6263 201 C 5.0240 8.6936 124.8984 55.4755 43.6560 174.6432 202 S 3.5511 9.6876 120.7108 59.7635 59.9712 173.2292 203 G 3.9035 8.4686 104.5883 45.7372 0.0000 173.9756 204 K 4.6833 7.5213 117.9373 53.1081 34.9757 175.5356 *209 L 4.3040 8.2239 122.6496 55.4865 41.9628 175.8571 210 Q 4.5459 8.8478 125.5854 56.3034 30.8601 175.7326 211 G 5.2844 7.9825 104.7872 45.8281 0.0000 171.4807 212 I 5.2167 8.2277 119.8449 58.8288 41.1399 175.1907 213 V 3.7343 8.9396 127.2480 64.0993 31.7855 174.0999 214 S 4.8876 8.6499 120.8756 58.6259 64.4865 174.7482 215 W 5.0363 7.7078 114.7620 56.4061 31.7405 172.8067 216 G 3.9672 8.4428 108.1408 46.6948 0.0000 172.2701 217 S 4.6860 8.5057 115.4612 56.7486 63.0166 172.9931 *219 G 4.2696 8.0917 117.5034 45.8070 0.0000 171.3018 220 C 4.8739 8.1458 115.7277 56.5308 45.0258 174.0116 221 A 3.8616 9.2291 126.1706 53.2195 16.4956 177.1622 221A Q 4.4853 7.3083 116.0936 56.2173 29.7063 175.8969 222 K 4.2266 8.4848 122.2678 58.0163 32.6598 176.0587 223 N 4.2739 9.3616 122.5313 54.2412 36.9172 175.3297 224 K 4.2984 7.5844 115.5864 53.8317 32.5596 174.0773 225 P 4.6077 0.0000 0.0000 62.0031 33.1196 177.2733 226 G 3.5555 8.4776 107.3531 46.0707 0.0000 172.6968 227 V 4.2968 7.8379 122.3336 60.6800 33.7893 174.1599 228 Y 4.9747 8.1768 124.6658 55.9555 41.9383 175.0885 229 T 4.4299 8.6834 120.0195 63.7188 70.0249 174.3367 230 K 5.0203 9.2795 128.2327 55.3596 31.0269 177.2677 231 V 3.9989 8.9962 125.7679 65.5790 31.4529 174.7883 232 C 4.3751 8.2607 112.7094 58.1183 41.6268 174.9342 233 N 4.1512 8.0581 117.7299 54.8451 38.4089 175.0924 234 Y 4.7545 7.8473 117.2003 57.6208 39.1103 177.6499 235 V 3.7133 7.9331 121.4888 66.2418 31.5219 178.0958 236 S 4.1716 8.0739 114.4942 61.2050 62.7069 176.2301 237 W 4.1980 8.2965 130.6513 60.4547 30.4663 177.9293 238 I 3.0654 8.5310 120.0086 64.1885 36.6745 178.5217 239 K 3.7529 8.2560 119.5982 59.6692 31.6605 179.5330 240 Q 3.9242 8.0606 117.4382 58.9505 28.9836 178.6350 241 T 3.7052 7.6519 117.1475 66.4387 68.3965 176.6975 242 I 2.2673 7.0934 121.6440 64.0623 36.8339 178.3649 243 A 4.0783 7.4694 119.2697 54.0308 18.2165 178.7163 244 S 4.6654 7.3695 111.2494 58.3323 63.4784 173.9992 245 N 4.6943 7.9691 124.8757 53.5651 39.4686 174.0928 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 1.78 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.87 0.90 0.00 0.00 17 V 8.83 4.38 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 0.99 0.00 0.00 0.97 0.00 0.00 18 G 8.58 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 0.00 0.00 0.00 0.00 19 G 7.64 4.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 Y 7.84 4.95 0.00 2.98 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 8.69 4.18 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 1.25 0.00 0.00 22 C 8.63 4.19 0.00 2.73 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 23 G 8.50 4.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 A 8.50 4.16 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 8.89 4.25 0.00 2.86 2.91 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 7.53 4.20 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 27 V 7.03 4.08 1.74 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 0.31 0.00 0.00 0.74 0.00 0.00 28 P 0.00 4.46 0.00 2.37 2.40 0.00 3.63 0.00 0.00 3.88 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 6.96 5.17 0.00 3.18 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 7.44 4.56 0.00 1.77 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.74 0.00 0.00 0.00 0.00 0.00 1.88 2.47 0.00 31 V 9.04 4.84 2.23 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 0.88 0.00 0.00 1.01 0.00 0.00 32 S 8.78 4.87 0.00 3.08 3.34 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 33 L 8.62 4.69 0.00 0.27 0.95 0.75 0.29 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 34 N 9.18 6.02 0.00 2.46 2.39 0.00 0.00 6.78 7.30 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 *37 S 8.51 4.28 0.00 3.63 3.56 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 38 G 9.24 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 0.00 0.00 0.00 39 Y 6.72 4.56 0.00 3.04 2.99 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 40 H 8.95 4.60 0.00 2.88 3.17 0.00 5.86 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 F 8.16 5.06 0.00 3.08 3.19 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 42 C 6.95 4.78 0.00 2.11 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 43 G 9.17 4.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 G 8.08 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 45 S 8.91 5.39 0.00 3.82 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 46 L 9.32 4.73 0.00 1.86 1.81 1.08 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 47 I 8.65 4.47 1.90 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 1.53 1.00 1.02 0.00 0.00 48 N 7.54 4.65 0.00 2.98 3.00 0.00 0.00 6.02 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 49 S 8.60 4.34 0.00 4.25 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 8.93 4.52 0.00 2.12 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.87 6.79 0.00 0.00 0.00 0.00 0.00 2.24 2.33 0.00 51 W 8.27 5.51 0.00 3.28 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 52 V 9.21 4.96 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 1.16 0.00 0.00 0.98 0.00 0.00 53 V 8.91 4.85 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 1.03 0.00 0.00 1.01 0.00 0.00 54 S 8.90 5.27 0.00 3.92 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 A 8.68 4.64 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 56 A 8.26 3.81 0.14 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 0.00 0.00 57 H 8.28 4.55 0.00 3.40 3.59 0.00 5.55 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 C 7.87 4.66 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 7.68 4.33 0.00 2.89 3.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 60 K 7.37 3.19 0.00 1.40 1.29 0.00 0.66 0.00 0.00 1.23 0.00 0.00 2.13 0.00 0.00 2.21 0.00 0.00 0.00 0.00 0.62 0.91 7.81 61 S 7.92 4.43 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 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 7.56 4.23 1.90 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 1.32 0.67 0.98 0.00 0.00 64 Q 8.83 4.86 0.00 2.03 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.88 0.00 0.00 0.00 0.00 0.00 2.16 2.24 0.00 65 V 8.94 4.32 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 0.99 0.00 0.00 0.91 0.00 0.00 66 R 8.98 5.14 0.00 1.68 1.78 0.00 2.65 0.00 0.00 2.48 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 1.27 0.00 67 L 9.16 4.75 0.00 1.64 1.64 1.03 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 *69 G 8.23 4.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 70 E 8.14 4.54 0.00 2.19 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.44 2.08 0.00 71 D 8.14 5.03 0.00 2.74 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 8.38 5.08 0.00 2.81 2.87 0.00 0.00 7.21 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 73 I 8.36 4.13 1.37 0.00 0.00 0.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 1.00 -0.57 0.00 0.00 74 N 9.09 4.78 0.00 2.95 2.87 0.00 0.00 6.62 7.77 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 75 V 7.46 4.31 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 0.78 0.00 0.00 0.97 0.00 0.00 76 V 8.47 4.15 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 0.84 0.00 0.00 1.03 0.00 0.00 77 E 9.50 4.39 0.00 1.96 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 2.47 0.00 78 G 8.42 4.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 N 8.08 4.89 0.00 2.65 2.81 0.00 0.00 7.15 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 8.00 4.58 0.00 1.44 1.55 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 2.53 2.48 0.00 81 Q 9.09 4.43 0.00 1.94 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.77 0.00 0.00 0.00 0.00 0.00 2.21 2.25 0.00 82 F 8.65 5.61 0.00 2.82 2.81 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 83 I 8.90 4.67 1.88 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 0.70 0.94 0.00 0.00 84 S 8.75 4.57 0.00 3.76 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 85 A 8.59 4.58 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 86 S 8.90 4.54 0.00 3.78 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 87 K 7.47 4.67 0.00 1.85 1.90 0.00 1.56 0.00 0.00 1.91 0.00 0.00 2.81 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.24 1.44 7.81 88 S 8.65 5.27 0.00 3.95 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 89 I 9.09 4.58 2.03 0.00 0.00 1.00 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 0.95 1.11 0.00 0.00 90 V 8.45 4.19 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 0.69 0.00 0.00 0.78 0.00 0.00 91 H 8.71 3.67 0.00 2.85 3.06 0.00 5.65 0.00 0.00 0.00 0.00 6.66 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 4.30 0.00 2.17 2.18 0.00 2.51 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 1.64 1.90 0.00 93 S 7.78 4.61 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 94 Y 7.88 4.35 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 95 N 8.58 4.59 0.00 2.58 2.47 0.00 0.00 6.59 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 96 S 7.74 3.77 0.00 3.95 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 97 N 8.35 4.38 0.00 2.82 2.79 0.00 0.00 6.79 8.30 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 98 T 7.61 4.10 4.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 99 L 7.86 3.78 0.00 1.62 1.91 0.93 1.34 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 0.00 100 N 7.92 4.43 0.00 2.79 2.67 0.00 0.00 7.09 6.71 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 0.00 101 N 8.70 4.84 0.00 2.98 2.68 0.00 0.00 7.22 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 7.55 4.64 0.00 3.23 2.64 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 0.00 103 I 7.12 4.93 1.48 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.26 -0.03 0.00 0.00 104 M 9.39 5.49 0.00 2.05 2.31 0.00 0.00 0.00 0.00 0.00 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.68 0.00 105 L 9.21 5.48 0.00 1.71 1.91 0.06 1.00 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 0.00 106 I 9.10 5.03 1.93 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 1.22 0.93 0.90 0.00 0.00 107 K 8.52 3.97 0.00 0.79 1.06 0.00 1.24 0.00 0.00 1.32 0.00 0.00 2.64 0.00 0.00 2.73 0.00 0.00 0.00 0.00 0.68 0.21 7.81 108 L 8.01 4.49 0.00 1.49 1.58 0.93 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 109 K 9.18 4.17 0.00 1.92 1.80 0.00 1.71 0.00 0.00 1.73 0.00 0.00 2.93 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.41 1.34 7.81 110 S 7.74 4.62 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 8.51 4.31 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 0.00 112 A 8.89 4.12 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 0.00 113 S 8.99 4.45 0.00 3.88 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 0.00 114 L 8.47 4.51 0.00 1.70 1.68 0.96 1.13 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 0.00 115 N 8.48 4.77 0.00 2.92 2.92 0.00 0.00 6.67 7.77 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 0.00 116 S 8.75 4.16 0.00 4.01 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 8.71 4.34 0.00 1.89 2.01 0.00 3.18 0.00 0.00 3.31 7.31 0.00 0.00 0.00 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1.20 0.00 0.00 *127 S 7.62 4.21 0.00 4.00 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 0.00 128 C 8.45 4.46 0.00 2.93 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 7.95 4.74 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 8.01 4.46 0.00 3.97 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 8.24 4.20 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 133 G 8.99 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 0.00 134 T 7.69 4.04 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 1.16 0.00 0.00 135 Q 8.56 4.61 0.00 1.93 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.69 6.81 0.00 0.00 0.00 0.00 0.00 2.32 2.34 0.00 136 C 9.25 5.26 0.00 2.85 2.99 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 0.00 137 L 9.09 5.19 0.00 1.76 1.57 1.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 138 I 9.13 5.23 1.86 0.00 0.00 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.71 1.50 0.93 0.00 0.00 139 S 8.48 4.86 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 7.44 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 8.56 4.55 0.00 3.21 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 0.00 142 G 8.50 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 0.00 0.00 0.00 143 N 7.90 3.65 0.00 2.05 2.53 0.00 0.00 7.10 6.99 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 0.00 144 T 8.54 5.02 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 1.23 0.00 0.00 145 K 7.67 4.59 0.00 1.77 1.60 0.00 1.81 0.00 0.00 1.63 0.00 0.00 2.91 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.26 0.96 7.81 146 S 8.83 4.28 0.00 3.82 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 0.00 147 S 7.91 4.43 0.00 3.82 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 148 G 8.53 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 0.00 149 T 8.23 4.79 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 1.46 0.00 0.00 150 S 9.88 4.52 0.00 3.81 3.63 0.00 0.00 0.00 0.00 0.00 0.00 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 8.80 4.90 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 0.00 152 P 0.00 4.71 0.00 2.44 2.08 0.00 4.11 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 2.14 2.01 0.00 153 D 8.62 4.86 0.00 2.76 2.99 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 0.00 154 V 7.72 5.11 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.00 0.00 0.97 0.00 0.00 155 L 8.42 3.14 0.00 1.30 1.23 -0.74 0.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 156 K 8.19 4.91 0.00 1.65 1.49 0.00 1.56 0.00 0.00 1.61 0.00 0.00 2.76 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.38 1.46 7.81 157 C 8.51 5.31 0.00 1.50 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 0.00 158 L 8.62 5.02 0.00 1.70 1.45 1.04 1.13 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 0.00 159 K 8.99 5.12 0.00 1.82 1.82 0.00 1.90 0.00 0.00 1.82 0.00 0.00 2.79 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.62 1.48 7.81 160 A 8.93 4.69 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 161 P 0.00 4.99 0.00 2.02 2.08 0.00 3.09 0.00 0.00 3.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.72 0.00 162 I 8.78 4.20 1.94 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 1.14 0.60 0.81 0.00 0.00 163 L 8.69 4.91 0.00 1.56 1.60 0.93 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 164 S 8.47 4.29 0.00 4.01 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 0.00 165 D 8.75 4.44 0.00 2.82 2.81 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 0.00 166 S 8.04 4.14 0.00 4.06 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 0.00 167 S 8.19 4.09 0.00 4.09 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 0.00 168 C 8.33 4.29 0.00 3.20 3.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 169 K 8.81 4.00 0.00 1.89 1.90 0.00 1.76 0.00 0.00 1.62 0.00 0.00 2.95 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.54 1.60 7.81 170 S 8.21 4.20 0.00 3.92 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 0.00 171 A 7.66 3.97 0.99 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 0.00 0.00 172 Y 7.53 4.89 0.00 3.12 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 0.00 173 P 0.00 4.62 0.00 2.08 2.06 0.00 3.83 0.00 0.00 4.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.19 0.00 174 G 9.21 4.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175 Q 8.15 4.54 0.00 2.37 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.90 6.62 0.00 0.00 0.00 0.00 0.00 2.30 2.58 0.00 176 I 7.86 4.43 1.98 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.92 1.00 0.00 0.00 177 T 8.20 4.64 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 1.29 0.00 0.00 178 S 8.54 4.33 0.00 4.01 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 0.00 179 N 7.95 4.93 0.00 3.15 3.11 0.00 0.00 6.60 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 7.95 5.61 0.00 1.88 1.99 0.00 0.00 0.00 0.00 0.00 2.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.66 2.62 0.00 181 F 8.67 5.10 0.00 3.05 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 0.00 182 C 9.22 5.83 0.00 2.97 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 0.00 183 A 9.03 5.05 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 184 G 7.04 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 0.00 0.00 0.00 184A Y 8.44 4.68 0.00 2.95 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 0.00 185 L 8.84 4.15 0.00 1.74 1.73 0.92 1.00 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 0.00 186 E 8.19 3.71 0.00 1.99 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 2.23 1.88 0.00 187 G 7.56 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 9.50 4.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 188A K 7.26 5.02 0.00 1.47 1.73 0.00 1.15 0.00 0.00 1.50 0.00 0.00 2.57 0.00 0.00 2.74 0.00 0.00 0.00 0.00 1.42 1.23 7.81 189 D 8.80 4.59 0.00 2.78 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 8.14 4.86 0.00 4.07 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 191 C 9.05 4.73 0.00 2.94 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 0.00 192 Q 8.52 4.21 0.00 2.26 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 5.16 0.00 0.00 0.00 0.00 0.00 2.53 2.43 0.00 193 G 9.30 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 0.00 194 D 8.44 4.69 0.00 2.92 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 0.00 195 S 8.08 4.41 0.00 3.99 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 196 G 8.82 4.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 197 G 7.79 4.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 198 P 0.00 5.06 0.00 2.35 2.38 0.00 3.91 0.00 0.00 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 2.20 0.00 199 V 8.76 4.54 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 0.82 0.00 0.00 0.51 0.00 0.00 200 V 8.78 4.81 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.87 0.00 0.00 0.61 0.00 0.00 201 C 8.69 5.02 0.00 2.80 2.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 202 S 9.69 3.55 0.00 3.96 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 0.00 203 G 8.47 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 204 K 7.52 4.68 0.00 1.72 1.64 0.00 1.86 0.00 0.00 1.63 0.00 0.00 2.86 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.47 1.39 7.81 *209 L 8.22 4.30 0.00 1.51 1.65 1.02 0.75 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 0.00 210 Q 8.85 4.55 0.00 1.96 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.58 6.39 0.00 0.00 0.00 0.00 0.00 2.40 2.33 0.00 211 G 7.98 5.28 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 0.00 212 I 8.23 5.22 1.93 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 1.30 0.77 1.00 0.00 0.00 213 V 8.94 3.73 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.00 0.00 1.16 0.00 0.00 214 S 8.65 4.89 0.00 4.03 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 215 W 7.71 5.04 0.00 3.34 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 0.00 216 G 8.44 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 0.00 217 S 8.51 4.69 0.00 4.26 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 *219 G 8.09 4.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 220 C 8.15 4.87 0.00 2.94 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 0.00 221 A 9.23 3.86 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 7.31 4.49 0.00 2.11 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.96 6.93 0.00 0.00 0.00 0.00 0.00 2.39 2.46 0.00 222 K 8.48 4.23 0.00 1.72 1.71 0.00 1.93 0.00 0.00 1.70 0.00 0.00 2.99 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.49 1.61 7.81 223 N 9.36 4.27 0.00 2.80 2.79 0.00 0.00 6.78 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 0.00 224 K 7.58 4.30 0.00 1.67 1.75 0.00 1.64 0.00 0.00 1.19 0.00 0.00 2.89 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.38 1.47 7.81 225 P 0.00 4.61 0.00 2.11 2.10 0.00 3.62 0.00 0.00 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 1.99 0.00 226 G 8.48 3.56 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 0.00 227 V 7.84 4.30 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 0.27 0.00 0.00 -0.76 0.00 0.00 228 Y 8.18 4.97 0.00 1.43 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 229 T 8.68 4.43 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 1.17 0.00 0.00 230 K 9.28 5.02 0.00 2.15 1.95 0.00 1.83 0.00 0.00 1.92 0.00 0.00 2.90 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.51 1.58 7.81 231 V 9.00 4.00 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 1.06 0.00 0.00 232 C 8.26 4.38 0.00 3.16 3.38 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 0.00 233 N 8.06 4.15 0.00 2.34 2.37 0.00 0.00 6.83 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 0.00 234 Y 7.85 4.75 0.00 3.28 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 0.00 235 V 7.93 3.71 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 1.06 0.00 0.00 236 S 8.07 4.17 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 0.00 237 W 8.30 4.20 0.00 3.50 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 238 I 8.53 3.07 1.98 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 1.60 1.09 0.74 0.00 0.00 239 K 8.26 3.75 0.00 1.78 1.78 0.00 1.64 0.00 0.00 1.61 0.00 0.00 2.92 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.38 1.54 7.81 240 Q 8.06 3.92 0.00 1.93 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.96 0.00 0.00 0.00 0.00 0.00 2.35 2.63 0.00 241 T 7.65 3.71 3.29 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 0.76 0.00 0.00 242 I 7.09 2.27 1.37 0.00 0.00 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.06 0.08 0.44 0.00 0.00 243 A 7.47 4.08 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 0.00 244 S 7.37 4.67 0.00 3.87 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 0.00 245 N 7.97 4.69 0.00 2.94 2.98 0.00 0.00 6.75 8.37 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 * Residues marked with a * may have inaccurate shift predictions.