NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 E 4.2145 8.3027 121.4700 55.8323 30.8543 174.1346 2 V 4.0423 7.9623 126.3208 62.2291 32.1878 173.5826 3 Q 4.7619 10.0842 127.6084 54.0892 33.6218 174.0854 4 L 5.0388 8.5536 121.4833 53.2311 45.4290 175.4631 5 V 4.6043 8.6545 125.3330 61.2884 33.2529 174.8732 6 Q 5.2424 9.7008 127.9231 55.3095 30.4641 175.2878 7 S 4.5375 9.1136 115.0334 57.3344 67.1101 174.1437 8 G 4.3829 8.9695 108.3576 46.0688 0.0000 174.8348 9 G 3.8092 7.7093 113.5103 45.8403 0.0000 172.2847 10 G 3.6778 8.6093 107.8609 43.9561 0.0000 172.1323 11 V 4.4337 7.9333 118.5501 62.6422 32.1727 175.7291 12 V 4.6232 8.9013 119.9354 59.7357 36.1390 174.8450 13 Q 4.6658 8.4576 120.7993 54.2783 30.6360 173.9063 14 P 4.3364 0.0000 0.0000 64.4912 31.7324 177.2348 15 G 3.8837 9.2780 111.2667 45.1637 0.0000 173.2014 16 K 4.4621 7.4913 119.3050 55.3901 34.7020 175.4305 17 S 5.1333 7.9173 116.4993 57.2558 65.9384 173.8669 18 L 4.1656 7.9074 118.9504 54.3780 45.9322 172.9750 19 R 4.8620 8.6349 126.3444 54.4908 32.4641 174.5965 20 L 4.7793 8.7314 125.7401 53.1516 44.6907 175.5805 21 S 5.3808 8.9858 117.4242 57.0154 67.0709 172.6792 22 C 5.1684 9.0902 122.3582 54.9345 47.8651 172.5766 23 A 4.6295 9.0027 129.9136 51.0334 19.4644 175.7620 24 A 5.0427 8.2797 125.9037 51.1369 20.3728 176.4147 25 S 4.2851 8.9981 115.2411 57.6763 67.1478 175.0552 26 G 4.1460 10.6840 106.9606 46.4553 0.0000 172.6403 27 F 4.8122 7.1411 112.2028 55.5536 40.6988 174.9969 28 A 4.3526 8.5906 124.7394 50.4261 16.4427 177.3724 29 F 3.9620 8.1915 124.5154 61.0913 39.6548 177.1636 30 S 4.2858 8.1999 112.1287 59.9464 62.2855 174.1672 31 S 4.5254 8.4498 114.8487 59.4060 63.7135 173.4155 32 Y 4.7536 7.5450 118.0927 55.5985 40.9059 175.5444 33 A 4.6832 8.6535 124.3522 52.4849 20.3142 176.0980 34 M 5.1859 8.6539 117.6495 53.9627 36.6401 174.4607 35 H 5.4555 9.1696 118.7919 53.7985 33.1998 172.5784 36 W 5.2112 9.2102 120.5421 55.0372 31.9281 175.1593 37 V 5.0413 9.0890 123.7082 61.1068 35.0361 174.2137 38 R 5.0014 9.3348 121.6029 54.4606 33.5642 174.1173 39 Q 4.7746 8.7665 120.2792 54.1402 32.0792 174.0733 40 A 4.6483 8.5887 129.1867 50.8878 19.8830 174.7587 41 P 4.2602 0.0000 0.0000 64.5420 31.4340 176.3617 42 G 3.9695 9.0315 108.8987 46.0954 0.0000 172.5458 43 K 4.6587 7.9113 118.1025 54.2227 36.1727 176.0873 44 G 3.9790 8.4213 108.3265 45.4223 0.0000 173.2588 45 L 4.0460 7.6386 119.7438 54.2639 42.4902 176.4766 46 E 4.7297 9.1082 123.4212 53.9887 32.8027 174.4608 47 W 4.5360 9.3865 135.0000 58.0261 31.3443 174.3889 48 V 4.0438 8.2440 125.2861 63.6837 33.2081 174.8321 49 A 4.5945 6.5291 119.9370 50.5265 22.6551 174.7207 50 V 4.9211 9.2296 119.0522 59.9622 35.5172 174.2858 51 I 5.0506 8.4897 122.7441 58.9119 41.2631 175.0229 52 S 4.7386 8.9726 124.0111 58.2225 63.7744 174.6060 53 Y 4.5802 9.3316 118.8400 59.2022 37.3376 177.1857 54 D 4.3741 7.0086 116.2903 52.4233 40.0583 177.2036 55 G 3.9015 7.9514 108.5668 45.6539 0.0000 174.8122 56 S 4.1320 7.9897 114.5141 60.6990 62.7161 173.4671 57 N 5.1887 7.8830 117.6876 50.8015 40.1114 172.9700 58 K 4.9229 7.8216 118.5190 55.6550 35.9951 174.8795 59 Y 5.0661 8.9742 119.5351 56.6974 42.2071 173.9792 60 Y 5.1938 9.0889 118.4292 55.8174 42.5174 175.1335 61 A 4.4642 9.1785 124.1327 52.1064 18.8887 178.7645 62 D 4.4746 9.1483 120.3219 57.4308 41.2359 179.4404 63 S 4.1713 8.1640 112.6092 60.5254 63.3723 175.2007 64 V 3.9143 7.4604 111.4573 60.2319 32.1615 175.3569 65 K 3.9515 7.4299 119.7992 57.9362 32.0931 177.6426 66 G 3.9419 8.7016 111.6763 45.2645 0.0000 173.7467 67 R 4.5858 7.6604 116.7699 56.1124 33.4882 175.4833 68 F 5.4143 8.0263 115.9940 56.0884 41.4202 175.8925 69 T 4.7595 8.7860 118.1381 62.0376 72.0932 172.8141 70 I 4.9416 8.9364 127.2548 60.2608 39.6699 174.7441 71 S 5.0329 8.9730 122.6998 57.7843 67.8577 173.2324 72 R 5.1940 8.6133 116.8031 55.0887 32.9078 174.3833 73 D 4.9313 9.7063 121.4041 52.5107 41.9679 176.1820 74 N 4.7706 9.0038 123.8484 55.8373 39.0971 177.1893 75 S 4.2762 7.9224 111.4708 60.7146 63.1686 175.2798 76 K 4.1957 8.0628 117.2687 55.4199 32.7424 175.6842 77 N 3.3235 7.9786 116.1790 54.5235 36.5813 173.6349 78 T 4.6672 7.1681 112.3427 61.4632 72.6711 173.4770 79 L 5.1835 8.4959 127.2690 53.6493 45.0337 174.6600 80 Y 5.5826 9.7257 122.3384 56.2363 42.6892 174.3094 81 L 4.5819 8.4481 123.2586 53.2848 45.1187 175.1568 82 Q 4.4344 8.9406 129.5388 55.3352 30.3125 174.1991 83 M 3.9293 8.8828 128.2872 53.6559 33.5711 175.4515 84 N 5.0132 8.9672 121.3148 50.6884 42.1508 174.3346 85 S 3.6983 8.5499 112.8481 59.1873 60.8114 173.3968 86 L 4.3047 7.7246 118.9443 55.2690 42.5153 177.1044 87 R 4.8710 8.7318 120.9888 54.0176 33.5453 176.1633 88 A 4.0921 8.5817 125.0035 55.1291 18.5696 179.8264 89 E 4.1295 8.0941 112.3976 58.8821 29.8027 177.4878 90 D 4.6794 7.9056 118.2001 55.6792 41.2468 176.4366 91 T 4.3638 7.7947 117.2534 64.2065 68.7884 173.6698 92 A 4.4147 8.4727 125.9705 51.1934 23.6838 175.1207 93 V 4.2853 8.3314 121.0641 62.7879 32.7792 174.5768 94 Y 4.9607 9.1870 126.5109 56.8767 40.1776 174.2303 95 Y 5.5022 9.5772 121.4662 56.3682 41.3538 172.8079 96 C 4.0802 8.9520 118.6155 54.7394 41.6755 172.5553 97 A 4.7015 7.8736 121.3901 50.3841 22.5729 175.6192 98 R 4.2035 8.7313 123.9494 56.0017 31.3065 175.3279 99 D 4.5627 8.6421 126.6817 54.0761 42.1703 176.4445 100 R 4.5088 8.8897 124.5603 56.2557 30.3347 174.9040 101 S 3.9371 9.2777 119.1168 59.7415 60.7787 172.4668 102 Y 3.3060 9.3824 112.6315 58.8770 36.5132 169.9667 103 Y 5.0215 7.4404 118.1975 56.6650 39.8502 174.8814 104 L 4.8595 9.0398 121.3796 53.3075 42.9304 176.5291 105 D 4.9399 8.4342 123.5736 54.2050 40.3684 176.5705 106 Y 4.9814 7.6302 116.5767 56.1037 42.3406 174.1686 107 W 5.2176 9.0917 122.2131 54.7021 32.0889 175.4816 108 G 4.5931 9.1251 111.1332 45.5523 0.0000 174.6015 109 Q 4.2806 8.8267 117.3868 57.2788 29.0719 177.5525 110 G 3.7189 8.3294 105.4333 45.6832 0.0000 172.6794 111 T 4.6432 8.3977 110.7172 59.3515 72.1379 172.6426 112 L 4.4919 8.5654 127.7374 54.6493 43.9109 175.1528 113 V 4.6121 8.8338 126.7126 61.6874 33.7645 174.5178 114 T 4.4097 8.4333 126.1081 61.8825 70.0704 174.4791 115 V 4.4068 8.5963 128.9106 62.4151 31.4914 175.3011 116 S 4.6894 8.9694 129.6067 57.2739 65.5345 175.0645 117 S 4.2678 8.5688 108.0497 58.9052 59.8757 174.4513 *132 S 4.3989 7.4241 115.9744 57.7043 65.1493 175.2643 133 E 4.2366 8.2682 119.6924 55.5708 30.8970 176.1646 134 T 4.5611 8.1969 117.7413 62.4104 70.2731 174.1935 135 T 4.4724 8.9658 124.3914 62.4485 70.3021 173.7616 136 L 5.1160 8.4832 125.4686 53.3451 44.4426 175.3483 137 T 4.7334 8.8305 120.8584 61.9163 70.7660 173.6354 138 Q 5.0719 8.7333 125.7811 55.5967 30.4100 175.7991 139 S 4.8236 8.7813 115.5012 56.6146 66.7537 172.5074 140 P 4.8860 0.0000 0.0000 61.7670 32.6071 175.8959 141 A 4.3520 8.5110 119.8420 54.9073 19.2388 177.6754 142 T 5.1646 7.7289 103.1905 60.2288 72.3002 173.6417 143 L 4.7620 9.3344 123.8828 53.1609 45.0818 175.5278 144 S 5.2203 8.8327 120.2602 57.0927 64.2402 173.2223 145 L 5.0564 8.9899 124.1998 53.2827 46.6340 175.7103 146 S 5.0897 8.8402 115.5041 55.9274 65.8880 172.6075 147 P 4.4989 0.0000 0.0000 64.9877 31.3913 177.0198 148 G 3.9157 9.5494 111.5991 44.9648 0.0000 172.8175 149 E 4.5852 7.7906 118.9956 54.8206 32.5000 174.5660 150 R 4.8491 8.3318 120.9250 54.9420 31.7528 174.9304 151 A 4.6688 8.7055 128.1522 50.4069 21.5852 175.4243 152 T 4.7255 8.4457 118.8778 61.8326 71.0932 173.3249 153 L 4.7220 8.5263 127.3960 53.0750 44.1932 176.1234 154 S 5.4244 8.9645 119.6829 57.3277 65.8231 172.4738 155 C 5.4321 9.3044 122.5370 55.0131 48.0016 172.4395 156 R 5.3100 9.2683 126.6315 54.5747 32.3041 174.0771 157 A 5.0860 9.1454 129.0757 50.8894 19.8705 177.3878 158 S 4.4412 8.7898 116.9160 60.5568 63.7735 174.3833 159 Q 4.6472 7.8169 115.5226 53.2278 31.6209 174.5606 160 S 4.2580 8.6800 113.2975 59.2249 62.7698 174.2160 161 V 4.4081 9.1513 120.2455 60.3273 33.0892 177.4881 162 R 3.5421 7.3670 123.4463 57.7696 30.4201 177.9998 163 S 4.9078 8.7746 122.4507 59.4410 63.7966 173.6001 164 N 5.2714 8.2541 119.5562 53.1892 38.4870 174.1572 165 L 5.0459 7.7090 119.6735 53.2153 45.0779 175.2390 166 A 4.9503 9.0952 126.9147 49.8174 22.7727 174.9047 167 W 5.2048 8.5433 118.4502 55.0893 33.0059 174.5587 168 Y 5.1167 9.5419 120.2024 56.2890 41.8504 173.9896 169 Q 4.4879 9.0271 124.2747 54.3405 31.6637 173.9676 170 Q 4.6068 8.9223 127.2876 54.1174 31.8651 174.6822 171 K 4.5145 8.4961 125.9054 54.9699 34.0385 174.8342 172 P 4.2779 0.0000 0.0000 64.3176 31.3319 177.0818 173 G 3.9222 8.9094 110.8478 45.8573 0.0000 172.6636 174 Q 4.5744 8.0314 118.3537 53.6224 30.9368 175.1887 175 A 3.9300 8.2097 122.0601 51.1737 19.1331 175.9377 176 P 4.2341 0.0000 0.0000 62.4608 32.1567 175.7666 177 R 4.6374 8.5098 123.3305 53.5134 33.0116 173.0227 178 P 4.3874 0.0000 0.0000 63.2745 31.7345 175.5469 179 L 4.1622 8.7840 123.8699 56.0726 43.5827 176.6757 180 I 4.7390 6.8381 117.7880 59.7491 41.6362 173.7784 181 Y 4.3154 9.0151 124.0273 55.9748 41.5386 175.1185 182 D 5.1310 9.2483 117.5653 54.5551 39.1230 174.8847 183 A 4.3455 9.2622 127.0602 52.4567 18.3047 180.5475 184 S 4.8161 8.1457 105.5659 56.8383 65.5109 174.0927 185 T 4.4136 8.1860 119.0142 62.1544 69.2584 174.7084 186 R 4.3745 8.5788 126.1382 56.1446 31.1370 176.8099 187 A 4.4829 8.8216 125.4102 51.1124 20.4526 177.0099 188 T 3.9222 8.3876 116.0773 65.7912 68.5305 175.1914 189 G 3.8810 9.1094 114.9944 45.0494 0.0000 172.6714 190 I 3.9849 7.1638 121.1854 58.8697 37.4626 174.1557 191 P 4.4993 0.0000 0.0000 62.6092 31.6834 176.5220 192 D 4.6964 8.4758 117.1048 54.2651 39.7988 177.3448 193 R 4.0170 7.8553 117.2982 58.4877 30.8662 176.0577 194 F 4.7941 7.8933 119.9939 56.6571 39.8208 175.5385 195 S 4.6543 9.0689 117.9774 56.6132 66.2240 173.2400 196 G 4.6341 8.5188 108.0871 43.7668 0.0000 171.4274 197 S 4.7345 9.2285 115.3657 56.8929 66.2387 172.5311 198 G 4.2718 8.1073 110.0582 44.5132 0.0000 173.2209 199 S 4.6781 7.7710 114.1754 57.8778 66.9586 171.7714 200 G 4.1834 9.6014 116.4875 45.1270 0.0000 175.0236 201 T 4.7320 9.2633 117.7348 61.0667 72.0616 173.9358 202 D 5.1848 7.4698 122.5094 52.5583 44.0552 174.3099 203 F 5.5199 9.1808 123.7127 56.2576 44.0351 173.8036 204 T 5.2780 9.2513 109.8252 60.2427 72.8476 172.3485 205 L 4.5071 8.2281 124.3801 53.4481 44.8574 175.0004 206 T 4.6460 8.6955 123.8105 61.9666 70.8315 173.7749 207 I 4.1262 8.2600 128.4236 59.5120 38.2675 175.3653 208 S 4.3351 8.6001 123.8783 58.5488 63.8845 175.6400 209 R 3.4416 8.4172 111.7840 56.9705 27.5454 174.9811 210 L 3.9140 8.5993 127.8681 55.6733 42.6512 176.5352 211 E 4.9894 8.7481 121.6067 53.5380 32.8908 175.2546 212 P 4.5990 0.0000 0.0000 66.3142 31.4153 178.5077 213 E 4.3037 8.0926 114.6749 58.3066 29.5578 177.2510 214 D 4.6572 7.9895 118.0697 55.2450 41.3144 176.3506 215 F 4.6871 7.4789 117.7622 57.6599 39.4779 174.7387 216 A 4.3145 8.4033 124.4971 51.4737 23.6653 174.6216 217 V 4.3385 7.8661 119.1609 62.6158 33.1601 174.3958 218 Y 5.1607 9.1371 125.2765 56.4381 40.9112 174.1221 219 Y 5.4164 9.3271 122.0269 56.3495 41.1337 172.6210 220 C 4.4117 8.7246 117.8688 54.0100 39.9542 172.1770 221 Q 4.7726 8.7567 121.3675 54.3376 32.4034 173.4048 222 Q 5.0933 8.5684 123.8604 54.5973 30.6299 176.0487 223 R 4.2850 8.4001 117.6800 56.6062 30.8223 177.4334 224 S 4.1984 8.1954 113.5051 59.6476 63.7879 173.8024 225 N 4.8249 8.5995 119.1667 50.8492 39.6181 174.4522 226 W 4.0969 8.6843 133.8779 56.3971 31.4837 173.8895 227 P 2.9700 0.0000 0.0000 60.0275 32.2225 173.6115 228 P 4.3184 0.0000 0.0000 62.6682 31.5574 176.0607 229 T 4.8139 8.2351 113.3879 59.8992 72.1976 172.7487 230 F 5.2171 8.9572 121.3817 55.5523 41.9824 175.4790 231 G 4.0114 8.8819 109.4891 46.1292 0.0000 173.3630 232 Q 4.4594 8.7444 119.3186 55.8426 29.5665 175.9926 233 G 3.6098 8.5676 103.7770 45.6067 0.0000 173.0517 234 T 4.7925 8.5080 115.8502 61.3835 72.4705 172.9521 235 K 4.7234 9.1051 128.7419 55.3919 33.7561 175.5242 236 V 4.7542 9.3593 129.1872 62.0279 32.2951 174.4969 237 E 4.6392 9.3385 128.4945 54.5200 32.0782 175.9637 238 V 3.2559 7.7303 122.3699 62.4477 32.3207 175.5082 239 K 4.1345 8.6832 130.4362 56.2147 32.0120 176.8192 240 S 4.2462 8.5523 123.9866 58.9602 63.7274 172.3245 241 G 3.5431 10.0436 114.0125 45.7050 0.0000 172.4121 242 L 4.1775 7.4634 122.6923 54.5598 42.6517 173.1973 243 V 4.1713 8.0109 121.9446 62.1969 33.7490 173.1767 244 P 4.6227 0.0000 0.0000 61.5295 32.5542 175.1802 245 R 4.0680 8.6786 122.5513 56.6871 30.9901 175.3709 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 1 E 8.30 4.21 0.00 2.04 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.42 2.34 0.00 2 V 7.96 4.04 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 0.14 0.00 0.00 0.29 0.00 0.00 3 Q 10.08 4.76 0.00 2.04 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.45 6.52 0.00 0.00 0.00 0.00 0.00 2.28 2.39 0.00 4 L 8.55 5.04 0.00 1.62 1.57 0.93 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 5 V 8.65 4.60 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 1.08 0.00 0.00 0.95 0.00 0.00 6 Q 9.70 5.24 0.00 2.11 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 6.44 0.00 0.00 0.00 0.00 0.00 2.44 2.37 0.00 7 S 9.11 4.54 0.00 3.88 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 8 G 8.97 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 0.00 0.00 0.00 0.00 9 G 7.71 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 0.00 0.00 0.00 0.00 10 G 8.61 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 V 7.93 4.43 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 12 V 8.90 4.62 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 0.71 0.00 0.00 0.89 0.00 0.00 13 Q 8.46 4.67 0.00 1.96 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 7.06 0.00 0.00 0.00 0.00 0.00 2.41 2.32 0.00 14 P 0.00 4.34 0.00 2.04 2.00 0.00 3.69 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 2.17 2.19 0.00 15 G 9.28 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 16 K 7.49 4.46 0.00 1.92 1.71 0.00 1.60 0.00 0.00 1.62 0.00 0.00 2.84 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.36 1.38 7.81 17 S 7.92 5.13 0.00 3.65 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 18 L 7.91 4.17 0.00 1.47 1.17 0.76 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 19 R 8.63 4.86 0.00 1.70 1.67 0.00 2.96 0.00 0.00 3.05 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.49 0.00 20 L 8.73 4.78 0.00 0.86 1.33 0.20 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 21 S 8.99 5.38 0.00 3.82 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 22 C 9.09 5.17 0.00 2.89 2.83 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 23 A 9.00 4.63 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 24 A 8.28 5.04 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 S 9.00 4.29 0.00 3.78 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 G 10.68 4.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27 F 7.14 4.81 0.00 2.96 2.76 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.59 4.35 1.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 F 8.19 3.96 0.00 2.50 3.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 S 8.20 4.29 0.00 3.97 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31 S 8.45 4.53 0.00 4.00 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 32 Y 7.54 4.75 0.00 3.06 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 33 A 8.65 4.68 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 34 M 8.65 5.19 0.00 1.83 1.85 0.00 0.00 0.00 0.00 0.00 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.43 2.47 0.00 35 H 9.17 5.46 0.00 2.88 3.21 0.00 5.76 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 W 9.21 5.21 0.00 3.20 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 37 V 9.09 5.04 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 0.79 0.00 0.00 1.05 0.00 0.00 38 R 9.33 5.00 0.00 0.88 1.05 0.00 2.34 0.00 0.00 2.91 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.30 0.00 39 Q 8.77 4.77 0.00 2.09 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 7.01 0.00 0.00 0.00 0.00 0.00 2.23 2.43 0.00 40 A 8.59 4.65 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 41 P 0.00 4.26 0.00 2.20 2.12 0.00 3.91 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 2.01 2.00 0.00 42 G 9.03 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 43 K 7.91 4.66 0.00 1.87 1.73 0.00 1.85 0.00 0.00 1.73 0.00 0.00 3.00 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.39 1.39 7.81 44 G 8.42 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 45 L 7.64 4.05 0.00 0.33 0.22 -0.25 0.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.41 0.00 0.00 0.00 0.00 0.00 0.00 46 E 9.11 4.73 0.00 1.91 1.69 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 2.26 2.29 0.00 47 W 9.39 4.54 0.00 3.56 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 48 V 8.24 4.04 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 1.04 0.00 0.00 0.98 0.00 0.00 49 A 6.53 4.59 1.13 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 50 V 9.23 4.92 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 1.46 0.00 0.00 0.70 0.00 0.00 51 I 8.49 5.05 1.91 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 1.28 1.45 0.94 0.00 0.00 52 S 8.97 4.74 0.00 3.94 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 53 Y 9.33 4.58 0.00 3.15 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 54 D 7.01 4.37 0.00 2.58 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 0.00 0.00 0.00 0.00 55 G 7.95 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 56 S 7.99 4.13 0.00 4.02 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 0.00 57 N 7.88 5.19 0.00 2.57 2.83 0.00 0.00 6.61 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 58 K 7.82 4.92 0.00 1.39 1.64 0.00 1.73 0.00 0.00 1.72 0.00 0.00 3.02 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.21 1.50 7.81 59 Y 8.97 5.07 0.00 3.45 3.35 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 60 Y 9.09 5.19 0.00 2.86 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 61 A 9.18 4.46 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 62 D 9.15 4.47 0.00 2.88 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 63 S 8.16 4.17 0.00 3.91 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 64 V 7.46 3.91 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 0.30 0.00 0.00 0.85 0.00 0.00 65 K 7.43 3.95 0.00 1.79 1.74 0.00 1.82 0.00 0.00 1.82 0.00 0.00 3.33 0.00 0.00 3.20 0.00 0.00 0.00 0.00 1.61 1.70 7.81 66 G 8.70 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 67 R 7.66 4.59 0.00 1.81 2.23 0.00 3.11 0.00 0.00 3.31 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.74 0.00 68 F 8.03 5.41 0.00 2.84 2.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 69 T 8.79 4.76 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 1.28 0.00 0.00 70 I 8.94 4.94 1.99 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 1.45 1.33 0.77 0.00 0.00 71 S 8.97 5.03 0.00 4.00 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 72 R 8.61 5.19 0.00 2.16 2.01 0.00 2.97 0.00 0.00 3.20 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.74 0.00 73 D 9.71 4.93 0.00 3.01 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 74 N 9.00 4.77 0.00 2.84 2.98 0.00 0.00 7.19 7.57 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 75 S 7.92 4.28 0.00 4.04 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 76 K 8.06 4.20 0.00 1.76 1.85 0.00 2.07 0.00 0.00 1.75 0.00 0.00 2.99 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.39 1.59 7.81 77 N 7.98 3.32 0.00 2.57 2.31 0.00 0.00 6.66 6.58 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 78 T 7.17 4.67 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.54 0.00 0.00 79 L 8.50 5.18 0.00 1.95 1.50 1.12 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 80 Y 9.73 5.58 0.00 2.92 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 81 L 8.45 4.58 0.00 0.27 0.31 0.89 0.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.40 0.00 0.00 0.00 0.00 0.00 0.00 82 Q 8.94 4.43 0.00 2.09 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.63 6.55 0.00 0.00 0.00 0.00 0.00 2.21 2.34 0.00 83 M 8.88 3.93 0.00 0.70 1.37 0.00 0.00 0.00 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 1.13 0.00 84 N 8.97 5.01 0.00 2.64 2.68 0.00 0.00 7.23 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 85 S 8.55 3.70 0.00 4.00 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 86 L 7.72 4.30 0.00 1.91 1.61 0.92 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 87 R 8.73 4.87 0.00 1.90 1.83 0.00 3.09 0.00 0.00 3.17 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.55 0.00 88 A 8.58 4.09 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 89 E 8.09 4.13 0.00 2.07 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 2.41 0.00 90 D 7.91 4.68 0.00 3.04 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 91 T 7.79 4.36 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 1.29 0.00 0.00 92 A 8.47 4.41 0.98 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 93 V 8.33 4.29 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 0.46 0.00 0.00 0.91 0.00 0.00 94 Y 9.19 4.96 0.00 2.93 3.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 Y 9.58 5.50 0.00 3.19 3.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 96 C 8.95 4.08 0.00 2.16 1.51 0.00 0.00 0.00 0.00 0.00 0.00 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0.00 0.00 0.00 0.00 0.00 105 D 8.43 4.94 0.00 2.59 2.83 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 0.00 106 Y 7.63 4.98 0.00 2.72 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 0.00 107 W 9.09 5.22 0.00 3.01 3.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 108 G 9.13 4.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 Q 8.83 4.28 0.00 2.27 2.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.42 0.00 0.00 0.00 0.00 0.00 2.39 2.35 0.00 110 G 8.33 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 0.00 111 T 8.40 4.64 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 1.26 0.00 0.00 112 L 8.57 4.49 0.00 1.80 1.58 1.00 0.84 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 0.00 113 V 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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 1.24 0.00 0.00 136 L 8.48 5.12 0.00 1.64 1.49 0.84 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 137 T 8.83 4.73 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 1.25 0.00 0.00 138 Q 8.73 5.07 0.00 1.99 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.51 6.67 0.00 0.00 0.00 0.00 0.00 2.37 2.38 0.00 139 S 8.78 4.82 0.00 3.90 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 140 P 0.00 4.89 0.00 2.33 2.13 0.00 3.80 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 2.13 1.97 0.00 141 A 8.51 4.35 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 0.00 142 T 7.73 5.16 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 1.23 0.00 0.00 143 L 9.33 4.76 0.00 1.56 1.60 0.95 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 144 S 8.83 5.22 0.00 3.73 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 0.00 145 L 8.99 5.06 0.00 1.72 1.70 0.97 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 146 S 8.84 5.09 0.00 3.80 3.76 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.50 0.00 2.11 2.12 0.00 3.71 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 2.15 2.48 0.00 148 G 9.55 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 0.00 149 E 7.79 4.59 0.00 2.04 1.85 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 2.24 2.32 0.00 150 R 8.33 4.85 0.00 1.73 1.73 0.00 3.12 0.00 0.00 3.13 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.47 0.00 151 A 8.71 4.67 1.03 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 0.00 152 T 8.45 4.73 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 1.15 0.00 0.00 153 L 8.53 4.72 0.00 1.31 1.63 0.60 0.70 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 0.00 154 S 8.96 5.42 0.00 4.03 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 0.00 155 C 9.30 5.43 0.00 3.00 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 0.00 156 R 9.27 5.31 0.00 2.00 1.91 0.00 3.41 0.00 0.00 3.21 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.64 0.00 157 A 9.15 5.09 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 158 S 8.79 4.44 0.00 3.93 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 0.00 159 Q 7.82 4.65 0.00 2.14 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.93 0.00 0.00 0.00 0.00 0.00 2.23 2.32 0.00 160 S 8.68 4.26 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 0.00 161 V 9.15 4.41 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 0.75 0.00 0.00 1.08 0.00 0.00 162 R 7.37 3.54 0.00 2.03 1.10 0.00 3.13 0.00 0.00 3.23 7.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.58 0.00 163 S 8.77 4.91 0.00 4.11 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 0.00 164 N 8.25 5.27 0.00 2.92 2.83 0.00 0.00 6.62 6.25 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 0.00 165 L 7.71 5.05 0.00 0.84 1.04 0.21 0.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 166 A 9.10 4.95 0.82 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 0.00 0.00 167 W 8.54 5.20 0.00 3.02 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 0.00 168 Y 9.54 5.12 0.00 2.96 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 0.00 169 Q 9.03 4.49 0.00 2.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.74 0.00 0.00 0.00 0.00 0.00 1.96 1.66 0.00 170 Q 8.92 4.61 0.00 2.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.74 0.00 0.00 0.00 0.00 0.00 2.21 2.34 0.00 171 K 8.50 4.51 0.00 1.70 1.70 0.00 1.77 0.00 0.00 1.79 0.00 0.00 3.01 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.47 1.40 7.81 172 P 0.00 4.28 0.00 2.05 2.05 0.00 3.78 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 2.05 2.12 0.00 173 G 8.91 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 0.00 174 Q 8.03 4.57 0.00 2.12 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.83 0.00 0.00 0.00 0.00 0.00 2.34 2.48 0.00 175 A 8.21 3.93 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176 P 0.00 4.23 0.00 0.49 1.19 0.00 2.20 0.00 0.00 2.43 0.00 0.00 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0.00 0.00 0.00 0.00 0.00 185 T 8.19 4.41 4.47 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 1.29 0.00 0.00 186 R 8.58 4.37 0.00 1.67 1.80 0.00 3.43 0.00 0.00 3.22 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.59 0.00 187 A 8.82 4.48 0.98 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 0.00 188 T 8.39 3.92 4.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 189 G 9.11 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 0.00 190 I 7.16 3.98 1.83 0.00 0.00 0.50 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 0.76 0.56 0.00 0.00 191 P 0.00 4.50 0.00 2.30 2.24 0.00 3.64 0.00 0.00 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.37 2.06 0.00 192 D 8.48 4.70 0.00 2.80 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 0.00 193 R 7.86 4.02 0.00 1.87 2.12 0.00 2.90 0.00 0.00 3.20 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.18 0.00 194 F 7.89 4.79 0.00 2.78 2.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 195 S 9.07 4.65 0.00 3.77 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 196 G 8.52 4.63 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 0.00 197 S 9.23 4.73 0.00 3.87 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 0.00 198 G 8.11 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 0.00 199 S 7.77 4.68 0.00 3.83 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 200 G 9.60 4.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 201 T 9.26 4.73 4.48 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 1.24 0.00 0.00 202 D 7.47 5.18 0.00 2.65 2.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 203 F 9.18 5.52 0.00 3.39 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 0.00 204 T 9.25 5.28 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 1.25 0.00 0.00 205 L 8.23 4.51 0.00 0.27 0.14 0.61 0.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.70 0.00 0.00 0.00 0.00 0.00 0.00 206 T 8.70 4.65 4.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.00 0.00 207 I 8.26 4.13 1.39 0.00 0.00 0.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.43 0.25 0.02 0.00 0.00 208 S 8.60 4.34 0.00 3.60 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 209 R 8.42 3.44 0.00 1.92 2.04 0.00 2.98 0.00 0.00 3.17 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.53 0.00 210 L 8.60 3.91 0.00 1.57 1.18 0.89 0.31 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 0.00 211 E 8.75 4.99 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 2.19 2.31 0.00 212 P 0.00 4.60 0.00 2.25 2.25 0.00 3.63 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 2.18 2.25 0.00 213 E 8.09 4.30 0.00 1.98 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 2.34 2.43 0.00 214 D 7.99 4.66 0.00 2.24 2.57 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 0.00 215 F 7.48 4.69 0.00 3.05 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 0.00 216 A 8.40 4.31 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 217 V 7.87 4.34 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 0.34 0.00 0.00 0.89 0.00 0.00 218 Y 9.14 5.16 0.00 3.07 3.12 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 0.00 219 Y 9.33 5.42 0.00 3.03 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 0.00 220 C 8.72 4.41 0.00 1.78 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 221 Q 8.76 4.77 0.00 2.05 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.81 0.00 0.00 0.00 0.00 0.00 1.73 1.16 0.00 222 Q 8.57 5.09 0.00 2.08 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.36 0.00 0.00 0.00 0.00 0.00 2.14 2.31 0.00 223 R 8.40 4.29 0.00 1.59 1.83 0.00 2.64 0.00 0.00 2.25 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 1.26 0.00 224 S 8.20 4.20 0.00 3.95 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 225 N 8.60 4.82 0.00 2.73 2.79 0.00 0.00 6.96 7.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 226 W 8.68 4.10 0.00 3.24 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 0.00 227 P 0.00 2.97 0.00 1.65 0.83 0.00 3.69 0.00 0.00 3.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.83 0.00 228 P 0.00 4.32 0.00 1.41 1.66 0.00 2.20 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.80 1.52 0.00 229 T 8.24 4.81 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 1.24 0.00 0.00 230 F 8.96 5.22 0.00 3.02 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 0.00 231 G 8.88 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 232 Q 8.74 4.46 0.00 2.08 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.60 0.00 0.00 0.00 0.00 0.00 2.35 2.49 0.00 233 G 8.57 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 234 T 8.51 4.79 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 1.31 0.00 0.00 235 K 9.11 4.72 0.00 1.83 1.71 0.00 1.63 0.00 0.00 1.75 0.00 0.00 2.83 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.43 1.40 7.81 236 V 9.36 4.75 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 1.08 0.00 0.00 1.01 0.00 0.00 237 E 9.34 4.64 0.00 1.91 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 0.00 2.27 2.27 0.00 238 V 7.73 3.26 1.76 0.00 0.00 0.00 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 -0.14 0.00 0.00 239 K 8.68 4.13 0.00 1.86 1.69 0.00 1.84 0.00 0.00 1.89 0.00 0.00 2.88 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.42 1.40 7.81 240 S 8.55 4.25 0.00 3.87 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 0.00 241 G 10.04 3.54 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 0.00 0.00 0.00 242 L 7.46 4.18 0.00 1.54 1.53 0.91 0.91 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 0.00 243 V 8.01 4.17 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 0.91 0.00 0.00 0.92 0.00 0.00 244 P 0.00 4.62 0.00 2.19 2.03 0.00 3.96 0.00 0.00 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 1.91 0.00 245 R 8.68 4.07 0.00 1.90 1.88 0.00 3.31 0.00 0.00 3.26 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.66 0.00 * Residues marked with a * may have inaccurate shift predictions.