NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 20 R 4.2673 8.2549 120.8564 56.1043 32.1206 175.1996 21 I 3.8904 7.7615 119.0269 60.5256 38.9516 174.4675 22 K 4.3188 9.1977 127.6812 55.9215 33.9041 175.7851 23 K 4.3984 8.8891 125.3879 54.8953 33.5877 175.2093 24 I 4.6610 7.4762 126.3475 59.5687 39.4781 174.8789 25 S 5.1269 8.8196 121.2605 56.9519 64.6591 173.0607 26 I 4.7837 9.1961 128.8167 60.0913 37.6097 174.5829 27 E 4.6041 8.9743 127.0967 55.6447 31.3576 176.0155 28 G 4.2506 8.3346 108.3252 46.7728 0.0000 171.5742 29 N 4.8821 8.5648 117.8272 52.5750 41.3717 173.5084 30 I 4.1239 8.8522 118.2247 62.3932 37.8101 175.9096 31 A 3.8468 8.9959 125.5367 53.0875 16.3446 178.2660 32 A 4.1199 7.7427 122.4707 57.7009 18.5758 178.6211 33 G 3.5453 8.5848 105.3017 45.5583 0.0000 175.4576 34 K 4.0402 8.0625 120.9489 59.3974 31.7963 178.6565 35 S 4.1958 8.2353 113.2768 62.4853 62.7942 176.8572 36 T 3.9144 7.9669 118.5253 67.0420 68.7316 175.8585 37 F 4.5835 8.8521 122.5475 61.5247 39.4912 177.6381 38 V 3.2835 8.7743 119.6937 64.7275 31.1630 177.9665 39 N 3.8838 8.4917 117.5588 56.0469 38.0446 177.4276 40 I 3.6455 7.1603 120.7648 63.9931 37.2442 178.1560 41 L 4.0648 7.1954 119.3200 57.6533 41.2959 178.8942 42 K 3.8952 8.2105 119.5517 58.9899 33.0054 177.8554 43 Q 4.6161 7.3568 116.2575 55.1769 26.8477 175.5845 44 L 4.5689 7.6764 115.7947 54.3226 44.0380 174.8236 45 C 5.1023 7.1212 122.3644 59.5538 33.3919 173.2472 46 E 4.4843 8.5338 125.8344 56.9987 29.1990 176.2749 47 D 5.0543 7.8774 115.8313 53.6268 43.0928 175.2444 48 W 5.5622 8.3583 118.7058 55.2678 31.4094 174.2859 49 E 4.8926 9.2494 126.2852 54.3232 32.1477 174.8342 50 V 4.9709 8.4693 124.3684 61.4430 34.3006 175.5998 51 V 4.4324 8.7248 125.5775 59.5725 31.3689 172.7480 52 P 4.7030 0.0000 0.0000 61.9076 32.6305 175.5229 53 E 3.9235 8.8020 123.1684 55.4950 30.3999 177.1600 54 P 4.3598 0.0000 0.0000 61.6780 30.9626 178.8070 55 V 2.6971 7.5865 122.3526 65.7544 30.8413 176.5950 56 A 3.9090 7.7238 120.7563 55.3229 18.1816 179.4677 57 R 3.9975 7.6243 115.5665 58.6445 30.1007 178.2957 58 W 4.7970 8.0939 118.4706 58.9225 28.8279 177.0062 59 C 5.6473 7.3668 114.5818 58.7250 28.1647 173.9120 60 N 4.7419 7.6156 113.1464 52.6247 40.7444 173.6837 61 V 3.6887 8.3548 113.0950 61.8742 32.3532 176.0755 62 Q 4.5723 8.2036 122.1770 54.9679 32.7373 174.5585 63 S 4.1743 8.4320 113.7082 60.8104 63.1668 174.5098 *77 N 4.3909 8.0150 117.0507 52.7813 39.0576 174.6426 78 G 3.9175 8.6299 111.3943 45.3482 0.0000 172.8497 79 G 3.7625 8.5377 106.1723 46.1901 0.0000 172.7406 80 N 5.5745 8.3235 120.6665 51.0587 38.0363 175.2039 81 V 3.5062 8.0693 123.7490 63.9299 31.4004 178.1832 82 L 3.8979 7.9479 121.0592 58.2576 41.9432 178.6408 83 Q 4.0804 8.0109 119.0933 59.4556 28.9274 177.9678 84 M 3.8702 7.8112 119.2758 58.5459 31.7366 178.2283 85 M 4.0958 7.7470 117.7214 58.9086 32.1295 177.9623 86 Y 4.3313 7.2444 115.8626 61.0803 38.0766 177.9973 87 E 4.3145 8.4588 119.1057 58.0287 31.1908 177.5831 88 K 4.7064 8.3403 120.1119 53.3011 32.7386 174.1149 89 P 4.4714 0.0000 0.0000 64.7121 31.4444 179.1286 90 E 4.3053 8.2155 113.4872 57.0759 29.4361 176.8592 91 R 4.1687 7.9044 118.9371 56.3370 32.2711 176.4280 92 W 4.8505 7.8332 114.5951 56.1738 30.1705 177.4891 93 S 4.1746 8.0758 116.7666 62.1566 62.3071 175.7844 94 F 4.1849 8.4744 122.3052 61.6898 38.9558 176.6079 95 T 3.7075 8.1839 114.2542 67.0878 68.3798 175.5627 96 F 3.7259 8.8077 122.2282 61.5946 39.2692 176.6920 97 Q 3.7759 8.8852 119.1805 59.7510 28.7006 179.2893 98 T 3.5954 7.7962 116.5614 66.5791 68.4112 176.0419 99 Y 3.9847 7.7766 121.2320 60.7006 38.2668 178.0213 100 A 3.1658 7.9113 122.1901 55.0994 18.1705 179.2317 101 C 4.1469 7.7824 117.2537 62.2586 31.5801 175.3618 102 L 4.0463 8.1119 122.3252 58.3654 41.7888 178.9146 103 S 3.8965 8.0250 114.3161 61.5326 62.3990 176.7268 104 R 3.7329 7.5815 121.2484 59.3138 29.8930 178.1037 105 I 3.4824 7.6874 119.7409 64.7301 37.0937 178.2940 106 R 3.7090 8.1025 118.4339 59.1027 30.0507 178.6101 107 A 3.9255 7.8526 120.2315 55.6239 18.3193 179.8496 108 Q 3.6108 8.1872 116.3386 59.0065 28.6598 178.5411 109 L 3.9807 7.8103 118.6271 57.7151 41.8238 179.2182 110 A 4.1125 8.4473 120.8436 55.5443 18.4327 179.9360 111 S 4.1207 7.9688 112.8188 61.4748 62.6645 176.6033 112 L 4.3203 7.6327 119.8000 56.3438 41.3307 177.2560 113 N 4.8555 7.9656 115.4798 52.6779 39.1289 174.9659 114 G 3.8934 7.8783 109.3832 44.7019 0.0000 175.0760 115 K 4.1142 8.5144 117.4997 58.2045 32.9248 178.7533 116 L 4.0063 7.8539 122.3640 57.8748 42.2519 178.2260 117 K 4.0482 8.1577 119.2452 58.6091 32.3623 176.9344 118 D 4.4930 7.8376 117.1318 56.4525 41.5090 176.6846 119 A 4.0234 7.1661 119.3750 51.6500 18.2041 176.3441 120 E 4.0032 7.5101 117.8311 56.9670 30.0471 177.7051 121 K 4.3820 7.5855 130.7968 53.0796 32.0287 173.6017 122 P 5.0857 0.0000 0.0000 61.8793 33.7633 175.3300 123 V 4.4250 9.1255 121.4227 61.2574 35.4981 173.3932 124 L 4.9564 8.6892 130.2459 53.3873 44.3323 174.8603 125 F 4.9501 9.1230 126.4830 56.7020 40.6885 174.9587 126 F 5.2947 9.1759 123.3414 56.2301 40.9717 175.0534 127 E 4.6730 8.7977 125.3848 55.8462 28.8192 174.7662 128 R 4.5838 8.7967 127.1933 56.1765 30.9051 176.6862 129 S 4.9589 8.5850 114.4951 56.2166 67.1708 175.7470 130 V 4.0041 7.9242 116.4108 63.6744 31.0327 178.6029 131 Y 4.1364 7.0230 115.7738 61.1069 37.8151 178.2859 132 S 4.2538 8.2312 114.3427 60.9691 63.1218 175.9853 133 D 4.4739 8.1158 122.6782 57.4815 40.5960 178.6579 134 R 4.2614 7.9694 119.0385 59.8618 30.0620 177.9408 135 Y 4.0307 8.4899 114.9513 59.9012 38.2592 176.8574 136 I 4.1236 7.7399 120.2221 63.4120 38.0974 177.8005 137 F 4.1280 8.2823 117.6165 60.1650 39.1431 177.4577 138 A 3.9332 8.6842 120.5253 55.6162 18.2413 179.0956 139 S 3.3480 8.2760 111.1944 61.9482 62.3977 176.1257 140 N 4.1971 8.0099 118.6256 56.6227 38.5280 176.9162 141 L 4.0444 8.2064 121.0113 57.6037 41.6402 178.7177 142 Y 3.9646 7.8346 119.6231 60.8442 38.4533 178.1519 143 E 3.4883 7.6328 117.6993 58.8521 29.4533 178.5143 144 S 4.4370 7.5435 113.2610 57.5356 62.9886 173.6760 145 E 3.7024 7.6713 119.6583 57.9146 27.2327 174.9565 146 C 4.5540 8.2100 113.7186 59.7559 28.7078 174.1505 147 M 5.2830 7.8805 119.2969 52.0161 34.6502 175.1095 148 N 4.6636 8.9177 122.1541 52.3688 39.5395 175.2100 149 E 4.0692 8.8989 119.8256 60.3857 29.4253 179.6381 150 T 3.8551 8.0284 114.5706 67.0006 68.6819 176.0639 151 E 3.4285 8.2625 119.9138 59.1890 29.5423 179.3886 152 W 4.5364 8.3101 128.2675 60.6585 30.5605 178.2789 153 T 3.6428 8.3532 116.2509 66.5766 67.8631 176.7907 154 I 3.7105 8.0305 122.0876 64.4687 37.0540 177.6611 155 Y 4.3022 8.7116 120.7312 61.0170 38.6287 178.4225 156 Q 3.6326 7.8430 118.5456 58.8987 28.8269 177.8620 157 D 4.3355 8.0784 119.1805 57.3278 41.0842 178.4461 158 W 4.1307 8.5054 128.6016 60.9167 30.8986 177.1850 159 H 3.3249 8.4036 118.3260 59.2928 28.8733 176.7414 160 D 4.3552 8.4257 119.8467 57.2409 41.1182 178.0370 161 W 4.2822 8.1510 128.6553 60.7882 30.4517 177.8770 162 M 3.7236 8.1231 118.8848 58.2533 31.1506 177.6761 163 N 4.9034 7.6548 114.2398 53.4219 38.6042 176.0707 164 N 4.8270 7.5808 117.2238 53.0969 40.2739 175.3667 165 Q 3.9480 7.2837 116.0941 56.0325 30.1518 176.3754 166 F 4.7274 7.7599 113.3939 56.7710 39.9277 176.0688 167 G 3.7154 7.9471 109.6231 47.3566 0.0000 177.9030 168 Q 3.3412 6.8748 115.9449 57.5822 30.2386 179.8483 169 S 4.1501 8.1776 113.7403 61.8384 62.9491 175.8038 170 L 4.6322 8.0655 116.5172 54.4357 41.6628 176.8549 171 E 4.2192 7.6548 119.6314 56.6624 29.7728 177.2018 172 L 4.4922 9.3716 123.7570 55.0599 42.3601 176.5994 173 D 4.8972 8.3676 119.5113 53.8522 42.5089 176.1533 174 G 4.2402 7.3950 104.6193 46.1120 0.0000 172.4109 175 I 5.2000 8.2223 119.9907 59.4845 42.0674 174.6108 176 I 4.4025 9.2502 127.4703 59.6395 39.9664 174.3152 177 Y 4.6587 8.8626 130.8316 56.5448 39.5683 174.8341 178 L 4.3668 8.8028 129.3504 53.6651 41.7070 176.4409 179 Q 3.6543 8.0479 125.9290 55.4136 30.3923 174.4929 180 A 4.7151 8.1819 123.4669 50.9925 22.1801 176.2798 181 T 3.7663 8.4907 112.5467 61.3617 69.2649 173.6880 182 P 4.2854 0.0000 0.0000 65.6269 31.0108 178.7695 183 E 3.9081 8.0147 118.4553 59.7713 29.5711 178.8089 184 T 3.9088 8.1626 116.0318 67.0401 68.5516 176.3415 185 C 4.1729 8.1582 118.3347 62.8397 27.9611 175.8629 186 L 4.0658 7.9563 120.9640 58.3637 41.8404 178.4004 187 H 4.3989 8.4746 118.2865 59.5589 29.8961 177.6385 188 R 3.9218 8.6237 119.9705 59.1178 29.9322 179.1587 189 I 3.7682 8.3455 120.3890 64.2842 36.7769 177.7352 190 Y 4.2151 7.9340 119.9353 60.4792 38.7486 177.2189 191 L 3.8884 7.6721 118.5531 57.8599 41.8472 178.7901 192 R 3.9506 7.9789 118.0950 58.6508 30.1201 177.3327 193 G 3.9141 7.9478 105.2498 44.8898 0.0000 173.3894 194 R 3.9572 7.9873 119.4596 56.2368 30.0752 177.3585 195 N 4.4217 8.8311 121.3177 55.8906 38.9570 176.5454 196 E 4.1526 8.3353 117.5545 59.0979 29.8196 177.4195 197 E 3.9362 7.9139 115.7713 56.2895 29.8017 177.6410 198 Q 4.0686 7.9912 118.4515 57.8576 29.1415 176.7841 199 G 3.7836 7.5397 105.2733 45.2310 0.0000 174.0824 200 I 3.4569 6.7897 121.5954 61.1146 37.4132 174.7846 201 P 4.6758 0.0000 0.0000 61.5739 34.1055 176.7214 202 L 3.9387 8.3455 119.8859 58.2449 41.9411 178.5929 203 E 3.8920 8.2975 118.2590 59.9715 29.3937 178.5589 204 Y 4.0717 8.0731 118.4283 60.9022 38.9487 177.7588 205 L 3.9076 7.9228 119.8927 57.8423 41.7318 179.4850 206 E 3.5231 8.6250 119.3099 59.1156 29.5519 178.7095 207 K 3.7298 7.9015 118.6299 59.7565 32.1171 179.3213 208 L 3.7803 7.5256 118.8540 57.5480 41.2951 178.9712 209 H 4.0458 7.8160 118.3534 59.6151 29.7901 176.7605 210 Y 4.4399 7.6110 118.3765 61.3672 37.5987 178.9650 211 K 3.9554 8.0015 118.9331 59.7243 32.0144 179.1995 212 H 4.2333 8.0871 116.0270 58.8236 28.7592 177.2803 213 E 3.8863 8.3300 120.6330 59.8018 29.3997 179.5513 214 S 4.2092 8.8530 113.1651 60.9138 62.2574 175.9527 215 W 4.3740 7.9139 130.9225 60.1257 30.5414 177.7934 216 L 3.6794 7.7291 116.5145 55.1078 41.4818 177.0575 217 L 4.2818 7.3780 118.9494 57.0747 43.0086 177.0026 218 H 4.4653 8.4448 114.9921 56.2720 29.0328 175.8036 219 R 4.2187 8.0760 116.3032 56.0260 27.5603 176.8754 220 T 4.1911 7.8817 107.1907 62.1581 69.5733 174.2652 221 L 4.3581 7.8098 124.8582 53.9534 42.2542 175.7705 222 K 4.3333 8.6328 126.5224 56.0183 33.1108 176.7238 223 T 4.6397 8.0810 113.6313 60.0764 71.1665 173.6099 224 N 5.0878 8.5977 119.6919 53.9763 39.8706 175.6645 225 F 4.8065 7.8919 113.0949 56.5479 39.8627 176.3502 226 D 4.3704 7.6767 124.9017 57.2465 41.7461 179.3968 227 Y 4.3110 8.2583 116.8782 59.4763 38.0932 178.0110 228 L 3.5061 7.6528 120.2541 56.9130 41.7965 178.1883 229 Q 4.0570 7.7285 119.1187 58.3506 29.0958 176.1325 230 E 4.6342 7.7084 116.6534 56.2049 30.0855 175.7380 231 V 4.3755 7.4467 117.8196 60.1041 33.9082 173.1564 232 P 4.4909 0.0000 0.0000 63.0596 32.5864 175.5592 233 I 4.5647 8.2929 123.4583 59.5516 40.2799 174.2472 234 L 4.1373 7.8611 130.5141 54.3642 43.2923 175.4093 235 T 4.9199 8.3903 122.6587 61.8574 70.7132 173.3334 236 L 4.4650 8.2074 126.8166 52.8683 44.5391 175.7976 237 D 4.7628 8.5292 123.6463 53.2164 40.3451 175.1572 238 V 4.0926 7.9827 117.7559 61.2767 32.0997 178.2053 239 N 4.5183 8.6924 121.6455 56.0712 40.1251 177.2680 240 E 4.0744 8.1940 113.2677 56.5583 28.0982 178.4702 241 D 4.8633 8.7801 128.0034 54.9565 43.0655 174.5278 242 F 5.5863 8.7704 118.1387 56.1216 38.8755 176.8172 243 K 3.8000 7.3588 122.4255 59.6759 31.2494 176.3230 244 D 4.4490 7.2867 116.0628 55.5817 41.9979 176.2488 245 K 4.0281 7.8015 128.1852 56.9425 32.2694 177.2174 246 Y 5.1091 7.7347 121.4192 55.6014 40.9352 176.4843 247 E 4.0047 8.3430 121.6259 60.5246 29.5331 178.2985 248 S 4.0971 8.3182 111.9417 61.3058 62.1515 175.6625 249 L 3.9923 8.0241 120.5328 58.1570 41.6549 179.5726 250 V 3.7357 8.0074 117.6601 66.4401 31.3412 177.7818 251 E 4.0845 8.1704 117.4717 59.5972 29.3079 179.6451 252 K 4.0631 8.1071 117.6878 58.9938 31.9975 179.6604 253 V 3.7893 7.6254 119.0290 65.8072 31.6225 177.9840 254 K 4.1407 8.2909 118.2793 59.8851 31.4055 178.2604 255 E 3.9126 8.6637 119.5278 59.7076 29.2429 178.4732 256 F 4.1550 8.5066 120.2789 61.6503 39.5848 177.1848 257 L 4.0035 8.5860 117.6002 57.5410 41.6495 179.3806 258 S 4.3515 8.0927 115.6835 61.6500 62.5440 176.7314 259 T 4.0477 7.1410 105.4698 62.1625 68.0360 174.2532 260 L 4.1536 7.6428 127.9150 55.2499 41.9374 176.1927 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 20 R 8.25 4.27 0.00 1.76 1.82 0.00 3.24 0.00 0.00 3.22 7.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.72 0.00 21 I 7.76 3.89 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 1.36 0.77 0.91 0.00 0.00 22 K 9.20 4.32 0.00 1.54 1.57 0.00 1.53 0.00 0.00 1.58 0.00 0.00 2.79 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.36 1.36 7.81 23 K 8.89 4.40 0.00 1.48 1.05 0.00 1.67 0.00 0.00 1.68 0.00 0.00 2.93 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.06 1.21 7.81 24 I 7.48 4.66 1.13 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.58 0.59 0.92 0.00 0.00 25 S 8.82 5.13 0.00 4.09 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 26 I 9.20 4.78 2.15 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.97 1.03 0.00 0.00 27 E 8.97 4.60 0.00 2.04 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.45 2.49 0.00 28 G 8.33 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 29 N 8.56 4.88 0.00 2.71 2.82 0.00 0.00 6.95 7.94 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 30 I 8.85 4.12 2.04 0.00 0.00 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 1.58 1.03 1.08 0.00 0.00 31 A 9.00 3.85 1.41 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 0.00 0.00 0.00 0.00 0.00 0.00 32 A 7.74 4.12 1.41 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 0.00 0.00 0.00 0.00 0.00 0.00 33 G 8.58 3.55 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 34 K 8.06 4.04 0.00 1.98 1.94 0.00 1.71 0.00 0.00 1.94 0.00 0.00 3.45 0.00 0.00 3.32 0.00 0.00 0.00 0.00 1.85 1.70 7.81 35 S 8.24 4.20 0.00 3.92 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 36 T 7.97 3.91 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 1.02 0.00 0.00 37 F 8.85 4.58 0.00 3.17 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 38 V 8.77 3.28 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 0.86 0.00 0.00 0.69 0.00 0.00 39 N 8.49 3.88 0.00 2.87 2.86 0.00 0.00 6.90 7.15 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 40 I 7.16 3.65 1.59 0.00 0.00 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.44 0.11 0.00 0.00 41 L 7.20 4.06 0.00 1.35 1.35 0.12 0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 42 K 8.21 3.90 0.00 1.75 2.00 0.00 1.79 0.00 0.00 1.75 0.00 0.00 3.08 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.49 1.54 7.81 43 Q 7.36 4.62 0.00 2.30 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.11 6.87 0.00 0.00 0.00 0.00 0.00 2.47 2.28 0.00 44 L 7.68 4.57 0.00 1.59 1.33 0.79 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 45 C 7.12 5.10 0.00 2.25 1.54 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 46 E 8.53 4.48 0.00 1.94 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 2.37 0.00 47 D 7.88 5.05 0.00 2.66 2.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 W 8.36 5.56 0.00 3.33 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 49 E 9.25 4.89 0.00 2.15 1.88 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 2.27 2.29 0.00 50 V 8.47 4.97 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 0.97 0.00 0.00 0.95 0.00 0.00 51 V 8.72 4.43 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 0.77 0.00 0.00 1.15 0.00 0.00 52 P 0.00 4.70 0.00 1.91 1.96 0.00 3.72 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.12 0.00 53 E 8.80 3.92 0.00 2.14 1.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.43 2.57 0.00 54 P 0.00 4.36 0.00 1.77 1.95 0.00 3.47 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.85 0.00 55 V 7.59 2.70 1.88 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 0.70 0.00 0.00 1.05 0.00 0.00 56 A 7.72 3.91 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 57 R 7.62 4.00 0.00 1.86 1.95 0.00 3.10 0.00 0.00 3.29 7.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 1.76 0.00 58 W 8.09 4.80 0.00 3.73 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 0.00 59 C 7.37 5.65 0.00 3.13 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 60 N 7.62 4.74 0.00 2.66 2.69 0.00 0.00 7.09 7.95 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 61 V 8.35 3.69 1.89 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 0.47 0.00 0.00 0.91 0.00 0.00 62 Q 8.20 4.57 0.00 2.01 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.55 7.10 0.00 0.00 0.00 0.00 0.00 2.48 2.34 0.00 63 S 8.43 4.17 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 *77 N 8.02 4.39 0.00 2.73 2.81 0.00 0.00 6.91 7.65 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 78 G 8.63 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 0.00 0.00 0.00 79 G 8.54 3.76 0.00 0.00 0.00 0.00 0.00 0.00 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0.00 0.00 0.00 0.00 2.38 2.35 0.00 88 K 8.34 4.71 0.00 1.91 1.83 0.00 1.75 0.00 0.00 1.76 0.00 0.00 2.94 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.48 1.41 7.81 89 P 0.00 4.47 0.00 2.26 2.37 0.00 3.96 0.00 0.00 4.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 1.94 0.00 90 E 8.22 4.31 0.00 2.07 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 2.22 0.00 91 R 7.90 4.17 0.00 1.53 1.89 0.00 2.59 0.00 0.00 2.83 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.50 0.00 92 W 7.83 4.85 0.00 3.43 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 93 S 8.08 4.17 0.00 4.11 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 94 F 8.47 4.18 0.00 3.25 3.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 T 8.18 3.71 4.73 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 1.31 0.00 0.00 96 F 8.81 3.73 0.00 3.14 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 97 Q 8.89 3.78 0.00 2.42 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.60 0.00 0.00 0.00 0.00 0.00 2.18 2.41 0.00 98 T 7.80 3.60 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 99 Y 7.78 3.98 0.00 2.83 2.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 100 A 7.91 3.17 0.03 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 0.00 101 C 7.78 4.15 0.00 3.30 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 0.00 102 L 8.11 4.05 0.00 2.07 1.78 1.05 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 103 S 8.03 3.90 0.00 3.91 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 0.00 104 R 7.58 3.73 0.00 2.13 2.10 0.00 3.07 0.00 0.00 3.29 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.60 0.00 105 I 7.69 3.48 1.77 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 1.29 0.61 0.50 0.00 0.00 106 R 8.10 3.71 0.00 1.88 1.86 0.00 3.12 0.00 0.00 3.10 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.71 0.00 107 A 7.85 3.93 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 0.00 108 Q 8.19 3.61 0.00 1.75 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.71 0.00 0.00 0.00 0.00 0.00 1.80 2.24 0.00 109 L 7.81 3.98 0.00 1.69 1.71 0.65 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 110 A 8.45 4.11 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 S 7.97 4.12 0.00 4.09 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 0.00 112 L 7.63 4.32 0.00 1.90 1.77 1.02 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 113 N 7.97 4.86 0.00 2.83 2.82 0.00 0.00 6.92 7.56 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 0.00 114 G 7.88 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 0.00 0.00 0.00 115 K 8.51 4.11 0.00 1.93 2.09 0.00 1.54 0.00 0.00 1.77 0.00 0.00 2.99 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.52 1.39 7.81 116 L 7.85 4.01 0.00 1.99 1.75 1.05 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 117 K 8.16 4.05 0.00 1.76 1.95 0.00 1.85 0.00 0.00 1.72 0.00 0.00 2.98 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.47 1.44 7.81 118 D 7.84 4.49 0.00 2.80 2.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 119 A 7.17 4.02 1.41 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 0.00 0.00 0.00 0.00 0.00 0.00 120 E 7.51 4.00 0.00 2.05 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 2.41 2.26 0.00 121 K 7.59 4.38 0.00 1.75 1.82 0.00 1.84 0.00 0.00 1.80 0.00 0.00 3.09 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.44 1.44 7.81 122 P 0.00 5.09 0.00 2.19 2.19 0.00 3.72 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 1.97 0.00 123 V 9.13 4.42 1.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.07 0.00 0.00 0.98 0.00 0.00 124 L 8.69 4.96 0.00 1.72 1.30 1.09 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 125 F 9.12 4.95 0.00 3.06 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 0.00 126 F 9.18 5.29 0.00 3.03 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 0.00 127 E 8.80 4.67 0.00 2.05 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 0.00 2.41 2.40 0.00 128 R 8.80 4.58 0.00 2.14 2.15 0.00 3.66 0.00 0.00 3.42 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.80 0.00 129 S 8.58 4.96 0.00 4.20 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 0.00 130 V 7.92 4.00 1.79 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 0.92 0.00 0.00 0.01 0.00 0.00 131 Y 7.02 4.14 0.00 3.18 2.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 132 S 8.23 4.25 0.00 4.36 4.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 133 D 8.12 4.47 0.00 3.11 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 0.00 134 R 7.97 4.26 0.00 2.00 1.98 0.00 2.65 0.00 0.00 2.95 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.87 1.72 0.00 135 Y 8.49 4.03 0.00 2.67 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 0.00 136 I 7.74 4.12 2.15 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 1.52 1.24 0.50 0.00 0.00 137 F 8.28 4.13 0.00 3.34 3.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 138 A 8.68 3.93 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 0.00 139 S 8.28 3.35 0.00 4.16 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 0.00 140 N 8.01 4.20 0.00 2.68 2.93 0.00 0.00 7.36 6.61 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 0.00 141 L 8.21 4.04 0.00 1.89 1.72 0.96 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 142 Y 7.83 3.96 0.00 2.07 2.22 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 0.00 143 E 7.63 3.49 0.00 1.82 1.81 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 2.10 2.34 0.00 144 S 7.54 4.44 0.00 3.99 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 0.00 145 E 7.67 3.70 0.00 2.03 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 2.11 2.11 0.00 146 C 8.21 4.55 0.00 3.12 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 0.00 147 M 7.88 5.28 0.00 2.17 2.12 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.63 0.00 148 N 8.92 4.66 0.00 2.93 2.97 0.00 0.00 6.16 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 0.00 149 E 8.90 4.07 0.00 2.05 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 0.00 2.52 2.47 0.00 150 T 8.03 3.86 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 1.12 0.00 0.00 151 E 8.26 3.43 0.00 2.21 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 1.77 2.46 0.00 152 W 8.31 4.54 0.00 3.04 2.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 153 T 8.35 3.64 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 1.16 0.00 0.00 154 I 8.03 3.71 1.96 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.87 1.06 0.00 0.00 155 Y 8.71 4.30 0.00 3.51 3.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 156 Q 7.84 3.63 0.00 1.81 1.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.48 0.00 0.00 0.00 0.00 0.00 1.16 1.43 0.00 157 D 8.08 4.34 0.00 2.85 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 0.00 158 W 8.51 4.13 0.00 3.46 3.41 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 0.00 0.00 0.00 0.00 159 H 8.40 3.32 0.00 2.86 3.23 0.00 5.64 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 160 D 8.43 4.36 0.00 2.87 2.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 161 W 8.15 4.28 0.00 3.36 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 0.00 162 M 8.12 3.72 0.00 1.42 1.48 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 1.60 0.00 163 N 7.65 4.90 0.00 3.14 3.10 0.00 0.00 6.92 7.01 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 0.00 164 N 7.58 4.83 0.00 2.65 2.65 0.00 0.00 6.76 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 0.00 165 Q 7.28 3.95 0.00 0.94 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 7.22 0.00 0.00 0.00 0.00 0.00 1.16 1.16 0.00 166 F 7.76 4.73 0.00 2.79 2.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 167 G 7.95 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 0.00 0.00 0.00 168 Q 6.87 3.34 0.00 2.09 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.24 6.78 0.00 0.00 0.00 0.00 0.00 2.38 2.32 0.00 169 S 8.18 4.15 0.00 3.92 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 0.00 170 L 8.07 4.63 0.00 1.70 1.85 0.83 1.12 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 0.00 171 E 7.65 4.22 0.00 1.74 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 2.21 2.38 0.00 172 L 9.37 4.49 0.00 1.80 1.84 1.18 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 173 D 8.37 4.90 0.00 2.40 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 0.00 174 G 7.39 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 0.00 0.00 0.00 0.00 175 I 8.22 5.20 1.72 0.00 0.00 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.67 0.79 0.00 0.00 176 I 9.25 4.40 1.88 0.00 0.00 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 0.61 0.78 0.73 0.00 0.00 177 Y 8.86 4.66 0.00 2.77 2.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 178 L 8.80 4.37 0.00 1.37 1.32 0.69 -0.10 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 0.00 179 Q 8.05 3.65 0.00 1.14 1.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.79 0.00 0.00 0.00 0.00 0.00 2.21 2.17 0.00 180 A 8.18 4.72 1.16 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 0.00 181 T 8.49 3.77 4.38 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 1.26 0.00 0.00 182 P 0.00 4.29 0.00 2.19 2.34 0.00 3.52 0.00 0.00 3.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.87 0.00 183 E 8.01 3.91 0.00 2.06 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 0.00 2.39 2.45 0.00 184 T 8.16 3.91 4.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 185 C 8.16 4.17 0.00 3.16 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 0.00 186 L 7.96 4.07 0.00 1.73 1.92 0.99 1.22 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 0.00 187 H 8.47 4.40 0.00 3.30 3.58 0.00 5.84 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 0.00 188 R 8.62 3.92 0.00 1.97 2.03 0.00 3.33 0.00 0.00 3.22 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.83 0.00 189 I 8.35 3.77 2.14 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.38 0.98 0.00 0.00 190 Y 7.93 4.22 0.00 2.88 3.21 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 0.00 191 L 7.67 3.89 0.00 1.71 1.62 0.88 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 192 R 7.98 3.95 0.00 1.78 2.16 0.00 3.40 0.00 0.00 3.26 7.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.66 0.00 193 G 7.95 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 0.00 0.00 0.00 194 R 7.99 3.96 0.00 2.06 2.20 0.00 3.59 0.00 0.00 3.44 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.70 0.00 195 N 8.83 4.42 0.00 2.70 2.90 0.00 0.00 7.21 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 0.00 196 E 8.34 4.15 0.00 2.09 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 2.43 2.43 0.00 197 E 7.91 3.94 0.00 1.99 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 0.00 2.45 2.28 0.00 198 Q 7.99 4.07 0.00 2.04 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.91 0.00 0.00 0.00 0.00 0.00 2.58 2.32 0.00 199 G 7.54 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 0.00 200 I 6.79 3.46 1.82 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 0.85 0.18 1.07 0.00 0.00 201 P 0.00 4.68 0.00 2.55 2.15 0.00 3.62 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 2.10 2.00 0.00 202 L 8.35 3.94 0.00 1.77 1.70 0.90 0.95 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 0.00 203 E 8.30 3.89 0.00 2.13 2.05 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 2.43 2.48 0.00 204 Y 8.07 4.07 0.00 3.02 3.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 205 L 7.92 3.91 0.00 1.82 1.71 1.03 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 206 E 8.63 3.52 0.00 1.91 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.92 0.00 207 K 7.90 3.73 0.00 1.72 1.75 0.00 1.73 0.00 0.00 1.65 0.00 0.00 2.89 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.44 1.73 7.81 208 L 7.53 3.78 0.00 1.57 1.38 0.53 0.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 209 H 7.82 4.05 0.00 3.27 3.25 0.00 5.80 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 0.00 210 Y 7.61 4.44 0.00 3.20 2.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 211 K 8.00 3.96 0.00 1.93 1.85 0.00 1.83 0.00 0.00 1.68 0.00 0.00 2.99 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.56 1.55 7.81 212 H 8.09 4.23 0.00 3.45 3.16 0.00 5.84 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 0.00 213 E 8.33 3.89 0.00 2.24 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 0.00 2.42 2.58 0.00 214 S 8.85 4.21 0.00 3.97 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 0.00 215 W 7.91 4.37 0.00 3.27 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 0.00 216 L 7.73 3.68 0.00 0.64 1.06 0.33 -1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.60 0.00 0.00 0.00 0.00 0.00 0.00 217 L 7.38 4.28 0.00 1.54 1.54 0.96 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 218 H 8.44 4.47 0.00 3.17 3.32 0.00 5.86 0.00 0.00 0.00 0.00 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 219 R 8.08 4.22 0.00 1.89 1.94 0.00 3.16 0.00 0.00 2.28 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.62 0.00 220 T 7.88 4.19 4.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 221 L 7.81 4.36 0.00 1.75 1.83 0.99 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 222 K 8.63 4.33 0.00 1.84 1.78 0.00 1.80 0.00 0.00 1.79 0.00 0.00 3.18 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.46 1.51 7.81 223 T 8.08 4.64 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 0.53 0.00 0.00 224 N 8.60 5.09 0.00 2.80 2.87 0.00 0.00 6.94 8.34 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 0.00 225 F 7.89 4.81 0.00 2.87 2.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 226 D 7.68 4.37 0.00 2.79 2.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 227 Y 8.26 4.31 0.00 3.20 3.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 228 L 7.65 3.51 0.00 1.37 1.54 0.13 0.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.53 0.00 0.00 0.00 0.00 0.00 0.00 229 Q 7.73 4.06 0.00 1.98 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 7.46 0.00 0.00 0.00 0.00 0.00 2.37 2.36 0.00 230 E 7.71 4.63 0.00 2.02 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 2.28 2.38 0.00 231 V 7.45 4.38 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 0.85 0.00 0.00 0.93 0.00 0.00 232 P 0.00 4.49 0.00 2.14 1.92 0.00 3.73 0.00 0.00 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.08 0.00 233 I 8.29 4.56 1.77 0.00 0.00 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.69 0.78 0.00 0.00 234 L 7.86 4.14 0.00 0.60 0.29 0.82 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 0.00 0.00 0.00 0.00 235 T 8.39 4.92 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 0.00 236 L 8.21 4.46 0.00 1.17 1.26 0.67 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 237 D 8.53 4.76 0.00 2.60 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 0.00 238 V 7.98 4.09 1.78 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 0.06 0.00 0.00 0.86 0.00 0.00 239 N 8.69 4.52 0.00 2.95 2.89 0.00 0.00 6.88 7.92 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 0.00 240 E 8.19 4.07 0.00 2.10 1.77 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 2.38 2.43 0.00 241 D 8.78 4.86 0.00 2.65 2.60 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 0.00 242 F 8.77 5.59 0.00 3.49 3.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 243 K 7.36 3.80 0.00 1.64 2.03 0.00 1.71 0.00 0.00 1.68 0.00 0.00 3.09 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.43 1.50 7.81 244 D 7.29 4.45 0.00 2.72 2.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 245 K 7.80 4.03 0.00 1.78 1.77 0.00 1.70 0.00 0.00 1.90 0.00 0.00 2.96 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.54 1.41 7.81 246 Y 7.73 5.11 0.00 3.32 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 0.00 247 E 8.34 4.00 0.00 1.99 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.27 0.00 248 S 8.32 4.10 0.00 3.92 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 249 L 8.02 3.99 0.00 2.01 1.92 0.86 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 250 V 8.01 3.74 2.41 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 1.16 0.00 0.00 1.21 0.00 0.00 251 E 8.17 4.08 0.00 2.26 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 2.56 0.00 252 K 8.11 4.06 0.00 2.05 1.91 0.00 1.66 0.00 0.00 1.58 0.00 0.00 2.92 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.50 1.67 7.81 253 V 7.63 3.79 2.41 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 0.97 0.00 0.00 1.23 0.00 0.00 254 K 8.29 4.14 0.00 2.14 2.00 0.00 2.02 0.00 0.00 1.66 0.00 0.00 2.91 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.75 1.84 7.81 255 E 8.66 3.91 0.00 2.22 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.40 2.47 0.00 256 F 8.51 4.16 0.00 3.14 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 0.00 257 L 8.59 4.00 0.00 1.93 1.77 0.79 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 258 S 8.09 4.35 0.00 4.04 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 0.00 259 T 7.14 4.05 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 1.23 0.00 0.00 260 L 7.64 4.15 0.00 1.59 1.41 0.60 0.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.