NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 5 R 4.0850 8.2549 119.6409 54.3486 32.6971 174.4279 6 H 4.5391 7.0656 117.2287 53.5377 31.5125 173.3649 7 F 5.0856 8.4324 120.9368 55.9614 43.6572 173.7140 8 V 4.7043 8.2285 122.3640 61.6767 35.4277 173.9267 9 V 4.8907 8.3920 116.0474 59.9188 35.6496 175.1547 10 Q 4.6213 9.1436 120.5107 54.4595 33.5107 173.9707 11 F 5.0400 8.9598 125.2002 56.7552 41.3946 174.3252 12 Q 4.1174 8.1420 125.8971 53.2843 30.0667 172.8199 13 P 4.9115 0.0000 0.0000 61.6327 32.9626 175.4242 14 F 4.5695 9.2184 122.1909 55.8339 42.4000 173.3885 15 C 4.7799 8.6855 121.9310 55.4766 42.2510 172.7203 16 Y 4.3249 8.3487 122.6846 57.0775 38.5466 175.0455 17 F 5.2594 8.7202 123.0233 56.4206 41.9932 175.9528 18 T 4.3959 8.2558 117.7909 62.9631 72.9249 173.1932 19 N 4.3545 9.6339 125.1737 54.3901 35.9859 174.2462 20 G 3.7976 7.5599 111.7625 46.5675 0.0000 173.3674 21 T 4.5473 7.9678 107.0200 61.2935 68.2048 175.0926 22 Q 4.2059 6.9635 120.2759 57.8005 30.6949 177.3717 23 R 4.4091 7.8100 122.1825 55.3639 27.9940 175.2710 24 I 4.2016 7.5273 121.1834 60.8778 38.9389 176.7310 25 R 4.4830 8.9109 127.4949 54.4693 31.9552 172.6910 26 Y 5.1369 8.5454 127.5674 57.1750 40.1815 174.1054 27 V 5.5847 9.2924 125.7027 60.9211 36.2880 174.8009 28 T 4.6710 8.3852 119.5041 63.1788 71.4966 173.2498 29 R 5.1787 9.0344 126.5880 55.3539 32.7899 175.5313 30 Y 4.8409 8.7840 118.8108 56.4531 41.1971 174.7746 31 I 5.3695 9.1631 125.2151 59.6538 41.5047 174.1870 32 Y 5.2051 8.9750 125.4206 55.7185 41.5827 175.1816 33 N 3.9133 9.6410 126.7808 54.8190 38.3272 176.3476 34 R 4.6760 8.5539 122.6848 55.7304 30.0778 175.4000 35 E 4.6781 8.2651 119.2042 54.7255 33.0534 173.8236 36 E 4.8315 8.8533 124.8190 56.6119 30.8737 175.9101 37 Y 5.0216 8.8485 116.1019 56.5536 40.9843 174.1896 38 L 5.1056 7.3013 121.0826 53.9296 46.2975 174.4003 39 R 5.3087 8.6134 122.2140 55.4254 34.4467 173.3570 40 F 4.5159 9.2464 128.2511 56.4646 41.6133 173.4037 41 D 4.9315 7.7252 126.7541 52.2434 42.3610 176.3852 42 S 4.0421 9.4162 122.7205 61.6887 62.6096 176.3159 43 D 4.2845 9.0157 119.5823 56.5448 40.4188 177.2034 44 V 3.8938 8.1082 117.4648 61.7850 32.0653 176.1473 45 G 3.8968 7.1704 105.5518 46.2317 0.0000 172.4612 46 E 4.5237 6.7647 115.2217 54.5852 32.8094 174.5063 47 Y 5.1358 8.3047 120.6048 58.1406 38.7141 175.5428 48 R 4.8026 8.4905 118.7587 55.0525 35.0732 173.6286 49 A 4.6820 8.5345 123.7448 51.2776 19.5912 177.3945 50 V 4.1575 8.3738 122.2952 64.4391 32.9102 175.7971 51 T 4.7754 7.7122 108.5165 58.5202 72.3084 173.8237 52 E 3.8865 9.0584 121.8064 59.8553 29.1268 178.7758 53 L 4.0214 8.1018 116.5079 57.0983 41.8317 178.6568 54 G 4.0189 8.5142 105.5037 45.8998 0.0000 175.6823 55 R 3.9051 7.8442 121.3980 59.3429 29.8563 176.4880 56 P 4.3284 0.0000 0.0000 64.5679 31.6952 176.8906 57 D 4.8014 8.0445 117.0801 54.4295 42.6320 177.7132 58 A 3.2706 7.8482 113.4314 54.7579 18.7718 178.4882 59 E 3.8429 9.0512 119.7600 58.5727 30.3402 177.7123 60 Y 4.2253 7.9928 118.7084 61.0857 38.7312 177.6809 61 Y 3.7554 7.6452 116.0144 61.0409 37.9232 177.8296 62 N 4.6964 7.7606 116.4559 56.2153 38.6730 177.1067 63 K 4.1226 7.6242 118.5980 58.7703 32.5155 178.6735 64 Q 3.5706 7.4337 120.0331 58.0626 28.8135 176.6077 *67 Y 4.9059 7.5130 116.1627 56.5904 39.7223 177.0269 68 L 4.1676 8.1465 124.2696 59.3630 41.9966 177.3492 69 E 4.0089 8.2414 118.8376 59.2401 29.3385 178.8619 70 R 4.0941 7.7943 117.0863 59.1272 30.6485 178.6420 71 T 3.7926 8.0350 115.5864 66.6894 68.4331 176.8391 72 R 4.0910 8.0214 119.6994 59.5024 30.1290 178.8050 73 A 4.0847 7.7414 119.0018 55.4535 18.2475 179.5812 74 E 4.5798 8.2090 118.1324 58.7119 29.4167 178.8665 75 L 3.8008 8.2122 119.7702 57.2652 41.6885 177.8803 76 D 4.8507 8.1006 116.4938 55.3260 43.5630 177.3812 77 T 4.1088 7.9129 107.9588 62.1781 69.0146 174.6676 78 V 4.3780 7.8386 120.8588 63.5287 34.6911 176.8984 79 C 4.2178 7.6729 114.1858 59.7880 39.6868 175.8225 80 R 3.9601 7.1332 122.3432 60.3742 30.3533 177.3332 81 Y 4.1342 7.8613 118.3293 60.8524 38.3725 177.5752 82 N 4.1869 8.9593 117.6665 57.2074 38.5424 175.9681 83 Y 3.6299 8.2852 120.2780 61.5555 38.4358 178.1114 84 E 4.0788 8.7835 121.6531 58.5927 29.8525 178.2072 84A E 4.1771 8.3739 118.7982 57.0726 30.4297 176.8611 85 T 4.3180 8.5839 108.4192 62.6862 70.6274 176.1864 86 E 3.9050 7.8123 120.6838 59.1713 29.4379 178.9375 87 V 3.3619 7.2277 117.8956 65.3535 31.4641 175.0154 88 P 4.6356 0.0000 0.0000 62.7965 32.6849 175.3886 89 T 4.2128 8.4481 107.6398 62.0966 70.1277 175.9604 90 S 4.2194 8.9844 117.2148 61.1417 63.8309 175.8862 91 L 4.2688 7.7201 117.6356 56.1468 41.9117 177.5509 92 R 4.1779 7.8254 117.7243 57.5833 30.7501 176.6020 93 R 3.8799 7.8180 117.5678 56.9142 30.2517 175.3207 94 L 5.2009 8.4824 123.9248 53.0361 45.3818 175.5757 95 E 4.7547 9.2068 121.8971 54.5341 33.0779 175.2005 96 Q 5.1036 9.1321 124.3127 54.6129 29.5198 174.6199 97 P 4.9097 0.0000 0.0000 62.9901 32.8160 174.9696 98 N 4.9702 9.2096 119.1091 51.7753 40.7644 174.0945 99 V 4.8539 8.4086 123.0122 61.2248 33.9052 174.9464 100 V 4.6681 8.8014 120.3344 59.6595 35.8861 174.5124 101 I 5.2027 8.5192 124.0202 59.8131 39.7329 174.9698 102 S 4.8041 8.9514 119.2849 56.8949 67.0435 172.1395 103 L 4.7968 8.2542 122.3623 53.3916 43.1006 176.2819 104 S 4.3131 8.8666 123.0005 61.0859 63.2180 174.8018 105 R 4.6774 8.4053 116.4649 53.8178 32.8423 175.7957 106 T 3.9953 8.2279 115.8869 63.4618 68.9666 174.2978 107 E 4.0708 8.6314 125.1707 57.0586 30.1305 175.5237 108 A 4.5206 8.0954 125.0098 52.0977 21.8501 176.1334 109 L 4.5070 8.2274 117.5831 55.1738 42.1111 177.4025 110 N 4.6020 7.5699 113.8278 54.3783 41.7339 173.4763 111 H 4.5632 8.0772 114.8552 55.8540 29.6002 174.3324 112 H 4.4710 8.7534 124.3407 56.0736 30.5176 173.5895 113 N 5.1849 8.6069 125.1907 52.5585 42.9312 172.1453 114 T 4.6923 7.9360 113.7621 62.1829 72.6068 173.4208 115 L 4.2208 7.8734 127.1390 54.1301 43.3822 176.3344 116 V 4.6062 8.9433 122.9358 61.3799 34.6033 173.5867 117 C 4.9704 9.6448 129.8666 55.4408 45.4503 172.5037 118 S 4.6022 8.9935 124.4012 57.9525 63.7893 173.9211 119 V 4.8986 8.8679 126.9187 61.5237 32.9064 174.3799 120 T 5.0990 8.8781 118.1324 59.2614 72.7633 173.1448 121 D 4.5499 8.5528 118.0258 55.4322 38.6948 173.6976 122 F 5.2930 7.1255 111.9087 55.9698 41.4482 173.9854 123 Y 5.1926 8.6006 117.4310 56.1772 42.3704 172.3856 124 P 3.6687 0.0000 0.0000 61.8469 32.8764 176.7662 125 A 3.4965 8.0950 121.4821 54.1000 18.2409 177.8457 126 K 3.8617 7.0108 118.2382 56.8815 32.3393 175.6084 127 I 4.6080 7.7143 124.7926 59.8555 41.3070 173.5090 128 K 4.4941 8.7246 127.3910 54.7817 35.2774 174.9023 129 V 4.8914 8.4627 126.9918 61.1980 33.9973 174.7672 130 R 4.7309 9.2297 125.6440 54.3824 34.8148 174.0754 131 W 5.2885 8.6465 121.8151 55.5622 31.7709 175.2146 132 F 5.3822 9.9486 121.5203 55.8254 43.1214 173.5682 133 R 4.5464 9.2572 123.4333 55.1277 32.3533 175.4209 134 N 4.2634 10.3992 124.6659 54.3298 36.9068 175.3936 135 G 4.0673 8.7498 106.1694 45.1030 0.0000 174.3151 136 Q 4.8574 8.2801 119.2498 53.3700 31.3365 174.7074 137 E 3.7103 8.8229 119.4419 56.1069 29.4270 176.6835 138 E 4.0229 8.4808 125.2878 56.7790 30.1788 178.0221 139 T 4.6738 8.2203 115.1217 60.3082 68.0822 172.7520 140 V 4.2934 6.9596 120.2709 63.1213 36.3191 175.0704 141 G 4.1641 7.6608 106.2388 45.8176 0.0000 171.9739 142 V 4.9518 7.6069 118.7278 61.4982 33.8499 175.0344 143 S 4.8802 8.8464 119.5351 57.8127 66.5881 172.9853 144 S 5.1813 8.2849 114.2336 57.2043 65.7149 173.7717 145 T 4.3037 8.6161 111.9734 61.2808 69.6084 174.3543 146 Q 4.2314 8.4909 121.3880 55.2661 29.5101 175.9414 147 L 4.2038 8.3377 121.9781 55.6102 42.8496 175.9407 148 I 4.5397 9.0151 127.3698 59.6730 39.6975 174.4147 149 R 4.7035 8.5063 127.0465 54.8913 30.5803 175.9051 150 N 4.3372 8.5891 124.3835 54.1611 38.8390 176.5340 151 G 3.8668 8.1023 106.0124 45.4227 0.0000 173.3105 152 D 4.9198 7.4508 117.2371 52.7381 39.7635 175.8082 153 W 3.3488 8.4062 116.5611 58.1243 25.9826 173.8560 154 T 4.9558 7.3848 105.5647 60.2399 72.3259 172.3999 155 F 5.2410 8.8358 121.0768 55.7976 43.2507 173.9435 156 Q 5.2982 8.8663 117.0430 55.2886 32.4674 174.0524 157 V 4.8892 9.1315 119.1613 60.6161 35.4037 172.8525 158 L 5.1953 8.8589 123.7233 52.9921 44.4499 175.4339 159 V 4.7551 8.6136 123.8681 61.5627 33.9371 174.3100 160 M 4.9828 9.3311 128.6024 54.2754 34.4986 175.2444 161 L 4.7705 8.2530 123.3368 53.0760 45.2427 175.2044 162 E 4.4485 8.9455 127.3383 56.5368 30.3898 176.1015 163 M 4.4394 7.8485 120.0921 55.3117 35.1846 173.2831 164 T 4.7872 8.0865 115.2999 61.5325 72.3959 172.2238 165 P 4.6256 0.0000 0.0000 63.1870 32.2190 176.1585 166 R 4.6894 8.5668 119.3059 54.4526 34.1736 174.8340 167 R 4.0756 8.6051 121.6057 58.0441 30.5316 177.1437 168 G 4.0045 8.8582 109.1592 45.3424 0.0000 173.3436 169 E 4.5350 7.8533 119.7837 55.6810 31.1878 175.6985 170 V 4.7447 9.0523 124.1822 61.3981 34.3885 173.5663 171 Y 5.4044 9.6360 126.1792 56.7715 40.5274 174.8810 172 T 5.2778 9.6333 120.4666 61.9758 72.5768 171.9893 173 C 4.4880 9.0219 126.4474 55.1755 40.7561 171.5148 174 H 5.4906 9.5610 127.5512 54.4658 32.0559 173.2716 175 V 4.8326 8.5458 124.8379 61.2798 35.0700 173.5256 176 E 4.9521 9.1085 127.1909 54.8785 32.7526 174.5308 177 H 4.9482 8.4668 121.8573 54.0304 33.2057 172.2816 178 P 4.3940 0.0000 0.0000 65.5911 31.5403 178.0721 179 S 4.3256 8.3094 111.7615 59.8453 63.4003 173.3602 180 L 4.8514 7.9148 122.5587 53.1865 42.6519 176.7396 181 K 4.1271 8.8314 123.6528 58.8291 32.3634 177.3751 182 S 4.6565 7.5917 110.7730 55.2364 65.1118 171.3819 183 P 4.4708 0.0000 0.0000 63.3260 32.1345 175.1918 184 I 4.6120 8.5050 122.1213 59.9591 39.6203 175.0884 185 T 5.0488 8.3269 115.0810 59.9535 71.6575 173.1425 186 V 4.4457 8.6714 124.8138 61.1824 34.3907 174.3335 187 E 5.3162 8.9307 126.8406 55.1904 31.8299 175.1854 188 W 5.2628 9.2771 130.8114 56.2033 34.6255 173.8300 189 R 5.0154 7.5700 123.8745 52.5533 33.5013 175.0570 190 A 4.0904 8.4739 122.8722 52.2625 17.9491 177.3901 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 5 R 8.25 4.09 0.00 1.46 1.35 0.00 3.03 0.00 0.00 3.08 7.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 1.54 0.00 6 H 7.07 4.54 0.00 3.02 3.04 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 7 F 8.43 5.09 0.00 3.06 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 8 V 8.23 4.70 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 0.98 0.00 0.00 0.91 0.00 0.00 9 V 8.39 4.89 2.28 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 1.08 0.00 0.00 1.06 0.00 0.00 10 Q 9.14 4.62 0.00 2.04 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.74 0.00 0.00 0.00 0.00 0.00 2.32 2.36 0.00 11 F 8.96 5.04 0.00 2.74 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 12 Q 8.14 4.12 0.00 2.18 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.69 0.00 0.00 0.00 0.00 0.00 2.16 2.25 0.00 13 P 0.00 4.91 0.00 1.93 1.57 0.00 3.10 0.00 0.00 2.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.66 0.00 14 F 9.22 4.57 0.00 3.00 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 0.00 0.00 0.00 0.00 15 C 8.69 4.78 0.00 2.64 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 0.00 0.00 0.00 16 Y 8.35 4.32 0.00 3.00 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 17 F 8.72 5.26 0.00 3.12 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 18 T 8.26 4.40 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 19 N 9.63 4.35 0.00 2.98 2.89 0.00 0.00 7.00 8.12 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 20 G 7.56 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 T 7.97 4.55 4.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.75 0.00 0.00 22 Q 6.96 4.21 0.00 2.48 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 7.38 0.00 0.00 0.00 0.00 0.00 2.32 2.42 0.00 23 R 7.81 4.41 0.00 1.83 1.88 0.00 3.26 0.00 0.00 3.23 7.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.60 0.00 24 I 7.53 4.20 1.92 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.71 0.87 0.00 0.00 25 R 8.91 4.48 0.00 1.85 1.82 0.00 2.98 0.00 0.00 2.86 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.66 0.00 26 Y 8.55 5.14 0.00 3.08 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 27 V 9.29 5.58 2.42 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 1.22 0.00 0.00 1.02 0.00 0.00 28 T 8.39 4.67 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 1.91 0.00 0.00 29 R 9.03 5.18 0.00 1.90 1.95 0.00 3.25 0.00 0.00 3.24 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.82 0.00 30 Y 8.78 4.84 0.00 2.62 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 0.00 0.00 0.00 0.00 31 I 9.16 5.37 2.11 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 1.22 0.79 1.17 0.00 0.00 32 Y 8.97 5.21 0.00 3.04 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 33 N 9.64 3.91 0.00 2.50 1.84 0.00 0.00 6.82 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 R 8.55 4.68 0.00 1.73 1.86 0.00 3.24 0.00 0.00 3.16 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.60 0.00 35 E 8.27 4.68 0.00 2.04 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 2.39 2.36 0.00 36 E 8.85 4.83 0.00 2.19 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.37 0.00 37 Y 8.85 5.02 0.00 3.08 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 38 L 7.30 5.11 0.00 1.43 1.06 0.83 -0.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 39 R 8.61 5.31 0.00 1.96 1.76 0.00 3.08 0.00 0.00 3.09 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.66 0.00 40 F 9.25 4.52 0.00 2.37 2.66 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 41 D 7.73 4.93 0.00 2.62 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 S 9.42 4.04 0.00 4.15 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 43 D 9.02 4.28 0.00 2.92 2.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 V 8.11 3.89 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 0.87 0.00 0.00 0.83 0.00 0.00 45 G 7.17 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 46 E 6.76 4.52 0.00 1.89 1.80 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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 0.00 74 E 8.21 4.58 0.00 2.57 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 0.00 2.38 2.50 0.00 75 L 8.21 3.80 0.00 2.18 2.02 1.17 1.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 76 D 8.10 4.85 0.00 2.91 2.69 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 77 T 7.91 4.11 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 1.21 0.00 0.00 78 V 7.84 4.38 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 0.92 0.00 0.00 0.95 0.00 0.00 79 C 7.67 4.22 0.00 3.23 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 80 R 7.13 3.96 0.00 1.93 2.08 0.00 3.29 0.00 0.00 3.15 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.81 0.00 81 Y 7.86 4.13 0.00 3.31 3.23 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 82 N 8.96 4.19 0.00 3.03 2.88 0.00 0.00 6.72 8.11 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 83 Y 8.29 3.63 0.00 2.64 2.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 84 E 8.78 4.08 0.00 2.12 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.43 2.38 0.00 84A E 8.37 4.18 0.00 1.16 1.12 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 1.48 2.00 0.00 85 T 8.58 4.32 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 1.09 0.00 0.00 86 E 7.81 3.91 0.00 1.57 1.63 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 2.36 1.98 0.00 87 V 7.23 3.36 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 0.73 0.00 0.00 0.96 0.00 0.00 88 P 0.00 4.64 0.00 2.15 2.07 0.00 3.73 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.85 0.00 89 T 8.45 4.21 4.05 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 1.14 0.00 0.00 90 S 8.98 4.22 0.00 4.01 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 0.00 91 L 7.72 4.27 0.00 1.54 1.67 0.34 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 92 R 7.83 4.18 0.00 1.91 1.91 0.00 3.25 0.00 0.00 3.12 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.60 0.00 93 R 7.82 3.88 0.00 1.70 1.95 0.00 2.69 0.00 0.00 2.25 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.48 0.00 94 L 8.48 5.20 0.00 1.69 1.61 0.96 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 0.00 0.00 0.00 0.00 0.00 0.00 95 E 9.21 4.75 0.00 2.16 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 2.29 2.47 0.00 96 Q 9.13 5.10 0.00 1.97 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 7.04 0.00 0.00 0.00 0.00 0.00 2.40 2.24 0.00 97 P 0.00 4.91 0.00 2.03 1.92 0.00 3.70 0.00 0.00 3.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 1.78 0.00 98 N 9.21 4.97 0.00 2.69 2.80 0.00 0.00 6.65 7.25 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 99 V 8.41 4.85 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 0.74 0.00 0.00 0.87 0.00 0.00 100 V 8.80 4.67 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 0.70 0.00 0.00 0.97 0.00 0.00 101 I 8.52 5.20 2.10 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 1.43 0.63 1.09 0.00 0.00 102 S 8.95 4.80 0.00 3.89 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 0.00 103 L 8.25 4.80 0.00 1.59 1.58 0.39 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 104 S 8.87 4.31 0.00 3.88 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 0.00 105 R 8.41 4.68 0.00 1.76 1.81 0.00 3.15 0.00 0.00 3.20 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.64 0.00 106 T 8.23 4.00 4.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 107 E 8.63 4.07 0.00 2.03 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.36 2.47 0.00 108 A 8.10 4.52 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 0.00 109 L 8.23 4.51 0.00 1.64 1.72 0.93 0.94 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 0.00 110 N 7.57 4.60 0.00 2.60 2.67 0.00 0.00 7.10 7.89 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 0.00 111 H 8.08 4.56 0.00 3.22 3.20 0.00 5.76 0.00 0.00 0.00 0.00 6.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 112 H 8.75 4.47 0.00 3.17 3.19 0.00 5.49 0.00 0.00 0.00 0.00 6.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 N 8.61 5.18 0.00 2.68 2.43 0.00 0.00 6.53 6.80 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 0.00 114 T 7.94 4.69 4.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 115 L 7.87 4.22 0.00 0.57 1.00 0.07 -1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.38 0.00 0.00 0.00 0.00 0.00 0.00 116 V 8.94 4.61 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 1.01 0.00 0.00 0.91 0.00 0.00 117 C 9.64 4.97 0.00 2.54 2.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 S 8.99 4.60 0.00 3.87 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 119 V 8.87 4.90 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 0.00 0.00 0.86 0.00 0.00 120 T 8.88 5.10 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 1.28 0.00 0.00 121 D 8.55 4.55 0.00 2.87 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 0.00 122 F 7.13 5.29 0.00 3.03 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 0.00 123 Y 8.60 5.19 0.00 3.31 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 0.00 124 P 0.00 3.67 0.00 1.93 1.91 0.00 3.85 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.91 0.00 125 A 8.09 3.50 0.19 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 0.00 126 K 7.01 3.86 0.00 1.80 1.63 0.00 1.78 0.00 0.00 1.53 0.00 0.00 2.81 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.38 1.46 7.81 127 I 7.71 4.61 1.43 0.00 0.00 -0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 0.61 0.76 0.00 0.00 128 K 8.72 4.49 0.00 1.79 1.54 0.00 1.63 0.00 0.00 1.57 0.00 0.00 3.06 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.31 1.34 7.81 129 V 8.46 4.89 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.75 0.00 0.00 0.81 0.00 0.00 130 R 9.23 4.73 0.00 1.77 1.57 0.00 3.19 0.00 0.00 3.23 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.67 0.00 131 W 8.65 5.29 0.00 3.26 3.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 132 F 9.95 5.38 0.00 3.04 2.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 133 R 9.26 4.55 0.00 2.10 1.78 0.00 3.49 0.00 0.00 3.20 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.85 0.00 134 N 10.40 4.26 0.00 2.74 2.80 0.00 0.00 7.35 5.56 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 0.00 135 G 8.75 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 0.00 0.00 0.00 0.00 136 Q 8.28 4.86 0.00 2.11 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.08 6.91 0.00 0.00 0.00 0.00 0.00 2.32 2.44 0.00 137 E 8.82 3.71 0.00 1.75 1.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 2.23 0.00 138 E 8.48 4.02 0.00 2.04 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 2.52 2.53 0.00 139 T 8.22 4.67 4.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 140 V 6.96 4.29 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 0.80 0.00 0.00 0.92 0.00 0.00 141 G 7.66 4.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 142 V 7.61 4.95 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 1.05 0.00 0.00 0.93 0.00 0.00 143 S 8.85 4.88 0.00 3.91 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 0.00 144 S 8.28 5.18 0.00 4.02 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 T 8.62 4.30 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 1.24 0.00 0.00 146 Q 8.49 4.23 0.00 2.09 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.43 6.95 0.00 0.00 0.00 0.00 0.00 2.38 2.30 0.00 147 L 8.34 4.20 0.00 1.64 1.58 1.12 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 148 I 9.02 4.54 2.05 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.98 0.93 0.00 0.00 149 R 8.51 4.70 0.00 1.95 1.83 0.00 3.17 0.00 0.00 3.07 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.28 0.00 150 N 8.59 4.34 0.00 2.91 2.77 0.00 0.00 7.16 7.69 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 0.00 151 G 8.10 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 0.00 152 D 7.45 4.92 0.00 2.77 2.69 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 0.00 153 W 8.41 3.35 0.00 3.22 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 0.00 154 T 7.38 4.96 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 1.21 0.00 0.00 155 F 8.84 5.24 0.00 1.69 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 0.00 156 Q 8.87 5.30 0.00 2.16 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.11 6.71 0.00 0.00 0.00 0.00 0.00 2.24 2.35 0.00 157 V 9.13 4.89 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 0.81 0.00 0.00 1.03 0.00 0.00 158 L 8.86 5.20 0.00 1.67 1.65 0.96 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 159 V 8.61 4.76 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.96 0.00 0.00 160 M 9.33 4.98 0.00 1.94 1.94 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.51 0.00 161 L 8.25 4.77 0.00 0.27 0.13 0.65 0.43 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 0.00 162 E 8.95 4.45 0.00 1.84 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 2.37 2.36 0.00 163 M 7.85 4.44 0.00 1.74 1.81 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 1.58 0.00 164 T 8.09 4.79 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 1.30 0.00 0.00 165 P 0.00 4.63 0.00 2.54 2.43 0.00 3.98 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.09 0.00 166 R 8.57 4.69 0.00 2.29 1.86 0.00 3.42 0.00 0.00 3.38 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.98 0.00 167 R 8.61 4.08 0.00 1.80 1.89 0.00 3.23 0.00 0.00 3.22 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.66 0.00 168 G 8.86 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 0.00 0.00 0.00 169 E 7.85 4.54 0.00 2.34 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 0.00 2.21 2.24 0.00 170 V 9.05 4.74 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 1.05 0.00 0.00 0.92 0.00 0.00 171 Y 9.64 5.40 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 0.00 172 T 9.63 5.28 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 1.28 0.00 0.00 173 C 9.02 4.49 0.00 1.98 2.61 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 0.00 174 H 9.56 5.49 0.00 3.44 3.49 0.00 5.78 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 0.00 175 V 8.55 4.83 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 0.82 0.00 0.00 0.78 0.00 0.00 176 E 9.11 4.95 0.00 1.86 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 0.00 2.08 2.16 0.00 177 H 8.47 4.95 0.00 3.06 3.02 0.00 5.88 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 0.00 178 P 0.00 4.39 0.00 1.99 2.06 0.00 2.92 0.00 0.00 3.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 1.97 0.00 179 S 8.31 4.33 0.00 4.10 4.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 180 L 7.91 4.85 0.00 1.75 1.79 0.90 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 181 K 8.83 4.13 0.00 1.74 1.86 0.00 1.69 0.00 0.00 1.63 0.00 0.00 2.98 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.45 1.43 7.81 182 S 7.59 4.66 0.00 3.76 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 0.00 183 P 0.00 4.47 0.00 1.94 1.89 0.00 3.70 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.12 0.00 184 I 8.50 4.61 1.79 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 1.23 0.97 0.87 0.00 0.00 185 T 8.33 5.05 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 1.24 0.00 0.00 186 V 8.67 4.45 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 1.13 0.00 0.00 0.93 0.00 0.00 187 E 8.93 5.32 0.00 1.96 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 2.30 2.33 0.00 188 W 9.28 5.26 0.00 3.58 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 0.00 189 R 7.57 5.02 0.00 1.41 1.58 0.00 3.29 0.00 0.00 3.84 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.40 0.00 190 A 8.47 4.09 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 * Residues marked with a * may have inaccurate shift predictions.