NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 D 4.6025 8.2227 120.3136 52.9202 41.0467 175.7500 3 I 3.6279 8.0299 117.9912 63.5571 37.6886 176.1543 4 I 3.7445 8.5014 121.8182 64.3059 37.3414 177.8601 5 S 4.0884 7.9028 114.9172 61.5677 62.6363 176.8009 6 V 3.5521 7.4727 119.5099 66.0237 30.9929 177.9362 7 A 3.9697 7.7377 119.3299 55.1726 18.3277 179.2885 8 L 4.1308 7.9824 116.1606 56.6697 41.8767 178.6656 9 K 4.4154 8.1390 117.2108 55.7870 33.2645 176.9774 10 R 4.1766 7.3612 115.6417 56.5668 29.9972 174.9967 11 H 4.5963 7.8651 112.6262 54.7434 30.8765 173.4770 12 S 4.4397 8.3473 116.6607 57.6401 62.4121 174.6995 13 T 4.0532 7.9857 123.1830 63.0525 68.3448 175.1462 14 K 4.0540 9.6929 126.4009 57.2806 32.9455 177.0276 15 A 4.5616 7.1653 121.2567 50.9453 22.0145 175.1531 16 F 5.0449 8.7073 121.3925 55.6567 41.5207 175.3197 17 D 4.5726 9.3921 123.4599 53.2555 40.6189 177.2353 18 A 4.5358 8.9719 130.1074 53.7173 18.5321 177.6771 19 S 4.4988 8.8295 109.3795 58.1589 63.9583 174.2387 20 K 4.4176 7.9227 121.2921 54.9723 32.5553 176.0280 21 K 4.6767 8.2801 123.0055 54.1386 34.6659 176.1960 22 L 4.3695 8.1776 121.1852 54.6268 42.3777 178.3206 23 T 4.1549 8.8302 113.3407 60.8581 70.7471 173.9827 24 P 4.2446 0.0000 0.0000 66.2767 30.9363 178.3591 25 E 3.9170 8.0680 118.5763 59.2645 29.6009 178.5868 26 Q 3.9581 8.1118 117.9583 58.8318 28.3610 178.5407 27 A 3.8161 8.0831 121.8355 54.8860 18.2503 179.1488 28 E 3.7573 7.8563 117.9774 59.0018 29.7069 178.9200 29 Q 3.9764 7.9526 118.7402 58.8083 28.9399 178.5775 30 I 3.8369 8.0054 114.2938 63.8684 37.5477 178.4860 31 K 3.8937 7.6475 120.1276 59.3375 31.7621 179.4790 32 T 3.9961 7.6796 115.9797 66.4535 68.1516 176.2957 33 L 3.9864 7.6871 121.1513 58.3458 42.1578 178.8036 34 L 3.6776 7.3834 117.1643 57.4754 41.4014 179.0561 35 Q 4.1342 7.6535 118.4819 59.0741 29.0690 176.8809 36 Y 4.5507 8.0239 115.5891 57.1958 38.7845 175.7093 37 S 4.3848 7.4676 115.3176 57.3605 63.2066 172.0181 38 P 4.7877 0.0000 0.0000 62.5687 32.5529 175.2689 39 S 4.6925 8.2766 109.5298 57.0470 65.0943 174.6886 40 S 4.1610 9.4685 117.8400 60.7274 62.3913 174.3513 41 T 3.5202 9.5532 114.7075 61.8512 67.5653 171.0800 42 N 4.2846 8.7327 117.2640 54.8685 37.8315 175.6641 43 S 4.1249 8.3744 113.6759 59.2572 63.5795 174.0994 44 Q 2.0000 7.1310 119.3990 55.5150 27.1524 173.2636 45 P 4.2912 0.0000 0.0000 61.1501 30.0534 175.4891 46 W 5.5827 6.9069 116.0143 56.4623 32.2828 175.0252 47 H 4.3366 8.7501 118.6399 54.4767 32.8990 171.8815 48 F 5.0844 7.6300 122.0175 55.4399 42.4443 174.2430 49 I 4.1397 8.0323 122.0267 59.2109 40.4110 174.3748 50 V 4.4456 8.3451 130.1828 61.3313 32.4690 174.3935 51 A 4.6793 9.0445 131.8235 50.7763 19.7827 177.4905 52 S 4.7456 8.9622 114.7742 55.9601 64.9328 174.8254 53 T 4.4498 7.5056 112.3462 60.3635 71.6884 175.2287 54 E 3.9448 8.6003 120.9254 59.5173 29.3829 179.0584 55 E 3.9734 8.1627 119.9260 59.2131 29.7200 178.9364 56 G 3.6539 8.3613 106.1798 47.7782 0.0000 175.8994 57 K 4.0142 8.5414 121.0386 59.0088 31.8907 179.3832 58 A 4.1642 8.0185 121.1562 55.0165 18.0314 179.8326 59 R 3.8120 7.5378 115.8224 59.3257 30.4130 179.0923 60 V 3.9419 7.7639 117.8614 65.7487 31.8394 177.7982 61 A 4.1826 8.6090 120.1267 54.1599 18.1404 179.2008 62 K 4.0756 7.9398 118.9173 58.9048 32.2184 178.2938 63 S 4.5392 8.2950 113.1636 59.5802 63.1504 174.8165 64 A 4.8970 7.7996 123.3190 52.1084 19.4214 178.0352 65 A 4.1328 7.8964 120.1810 54.4773 20.1685 179.8231 66 G 4.1007 8.0847 103.7664 46.0343 0.0000 174.5490 67 N 4.8174 8.5633 117.3004 53.2765 39.2085 174.1834 68 Y 5.0470 7.3130 112.1314 57.1783 39.3180 178.4765 69 V 3.7158 8.0530 116.2580 64.6730 29.8369 178.0701 70 F 4.6407 7.9807 117.1901 60.7949 38.5043 177.2401 71 N 4.7815 8.6032 115.9830 55.7172 38.0460 177.0714 72 E 3.9083 7.6833 119.9114 59.4415 30.0174 178.0439 73 R 4.1418 7.5579 117.0519 59.5182 30.4902 179.8327 74 K 4.3173 7.7617 113.8320 57.5193 31.9120 178.6085 *76 L 4.2733 7.9570 120.6001 55.0166 43.4687 178.1864 77 D 4.4451 8.8713 118.3678 56.6956 41.1084 176.8810 78 A 3.7050 7.3338 120.8652 51.9903 18.5991 177.3126 79 S 4.2566 8.3910 114.3833 61.1748 63.1498 173.2058 80 H 5.1353 8.3913 116.5763 53.7420 32.4632 172.4783 81 V 4.5778 8.9759 121.8368 61.0800 34.5011 174.1053 82 V 4.4475 8.4854 128.0137 61.1559 33.8464 174.3678 83 V 4.5042 8.2865 128.4691 61.1532 33.3992 174.4210 84 F 4.6948 9.5458 128.7496 57.1820 39.9908 174.8189 85 C 5.4138 9.0677 121.4696 57.8240 31.8168 172.9359 86 A 5.2914 8.6605 123.1456 49.8511 21.7613 176.2367 87 K 4.2665 8.4644 120.4350 56.6789 32.2549 177.8193 88 T 4.1859 8.3344 113.0667 63.0298 70.1702 175.1169 89 A 4.0009 7.0442 126.1938 50.3854 21.5782 175.0285 *91 D 4.4871 8.4693 115.1351 53.9641 41.9427 176.3139 92 D 4.4895 8.4838 119.0262 57.2041 40.6975 179.2893 93 V 3.6088 7.9119 118.8586 65.7051 31.5473 177.6879 94 W 4.0741 8.6732 128.2163 60.2886 30.5239 178.0610 95 L 4.0716 8.0219 118.7327 57.6983 41.0787 179.4314 96 K 3.9885 8.3804 119.8289 59.1355 32.2468 178.6221 97 L 3.8115 7.8602 120.7990 58.0010 41.9472 179.2425 98 V 3.3996 7.7902 118.5338 66.0106 31.5814 178.4582 99 V 3.8449 7.7857 118.9317 64.9879 31.1794 178.0501 100 D 4.4336 8.2792 119.6282 57.0511 40.6229 178.4400 101 Q 3.9296 7.9712 119.8418 59.2874 29.0832 178.1926 102 E 3.8482 8.3343 119.5655 59.1335 29.3534 178.9545 103 D 4.3245 8.2620 118.0904 57.3762 41.1736 178.1760 104 A 4.0506 8.3242 120.3516 55.0562 18.4723 178.5964 105 D 4.5560 8.0051 114.9449 54.6294 41.0460 176.9512 106 G 3.8018 7.7514 107.6877 46.4661 0.0000 174.9552 107 R 3.9565 7.3999 118.4978 56.3923 30.4474 176.5979 108 F 5.0635 7.4398 116.6918 55.4186 40.3414 175.3275 109 A 4.2349 8.8847 129.9891 54.6394 18.9432 177.7260 110 T 4.8101 7.5554 104.6390 58.4551 73.4507 173.0897 111 P 4.3178 0.0000 0.0000 65.6401 31.1502 178.6193 112 E 3.8697 8.0733 118.4061 59.3799 29.5757 178.6302 113 A 3.9738 7.8251 120.3543 54.8831 18.2755 179.6863 114 K 2.4800 7.6699 117.6207 59.0643 32.1489 179.0069 115 A 3.8581 7.7304 120.7652 54.9887 18.1468 179.4751 116 A 3.7759 7.9827 119.4108 55.1906 18.4205 179.4360 117 N 4.2680 7.8488 115.6706 56.6650 39.1347 176.5802 118 D 4.2880 8.1537 119.8081 57.3892 41.4055 178.1129 119 K 4.0527 8.7555 120.8322 59.3273 32.1248 178.7271 120 G 3.7791 8.4319 106.5769 48.0570 0.0000 175.7982 121 R 4.4922 8.2483 118.7173 58.2567 29.6449 178.8545 122 K 4.0903 8.1202 119.3936 58.9963 31.7638 178.8721 123 F 3.8293 8.0600 120.4187 61.5084 39.4039 177.0587 124 F 4.1224 7.7455 114.0439 59.9703 39.0036 177.4878 125 A 4.4141 8.4043 120.8577 55.1159 18.2356 180.3088 126 D 4.2806 8.4343 117.6997 54.8963 40.9814 178.4635 *128 H 4.3737 8.2256 118.4161 55.7530 30.9213 175.9637 129 R 3.9710 7.9208 118.2844 58.8372 30.1323 177.6183 130 K 4.1783 8.4280 115.9560 57.8330 32.6578 177.1548 131 D 4.6181 7.8111 115.7792 55.7503 42.6189 177.4993 132 L 4.0297 7.6546 116.3424 55.5402 42.2629 176.4370 133 H 4.2822 7.9690 114.3537 56.8012 26.2194 174.7215 134 D 4.8875 8.6055 113.6824 53.1984 40.7338 177.0442 135 D 4.8433 8.5411 121.4454 57.0942 39.5065 178.2696 136 A 4.1353 8.1435 120.8066 55.0658 18.7384 178.7298 137 E 4.1081 8.1836 117.4610 58.9580 29.3844 178.5477 138 W 4.3711 8.5930 125.0689 58.9678 30.7852 176.9106 *140 A 4.4782 7.9212 121.9499 52.0212 20.2838 179.7956 141 K 4.0467 8.2778 115.4664 59.7812 31.9735 179.4840 142 Q 4.1296 7.7460 117.1257 58.9541 28.5220 179.1068 143 V 3.9708 7.9221 118.8243 66.4466 31.6703 177.5599 144 Y 3.7137 8.3289 116.5042 60.7760 37.6379 178.3114 145 L 4.0137 8.2175 121.4251 58.0805 42.2303 178.4534 146 N 4.4136 8.3185 118.4097 56.4028 38.9276 177.3368 147 V 3.6285 7.8283 113.7788 63.7517 31.2185 178.8919 148 G 3.5613 8.1039 105.9900 47.8532 0.0000 175.2936 149 N 4.3363 8.3153 120.1121 56.1357 38.9406 176.6874 150 F 4.1101 8.6629 122.4643 61.3110 39.4540 177.0830 151 L 3.8631 8.5149 118.9537 57.7102 41.3219 179.3651 152 L 4.0115 7.7631 120.5567 57.7960 42.0117 179.0663 153 G 3.5100 7.9474 105.6908 48.0450 0.0000 176.0292 154 V 3.3926 7.4162 115.4017 63.5577 31.3978 178.5145 155 A 4.1388 7.8809 121.2795 54.6598 18.0450 179.6400 156 A 4.0114 7.8900 117.8568 54.7397 18.4858 178.9282 157 L 4.2524 7.5370 115.4708 54.7923 41.8893 177.5952 158 G 3.8721 8.1436 107.5793 45.7816 0.0000 173.1274 159 L 4.7215 7.8757 119.1359 52.6874 44.5297 175.7441 160 D 4.7414 8.9403 122.2213 54.1424 42.9458 175.2903 161 A 5.6885 8.4184 121.3747 52.6671 23.4328 175.4914 162 V 4.7635 8.1411 117.8302 60.1548 34.4708 171.8925 163 P 4.7655 0.0000 0.0000 62.5354 32.6479 175.6918 164 I 4.7190 8.6109 122.8194 59.9881 40.3746 175.7550 165 E 4.6577 9.2304 125.2842 56.4857 31.2491 177.3689 166 G 3.4698 7.8030 108.9801 43.2100 0.0000 172.2124 167 F 4.2850 6.1600 116.9980 55.1594 40.8585 175.2470 168 D 4.6217 9.4410 121.6851 52.8825 40.9951 176.4686 169 A 4.3421 8.2741 129.8677 54.9567 18.4187 178.8144 170 A 4.0185 8.2338 119.6197 55.2908 18.3941 179.9493 171 I 3.6637 7.9783 117.8228 64.4567 37.2370 178.0926 172 L 4.1156 8.1522 121.1021 58.5418 41.4624 178.7722 173 D 4.4870 8.7493 118.8987 57.4031 40.7311 178.7013 174 A 4.0835 8.1676 121.3592 55.1464 18.1761 179.3228 175 E 3.8772 8.5848 117.2562 58.3055 29.6353 177.5291 176 F 4.6598 7.7212 115.3142 56.0126 39.9867 175.2323 177 G 4.1446 7.9268 108.5462 46.3923 0.0000 176.5298 178 L 4.1401 8.5155 120.7562 57.5741 42.3413 179.6958 179 K 3.8316 8.4534 119.3277 59.7739 31.9544 178.3950 180 E 4.0790 8.0935 115.8434 58.9417 29.5401 178.2198 181 K 4.1112 7.4768 115.4765 57.4355 32.5855 177.8133 182 G 3.6293 8.7341 108.1164 45.0800 0.0000 172.1518 183 Y 5.3445 7.8647 115.4999 56.2944 42.4276 174.7922 184 T 5.1877 8.9255 114.5186 59.9545 71.1922 173.0201 185 S 4.7783 9.9019 124.5485 58.9184 63.4102 172.9372 186 L 4.8226 9.4526 122.7851 55.9423 43.6441 177.0079 187 V 4.8485 7.6889 117.1736 61.0801 35.5559 173.5257 188 V 4.6607 8.4843 126.4440 61.0677 34.2159 174.4413 189 V 4.9868 8.9229 127.4064 59.3843 34.0405 172.4831 190 P 4.7748 0.0000 0.0000 62.2410 32.7112 175.7645 191 V 4.8438 9.9072 123.5484 59.5630 35.0010 175.7326 192 G 4.3898 7.7392 114.2530 46.8116 0.0000 172.2083 193 H 5.5186 8.2464 120.9421 53.7871 32.6712 172.5478 194 H 4.8183 9.5390 118.7609 55.7336 29.7666 174.5084 195 S 4.8733 8.6886 115.1706 56.2988 65.5592 175.3866 196 V 3.7256 8.4251 118.5714 64.3336 31.1010 176.7508 197 E 4.3244 7.8552 118.1428 56.9553 29.8841 177.2314 198 D 4.4062 7.8625 121.6319 52.3601 39.5428 176.3314 199 F 4.3225 7.9544 119.0671 59.0530 38.0278 177.7379 200 N 4.3030 7.0661 118.5624 55.2401 38.9637 176.0000 201 A 3.5170 7.6071 119.8966 54.1761 18.4545 177.9209 202 T 4.4392 7.3334 110.5144 62.9996 69.9321 174.4218 203 L 4.4534 7.2645 121.2918 52.6848 42.7438 175.0500 204 P 4.4161 0.0000 0.0000 62.4544 31.9813 176.4802 205 K 4.2190 8.2845 119.4592 56.4042 32.7609 176.5521 206 S 4.6435 8.3503 115.0124 56.6644 64.9537 173.4638 207 R 4.7617 8.2456 124.8800 54.0971 34.0977 174.8632 208 L 4.2088 8.2687 119.7852 53.9073 42.5730 175.7773 209 P 4.4547 0.0000 0.0000 62.6101 32.1030 177.8397 210 Q 4.1190 8.6095 119.9574 58.6317 28.8775 178.2010 211 N 4.5878 8.1370 113.9548 54.6749 37.8244 175.8105 212 I 4.1629 7.5780 119.6521 63.4064 38.0358 177.0954 213 T 4.2115 7.7774 107.5163 62.2243 69.4557 174.2089 214 L 4.7657 8.1189 124.2444 53.2149 44.4375 175.3479 215 T 4.6310 8.4222 121.2631 61.7199 71.3500 172.9968 216 E 4.7173 8.6973 125.2662 54.7690 31.6038 176.4402 217 V 4.0426 8.0864 115.1716 61.7127 32.7462 175.2363 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ 2 D 8.22 4.60 0.00 2.86 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 3 I 8.03 3.63 1.86 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 1.62 0.93 0.90 0.00 0.00 4 I 8.50 3.74 2.05 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 1.63 0.68 0.91 0.00 0.00 5 S 7.90 4.09 0.00 4.08 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 6 V 7.47 3.55 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 0.97 0.00 0.00 0.94 0.00 0.00 7 A 7.74 3.97 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 8 L 7.98 4.13 0.00 1.74 1.73 0.91 0.78 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 9 K 8.14 4.42 0.00 1.74 1.83 0.00 1.69 0.00 0.00 1.74 0.00 0.00 3.07 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.37 1.51 7.81 10 R 7.36 4.18 0.00 1.87 1.96 0.00 3.06 0.00 0.00 3.25 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 1.55 0.00 11 H 7.87 4.60 0.00 3.18 3.21 0.00 5.52 0.00 0.00 0.00 0.00 6.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 12 S 8.35 4.44 0.00 3.83 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 T 7.99 4.05 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.11 0.00 0.00 14 K 9.69 4.05 0.00 1.03 1.46 0.00 1.60 0.00 0.00 1.55 0.00 0.00 2.85 0.00 0.00 2.88 0.00 0.00 0.00 0.00 0.89 0.21 7.81 15 A 7.17 4.56 1.19 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 0.00 0.00 16 F 8.71 5.04 0.00 3.01 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 17 D 9.39 4.57 0.00 2.82 2.63 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 18 A 8.97 4.54 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 19 S 8.83 4.50 0.00 3.94 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 20 K 7.92 4.42 0.00 1.87 1.87 0.00 1.65 0.00 0.00 1.57 0.00 0.00 2.96 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.38 1.39 7.81 21 K 8.28 4.68 0.00 1.74 1.74 0.00 1.76 0.00 0.00 1.72 0.00 0.00 3.13 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.36 1.38 7.81 22 L 8.18 4.37 0.00 1.57 1.52 0.89 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 23 T 8.83 4.15 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 1.25 0.00 0.00 24 P 0.00 4.24 0.00 2.27 2.37 0.00 3.69 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.04 0.00 25 E 8.07 3.92 0.00 2.08 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 2.35 2.43 0.00 26 Q 8.11 3.96 0.00 2.23 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.57 0.00 0.00 0.00 0.00 0.00 2.35 2.35 0.00 27 A 8.08 3.82 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 28 E 7.86 3.76 0.00 2.20 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 2.29 2.38 0.00 29 Q 7.95 3.98 0.00 2.29 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.57 0.00 0.00 0.00 0.00 0.00 2.33 2.56 0.00 30 I 8.01 3.84 2.15 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 1.62 0.59 0.91 0.00 0.00 31 K 7.65 3.89 0.00 1.94 1.84 0.00 1.62 0.00 0.00 1.60 0.00 0.00 3.08 0.00 0.00 3.20 0.00 0.00 0.00 0.00 1.34 1.59 7.81 32 T 7.68 4.00 4.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 33 L 7.69 3.99 0.00 1.95 1.94 0.90 0.95 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 34 L 7.38 3.68 0.00 1.26 0.44 -0.26 0.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 35 Q 7.65 4.13 0.00 2.08 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 7.42 0.00 0.00 0.00 0.00 0.00 1.72 2.25 0.00 36 Y 8.02 4.55 0.00 3.03 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 37 S 7.47 4.38 0.00 3.82 3.53 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 38 P 0.00 4.79 0.00 2.32 2.16 0.00 3.97 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.04 0.00 39 S 8.28 4.69 0.00 3.69 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 40 S 9.47 4.16 0.00 4.02 3.79 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 41 T 9.55 3.52 4.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 42 N 8.73 4.28 0.00 2.84 2.94 0.00 0.00 7.08 7.99 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 43 S 8.37 4.12 0.00 3.81 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 44 Q 7.13 2.00 0.00 2.07 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.45 7.62 0.00 0.00 0.00 0.00 0.00 2.36 2.22 0.00 45 P 0.00 4.29 0.00 1.78 1.80 0.00 2.52 0.00 0.00 3.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.43 0.00 46 W 6.91 5.58 0.00 2.77 3.18 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 47 H 8.75 4.34 0.00 1.86 2.27 0.00 5.72 0.00 0.00 0.00 0.00 6.77 0.00 0.00 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0.00 56 G 8.36 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 K 8.54 4.01 0.00 1.84 1.84 0.00 1.75 0.00 0.00 1.74 0.00 0.00 2.91 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.38 1.39 7.81 58 A 8.02 4.16 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 59 R 7.54 3.81 0.00 2.04 1.71 0.00 3.32 0.00 0.00 3.13 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.87 0.00 60 V 7.76 3.94 2.08 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 0.90 0.00 0.00 1.05 0.00 0.00 61 A 8.61 4.18 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 62 K 7.94 4.08 0.00 1.97 1.84 0.00 1.62 0.00 0.00 1.69 0.00 0.00 3.10 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.45 1.46 7.81 63 S 8.29 4.54 0.00 4.58 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 64 A 7.80 4.90 1.52 0.00 0.00 0.00 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0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 92 D 8.48 4.49 0.00 2.74 2.80 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 93 V 7.91 3.61 2.39 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 1.09 0.00 0.00 0.97 0.00 0.00 94 W 8.67 4.07 0.00 3.47 3.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 L 8.02 4.07 0.00 1.97 1.78 1.06 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 96 K 8.38 3.99 0.00 1.95 1.95 0.00 1.65 0.00 0.00 1.57 0.00 0.00 2.90 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.60 1.44 7.81 97 L 7.86 3.81 0.00 1.75 1.40 0.54 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 98 V 7.79 3.40 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 1.04 0.00 0.00 0.74 0.00 0.00 99 V 7.79 3.84 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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0.00 1.48 1.45 0.00 108 F 7.44 5.06 0.00 3.05 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 0.00 109 A 8.88 4.23 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 0.00 110 T 7.56 4.81 4.39 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 1.23 0.00 0.00 111 P 0.00 4.32 0.00 2.26 2.35 0.00 3.70 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 2.06 2.06 0.00 112 E 8.07 3.87 0.00 2.06 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.38 2.41 0.00 113 A 7.83 3.97 1.39 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 0.00 0.00 114 K 7.67 2.48 0.00 1.41 1.72 0.00 1.80 0.00 0.00 1.60 0.00 0.00 2.95 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.13 0.84 7.81 115 A 7.73 3.86 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 116 A 7.98 3.78 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 0.00 117 N 7.85 4.27 0.00 2.87 2.68 0.00 0.00 6.83 8.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 D 8.15 4.29 0.00 2.77 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 0.00 119 K 8.76 4.05 0.00 1.82 1.89 0.00 1.68 0.00 0.00 1.62 0.00 0.00 2.97 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.43 1.49 7.81 120 G 8.43 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 0.00 121 R 8.25 4.49 0.00 2.29 2.38 0.00 2.87 0.00 0.00 3.30 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.80 0.00 122 K 8.12 4.09 0.00 2.05 1.93 0.00 1.70 0.00 0.00 1.60 0.00 0.00 2.92 0.00 0.00 3.29 0.00 0.00 0.00 0.00 1.52 1.63 7.81 123 F 8.06 3.83 0.00 3.01 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 0.00 124 F 7.75 4.12 0.00 3.27 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 0.00 125 A 8.40 4.41 1.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 126 D 8.43 4.28 0.00 2.48 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 *128 H 8.23 4.37 0.00 3.04 3.23 0.00 5.61 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 129 R 7.92 3.97 0.00 1.94 1.93 0.00 3.26 0.00 0.00 3.24 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.61 0.00 130 K 8.43 4.18 0.00 1.71 1.77 0.00 1.66 0.00 0.00 1.61 0.00 0.00 2.92 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.41 1.34 7.81 131 D 7.81 4.62 0.00 2.42 2.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 132 L 7.65 4.03 0.00 1.48 1.80 0.80 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 133 H 7.97 4.28 0.00 3.28 3.34 0.00 5.65 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 0.00 134 D 8.61 4.89 0.00 2.79 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 0.00 135 D 8.54 4.84 0.00 3.06 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 0.00 136 A 8.14 4.14 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 0.00 137 E 8.18 4.11 0.00 2.09 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 2.42 2.38 0.00 138 W 8.59 4.37 0.00 3.30 3.27 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 *140 A 7.92 4.48 1.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.28 4.05 0.00 2.07 1.93 0.00 1.83 0.00 0.00 1.74 0.00 0.00 3.01 0.00 0.00 3.19 0.00 0.00 0.00 0.00 1.46 1.68 7.81 142 Q 7.75 4.13 0.00 2.12 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.81 0.00 0.00 0.00 0.00 0.00 2.14 1.98 0.00 143 V 7.92 3.97 2.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 1.19 0.00 0.00 144 Y 8.33 3.71 0.00 3.28 3.03 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 0.00 145 L 8.22 4.01 0.00 1.95 2.05 1.01 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 146 N 8.32 4.41 0.00 2.76 3.04 0.00 0.00 6.79 7.29 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 0.00 147 V 7.83 3.63 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.49 0.00 0.00 0.65 0.00 0.00 148 G 8.10 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 0.00 149 N 8.32 4.34 0.00 2.82 3.06 0.00 0.00 6.92 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 150 F 8.66 4.11 0.00 3.19 3.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 151 L 8.51 3.86 0.00 1.65 1.66 0.89 0.54 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 0.00 152 L 7.76 4.01 0.00 1.67 1.62 0.89 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 153 G 7.95 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 0.00 154 V 7.42 3.39 1.80 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 -0.21 0.00 0.00 0.74 0.00 0.00 155 A 7.88 4.14 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 156 A 7.89 4.01 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 157 L 7.54 4.25 0.00 1.72 1.65 0.86 0.87 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 0.00 158 G 8.14 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 0.00 0.00 0.00 159 L 7.88 4.72 0.00 1.60 1.47 0.83 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 160 D 8.94 4.74 0.00 2.82 2.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 161 A 8.42 5.69 1.29 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 0.00 162 V 8.14 4.76 2.32 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 0.94 0.00 0.00 0.96 0.00 0.00 163 P 0.00 4.77 0.00 2.07 2.05 0.00 3.71 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.99 0.00 164 I 8.61 4.72 2.08 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 1.31 0.96 1.09 0.00 0.00 165 E 9.23 4.66 0.00 1.96 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 2.32 2.36 0.00 166 G 7.80 3.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 F 6.16 4.29 0.00 3.20 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 0.00 168 D 9.44 4.62 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 0.00 169 A 8.27 4.34 1.39 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 0.00 0.00 170 A 8.23 4.02 1.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 171 I 7.98 3.66 2.10 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 1.01 0.97 0.00 0.00 172 L 8.15 4.12 0.00 1.98 1.88 1.10 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 173 D 8.75 4.49 0.00 2.86 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 0.00 174 A 8.17 4.08 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175 E 8.58 3.88 0.00 1.94 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 2.27 1.48 0.00 176 F 7.72 4.66 0.00 3.02 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 0.00 177 G 7.93 4.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 178 L 8.52 4.14 0.00 1.97 2.03 1.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 179 K 8.45 3.83 0.00 1.81 1.85 0.00 1.73 0.00 0.00 1.82 0.00 0.00 2.92 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.52 1.50 7.81 180 E 8.09 4.08 0.00 2.02 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 2.33 2.28 0.00 181 K 7.48 4.11 0.00 2.15 2.08 0.00 1.74 0.00 0.00 1.75 0.00 0.00 3.02 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.54 1.63 7.81 182 G 8.73 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 0.00 0.00 0.00 183 Y 7.86 5.34 0.00 2.72 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 0.00 184 T 8.93 5.19 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 1.27 0.00 0.00 185 S 9.90 4.78 0.00 3.98 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 0.00 186 L 9.45 4.82 0.00 1.73 1.76 1.07 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 187 V 7.69 4.85 1.66 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 0.69 0.00 0.00 0.33 0.00 0.00 188 V 8.48 4.66 1.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.70 0.00 0.00 -0.09 0.00 0.00 189 V 8.92 4.99 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.94 0.00 0.00 190 P 0.00 4.77 0.00 1.80 1.55 0.00 3.86 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.02 0.00 191 V 9.91 4.84 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.00 0.00 1.10 0.00 0.00 192 G 7.74 4.39 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 0.00 0.00 0.00 193 H 8.25 5.52 0.00 3.09 3.13 0.00 5.62 0.00 0.00 0.00 0.00 6.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 194 H 9.54 4.82 0.00 3.13 3.10 0.00 5.53 0.00 0.00 0.00 0.00 6.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 195 S 8.69 4.87 0.00 3.88 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 0.00 196 V 8.43 3.73 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 0.77 0.00 0.00 0.95 0.00 0.00 197 E 7.86 4.32 0.00 2.05 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 2.37 2.28 0.00 198 D 7.86 4.41 0.00 2.81 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 0.00 199 F 7.95 4.32 0.00 3.27 3.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 200 N 7.07 4.30 0.00 2.28 2.76 0.00 0.00 7.13 8.15 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 0.00 201 A 7.61 3.52 1.06 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 0.00 0.00 202 T 7.33 4.44 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 1.19 0.00 0.00 203 L 7.26 4.45 0.00 1.68 1.60 1.06 1.02 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 0.00 204 P 0.00 4.42 0.00 2.17 2.04 0.00 3.77 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.98 0.00 205 K 8.28 4.22 0.00 1.76 1.78 0.00 1.87 0.00 0.00 1.65 0.00 0.00 2.91 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.43 1.41 7.81 206 S 8.35 4.64 0.00 3.77 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 207 R 8.25 4.76 0.00 1.77 1.75 0.00 3.43 0.00 0.00 3.23 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.58 0.00 208 L 8.27 4.21 0.00 1.62 1.60 0.93 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 209 P 0.00 4.45 0.00 2.18 1.97 0.00 3.60 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.11 0.00 210 Q 8.61 4.12 0.00 2.12 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.77 6.93 0.00 0.00 0.00 0.00 0.00 2.45 2.35 0.00 211 N 8.14 4.59 0.00 2.81 2.95 0.00 0.00 5.99 7.81 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 0.00 212 I 7.58 4.16 1.99 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 1.36 0.88 0.92 0.00 0.00 213 T 7.78 4.21 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 0.00 214 L 8.12 4.77 0.00 1.54 1.69 0.93 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 0.00 215 T 8.42 4.63 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 0.00 216 E 8.70 4.72 0.00 1.94 1.86 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 2.23 2.30 0.00 217 V 8.09 4.04 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 0.70 0.00 0.00 0.94 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.