NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- -5 H 4.7680 8.4293 116.3429 55.6700 29.2121 172.3071 -4 H 4.1525 7.8871 113.6011 55.5848 29.8712 172.3436 -3 H 5.0933 9.0649 116.4274 55.8208 29.9384 177.1881 -2 H 5.0439 7.9446 119.2237 55.5629 30.7008 172.3659 -1 H 4.1532 8.6168 121.6795 57.0894 29.3000 175.7686 0 G 4.2072 7.9448 102.4827 45.1282 0.0000 172.5866 1 S 4.2031 8.6362 112.3109 58.0083 63.5863 175.0925 2 A 3.9944 8.6473 130.9237 55.0107 17.7583 179.3363 3 L 3.8617 7.8428 118.3302 58.4720 42.2882 178.7650 4 Q 4.0299 7.8446 117.4255 59.3006 28.6356 179.2848 5 L 4.0161 8.1341 119.9344 57.9095 41.4333 179.8173 6 S 4.1148 8.1526 113.2033 61.2171 62.8646 176.2985 7 R 4.1914 7.3841 120.1600 58.5233 30.2533 178.0403 8 E 4.1145 8.2750 116.5728 56.6329 29.7036 177.6615 9 Q 4.0503 8.2251 123.2858 55.3460 28.1638 174.1146 10 G 3.9279 6.9572 100.9530 45.2439 0.0000 170.4198 11 I 4.3896 7.9981 121.1445 59.8556 38.7762 175.5322 12 T 4.8308 8.1045 115.3487 59.5513 72.4190 174.8918 13 L 3.9718 8.4778 122.9450 58.6157 41.9958 179.3615 14 R 4.2833 8.1885 117.9711 59.5602 30.2976 178.3763 15 G 3.7693 8.2415 105.5804 48.0061 0.0000 175.5140 16 S 4.1849 8.7747 115.4993 61.1791 62.3691 176.0895 17 A 4.0260 7.9179 123.3838 55.1869 18.1173 179.5480 18 E 3.9833 8.2570 116.8770 59.5663 29.6147 179.5550 19 I 3.8083 7.8134 119.8617 64.4131 37.2026 178.7412 20 V 3.7292 8.1554 118.8995 65.9597 31.2619 177.9071 21 A 4.2956 8.4059 120.7770 55.3076 18.1983 179.0677 22 E 3.9924 8.9389 118.1945 59.5372 29.5238 178.8800 23 F 4.3541 8.2969 120.5574 61.4502 39.4271 177.2022 24 F 3.4179 7.9630 116.8764 60.0929 38.7167 177.7215 25 S 3.9354 7.8331 113.1093 61.5377 62.1753 176.2951 26 F 4.1155 8.0535 120.2261 59.9680 38.6712 177.9071 27 G 3.2550 8.5483 106.7463 47.8270 0.0000 175.5969 28 I 3.5486 7.8983 123.2566 63.8107 37.1793 178.0630 29 N 4.2799 7.7972 116.7304 56.7708 38.3479 177.5961 30 S 4.1013 8.2231 116.3721 61.5497 62.7908 176.9474 31 I 3.2723 7.5906 122.4474 64.2307 36.7441 178.5009 32 L 3.9611 8.0451 120.1504 57.6379 41.2883 179.0130 33 Y 3.5008 7.7662 119.4176 60.3231 38.6605 177.5325 34 Q 3.6397 8.1507 118.8040 58.2382 29.0709 177.5898 35 R 4.4061 8.0958 115.3747 54.9635 29.0768 176.3663 36 G 4.0002 7.4140 106.3455 46.6002 0.0000 175.7840 37 I 4.0077 7.9497 119.7258 63.2566 37.7169 176.2930 38 Y 4.8133 7.4678 113.8722 55.2357 42.2296 173.0158 39 P 4.4566 0.0000 0.0000 63.1513 32.1686 178.0746 40 S 4.7190 8.9116 116.7985 61.3456 63.2761 175.9253 41 E 4.2899 8.2539 117.2778 58.3433 29.9780 177.9086 42 T 3.8938 8.1502 117.0451 65.6196 68.6677 174.1053 43 F 5.1275 7.9859 119.5006 56.1567 41.4677 174.8978 44 T 4.7464 8.7057 113.2652 60.4439 70.9907 173.2000 45 R 4.6324 8.5399 125.1020 56.6918 31.1003 176.2042 46 V 4.5141 8.6620 113.9235 60.5610 36.9002 172.7950 47 Q 4.9752 8.3579 121.7686 54.4003 30.2733 175.2687 48 K 3.9360 9.0520 123.1661 56.6138 35.3602 174.6126 49 Y 3.7865 8.8903 120.5487 58.9592 35.4994 171.1160 50 G 3.8802 8.3470 104.5688 46.0542 0.0000 173.4414 51 L 4.7797 8.1932 118.9998 52.8901 45.5485 175.3468 52 T 4.9423 8.3250 116.1786 62.4715 69.5297 174.5414 53 L 4.8063 8.9127 126.7136 52.8673 45.4851 175.3442 54 L 5.2393 8.2322 119.2631 53.1782 44.1577 176.7295 55 V 4.9254 8.7297 115.9312 59.4803 35.8171 175.2649 56 T 3.4267 9.7699 119.0384 62.7834 67.4754 174.0507 57 T 4.2806 7.7092 120.4713 63.1509 70.4275 174.7493 58 D 4.2687 7.4215 122.1594 53.6870 41.7816 175.6429 59 L 3.9422 8.5841 129.1913 58.6486 42.0278 178.4958 60 E 3.9223 8.2330 117.5034 59.4488 29.3635 179.1508 61 L 3.9694 8.3182 120.1460 58.1065 42.0700 178.8607 62 I 3.6189 8.3859 120.3837 64.5460 36.8139 178.4706 63 K 3.9349 8.6236 119.4049 59.5229 31.8192 178.7932 64 Y 4.1209 8.0897 119.6639 60.8208 38.8127 177.9532 65 L 3.7026 8.1979 120.0240 57.8486 41.6740 179.3237 66 N 4.2729 7.8850 115.9843 56.3600 38.4965 177.1405 67 N 4.2566 7.7271 117.5385 56.1976 38.6177 177.5319 68 V 3.6373 7.3758 119.4924 65.9709 31.6099 178.0614 69 V 3.5711 8.0455 118.2049 66.2022 31.2840 177.4714 70 E 3.9463 8.5009 119.3182 59.2737 29.3780 178.7103 71 Q 3.5086 8.0098 119.4893 58.9042 29.1202 177.6156 72 L 4.1174 8.3432 121.6977 58.1446 42.0661 178.8725 73 K 4.0018 8.4501 119.8587 59.5563 31.8559 178.5532 74 D 4.3427 7.5790 119.1438 57.3509 40.8083 178.8219 75 W 4.5244 7.9783 119.3631 59.8979 28.9942 178.6536 76 L 4.2485 8.4319 119.1410 57.8921 40.8401 178.7369 77 Y 4.1703 7.9404 118.3021 60.1221 38.8017 177.4324 78 K 4.2661 7.8078 116.0072 55.1102 33.2870 175.5283 79 C 4.2018 7.9845 115.6983 58.4439 37.8877 173.8671 80 S 4.2139 8.7816 115.1767 58.6092 64.1040 175.2234 81 V 4.2034 7.6533 119.9475 60.2731 31.5697 175.9407 82 Q 4.4905 9.5072 125.0495 57.3226 30.4952 175.8876 83 K 5.0457 7.9451 116.2679 54.7873 37.2371 175.0574 84 L 5.2537 9.1408 124.1451 53.4314 45.4596 175.3361 85 V 5.0359 9.3548 125.6495 61.2977 35.2526 174.1268 86 V 4.7574 9.1091 128.3503 61.7851 32.8813 174.4334 87 V 4.6128 9.1909 129.8810 61.8135 33.2868 174.4859 88 I 5.3087 8.9621 129.2803 59.7184 39.6474 174.9341 89 S 5.1248 8.8342 120.5487 56.0763 67.5267 172.7312 90 N 4.5954 9.1684 120.0701 53.8599 38.8149 175.3861 91 I 3.4725 8.9789 128.2064 63.8479 38.1253 175.9850 92 E 4.3648 8.5441 120.1561 58.0352 30.8165 177.2906 93 S 4.1360 9.0776 115.0397 62.0648 63.1520 175.9064 94 G 4.0257 7.9763 106.7732 43.9774 0.0000 173.2406 95 E 4.0432 8.4164 122.6409 56.2381 30.6523 176.0849 96 V 4.1039 8.5141 127.4358 63.1693 31.8745 175.2351 97 L 4.7780 9.4533 127.2888 55.3938 44.6753 175.9420 98 E 5.2385 8.0294 117.8092 54.8764 33.6784 174.2292 99 R 5.0361 9.3036 125.8724 55.0069 33.7692 173.4826 100 W 4.8959 9.5244 127.5625 55.3825 31.0113 175.0782 101 Q 4.9616 9.0047 126.8243 54.2197 31.3663 173.9242 102 F 5.3260 9.3830 125.5607 56.0595 41.7661 174.1211 103 D 5.3028 9.2397 124.9204 53.1086 42.4702 175.5865 104 I 5.0203 9.0260 125.2311 59.5361 39.4662 174.7155 105 E 4.8118 9.2352 128.0385 54.4053 31.9668 172.1522 106 C 5.3114 8.8150 120.7850 53.5797 41.5150 173.3091 107 D 4.5908 8.5212 121.1573 52.8595 40.8083 176.9515 108 K 3.8787 8.8500 127.1704 59.5055 32.3527 178.4695 109 T 4.1412 8.4561 107.5894 62.4374 69.5191 176.4081 110 A 4.1940 8.2649 125.8450 54.3771 18.3764 179.4939 111 K 4.1265 7.9792 113.1402 58.9040 32.6747 176.8985 112 D 5.0004 7.9057 120.5208 53.9785 41.2276 175.9509 113 D 4.6819 7.7308 118.4823 54.0499 41.7517 178.2430 114 S 4.3062 8.5801 117.8146 60.6817 63.4538 174.2486 115 A 4.6250 7.4915 120.1370 49.8577 21.6520 173.8549 116 P 4.5386 0.0000 0.0000 63.1445 32.1641 176.6790 117 R 4.1234 8.5959 122.0110 56.1091 31.4483 176.5529 118 E 4.5890 8.6933 122.6744 55.5018 27.4096 175.0268 119 K 4.6794 7.8034 121.8702 54.5155 35.8858 175.9713 120 S 4.6041 8.9017 121.1341 57.8352 64.3437 175.2347 121 Q 3.9386 9.1756 121.4426 59.3257 28.4962 179.2084 122 K 3.8682 8.1807 119.6931 59.5779 31.5558 178.3737 123 A 3.9432 7.7846 120.4612 55.2605 18.3741 179.5624 124 I 3.7403 7.5935 118.0230 64.4956 37.1204 178.7736 125 Q 3.9078 8.1154 119.1097 58.9591 28.3337 178.3576 126 D 4.5684 8.0586 119.0604 57.1212 41.1693 178.5023 127 E 4.1208 7.8527 118.5872 59.3617 29.5717 179.1582 128 I 3.0902 7.2383 119.8066 64.2227 37.1094 178.4339 129 R 3.8253 8.2110 119.7243 59.3999 29.2616 178.5168 130 S 4.1251 7.8055 112.7311 61.0587 62.2696 176.3796 131 V 3.6987 7.5284 120.5366 66.2169 31.5099 177.9017 132 I 3.8035 7.9322 119.5672 64.5115 36.8583 178.7224 133 R 3.9745 8.0182 118.7231 59.2105 29.6853 178.8262 134 Q 4.0461 7.6681 117.5863 59.2905 29.3264 177.8343 135 I 4.1330 8.1971 121.0368 64.8841 37.1492 178.5021 136 T 4.2441 8.2439 117.4308 66.2177 68.5615 176.5515 137 A 4.1352 8.2408 122.2233 54.9571 18.3833 179.2879 138 T 3.5632 7.7159 111.3428 64.5365 67.0237 175.9752 139 V 3.4512 7.3387 119.9250 66.3211 31.4731 177.0974 140 T 3.9756 7.1687 112.6905 66.4012 68.3577 175.3996 141 F 4.5411 7.4631 113.3126 57.7041 38.8484 176.1891 142 L 3.5977 6.5007 120.9348 53.5615 41.8971 175.1499 143 P 4.3241 0.0000 0.0000 62.0698 31.9675 176.6516 144 L 4.1203 8.2683 122.3964 55.0454 42.2373 177.9904 145 L 4.5030 8.0357 123.8839 52.6685 40.3906 175.8156 146 E 4.0124 8.3643 120.0381 59.1427 29.7978 179.1282 147 V 3.9852 7.4269 111.0835 60.1841 33.1222 174.9294 148 S 4.5653 8.3557 116.6269 58.3574 63.8351 173.8853 149 C 5.4625 8.6683 121.5510 57.9457 31.9695 172.3981 150 S 4.9253 8.8124 114.1663 56.8262 66.6454 172.4883 151 F 5.6827 8.3879 113.6542 55.4276 41.2338 173.3615 152 D 4.6564 9.3138 117.8735 52.6675 45.1368 173.6646 153 L 5.4343 8.7007 123.5933 53.2745 43.6279 175.6963 154 L 5.0856 9.5216 124.3618 53.0768 44.6144 175.5896 155 I 5.0606 8.6075 122.2809 59.6911 40.7418 174.3034 156 Y 4.6429 8.7382 126.1391 56.3287 41.6909 174.5412 157 T 4.6405 7.2376 115.5395 59.1376 71.7885 171.8038 158 D 4.4538 8.2677 121.5409 53.5020 41.3477 177.6163 159 K 3.7896 8.6285 122.8853 58.0019 32.7297 175.9524 160 D 4.7856 9.3982 117.7932 54.3248 41.5968 174.7602 161 L 4.4862 7.8469 118.8784 52.8613 43.9035 175.8607 162 V 3.9908 8.2125 126.0753 61.7811 30.4843 175.0659 163 V 4.2034 7.9312 120.0284 59.3918 32.3726 174.8364 164 P 4.5551 0.0000 0.0000 62.6202 31.9330 177.3394 165 E 4.1029 8.8347 118.9618 59.4407 29.4529 179.0756 166 K 3.9841 8.2545 116.6821 58.8739 32.6238 176.7039 167 W 4.7150 7.9304 119.4555 55.0805 30.2129 175.3661 168 E 4.8875 8.5674 120.1473 53.8504 31.8733 175.6105 169 E 4.0562 8.6609 119.9623 57.2977 30.0538 176.4126 170 S 4.4880 8.3028 115.2322 57.5057 65.3913 171.7420 171 G 4.2582 8.1979 109.7306 42.7360 0.0000 171.2822 172 P 3.9995 0.0000 0.0000 63.4860 31.7432 176.2178 173 Q 3.3908 7.7392 116.3841 56.8314 25.8591 173.4667 174 F 4.6187 7.5103 114.5847 57.3407 40.3017 175.7144 175 I 4.1237 8.3786 124.0068 60.8772 37.4812 177.1879 176 T 3.7742 8.6755 116.4133 64.8419 68.6053 173.4079 177 N 4.7908 7.8966 120.9414 52.6395 41.5225 173.4103 178 S 5.0823 8.3405 120.1404 57.0245 66.9129 172.4315 179 E 4.7556 8.2594 117.9179 54.6402 33.2283 175.2097 180 E 4.8603 8.1619 117.7909 55.0318 32.9044 174.3198 181 V 4.3688 8.7608 121.7473 61.0802 34.4537 174.3787 182 R 4.4471 8.6412 128.2876 56.0983 31.0188 175.4263 183 L 4.9237 8.5690 126.4611 52.9689 44.7691 175.8976 184 R 4.4623 9.5661 119.5363 56.6099 31.6116 175.6707 185 S 5.2202 8.4148 114.3852 56.8652 66.7350 172.4904 186 F 5.1766 8.1937 112.9624 56.0364 41.4970 173.5484 187 T 4.8993 8.9370 113.2652 61.1079 70.2199 173.5464 188 T 4.3394 8.8583 117.7145 61.3952 69.1342 175.8708 189 T 3.4593 7.9389 111.4670 62.0212 68.7449 172.0864 190 I 4.3787 7.5403 121.3562 62.3005 40.6361 175.0246 191 H 5.4474 8.6737 118.0668 53.6550 32.4621 173.0935 192 K 4.7157 9.2914 122.7367 54.5129 35.6565 174.7650 193 V 4.7048 7.8229 127.0188 61.1533 33.9586 173.6389 194 N 5.3097 9.0561 125.5069 51.7277 41.0131 174.1370 195 S 5.2239 8.1853 118.7902 57.2566 66.5617 172.9565 196 M 5.0540 7.9590 118.1743 54.4522 34.8407 173.7424 197 V 4.3959 8.4990 119.4792 59.6910 34.6990 174.1567 198 A 5.1248 8.6728 125.8910 50.1614 22.1527 174.5745 199 Y 5.2232 7.9755 118.0026 54.7051 42.0641 174.5645 200 K 4.5679 8.7493 122.9389 56.4960 33.0857 176.5683 201 I 4.0564 8.2669 128.7742 60.5548 37.5406 174.2457 202 P 4.1445 0.0000 0.0000 63.3031 31.6054 175.9450 203 V 4.4066 8.1477 115.7083 60.5753 34.3328 175.6474 204 N 4.4167 8.9364 127.6607 55.2298 37.4279 174.9557 *205 D 4.4415 7.9618 118.9755 53.3728 40.6018 176.7561 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 H 8.43 4.77 0.00 3.21 3.22 0.00 5.76 0.00 0.00 0.00 0.00 6.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -4 H 7.89 4.15 0.00 3.27 3.19 0.00 5.50 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 -3 H 9.06 5.09 0.00 3.12 3.39 0.00 5.90 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -2 H 7.94 5.04 0.00 3.13 3.16 0.00 5.75 0.00 0.00 0.00 0.00 7.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -1 H 8.62 4.15 0.00 3.29 3.37 0.00 5.83 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0 G 7.94 4.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1 S 8.64 4.20 0.00 3.91 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 2 A 8.65 3.99 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 3 L 7.84 3.86 0.00 1.73 1.68 0.92 0.75 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 4 Q 7.84 4.03 0.00 2.29 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.55 0.00 0.00 0.00 0.00 0.00 2.39 2.43 0.00 5 L 8.13 4.02 0.00 1.97 1.74 1.03 0.74 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 6 S 8.15 4.11 0.00 4.02 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 7 R 7.38 4.19 0.00 1.99 2.02 0.00 3.16 0.00 0.00 3.22 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.66 0.00 8 E 8.27 4.11 0.00 1.95 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 2.34 2.46 0.00 9 Q 8.23 4.05 0.00 2.22 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 7.05 0.00 0.00 0.00 0.00 0.00 2.29 2.46 0.00 10 G 6.96 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 I 8.00 4.39 1.87 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.90 1.00 0.00 0.00 12 T 8.10 4.83 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 1.24 0.00 0.00 13 L 8.48 3.97 0.00 1.73 1.75 0.84 0.33 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 14 R 8.19 4.28 0.00 2.15 2.01 0.00 3.17 0.00 0.00 3.25 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.74 0.00 15 G 8.24 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 16 S 8.77 4.18 0.00 3.94 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 17 A 7.92 4.03 1.53 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 0.00 0.00 18 E 8.26 3.98 0.00 2.31 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.36 2.39 0.00 19 I 7.81 3.81 2.11 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 1.48 1.12 0.99 0.00 0.00 20 V 8.16 3.73 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.00 0.00 1.01 0.00 0.00 21 A 8.41 4.30 1.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 E 8.94 3.99 0.00 2.26 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.67 2.52 0.00 23 F 8.30 4.35 0.00 3.01 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 24 F 7.96 3.42 0.00 3.33 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 25 S 7.83 3.94 0.00 3.80 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 26 F 8.05 4.12 0.00 3.30 3.16 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 27 G 8.55 3.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 I 7.90 3.55 1.84 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.68 0.69 0.00 0.00 29 N 7.80 4.28 0.00 2.93 3.07 0.00 0.00 7.09 6.84 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 30 S 8.22 4.10 0.00 4.02 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31 I 7.59 3.27 1.59 0.00 0.00 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.04 0.29 0.20 0.00 0.00 32 L 8.05 3.96 0.00 1.86 1.94 0.50 0.11 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 33 Y 7.77 3.50 0.00 1.46 2.49 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 0.00 0.00 0.00 34 Q 8.15 3.64 0.00 2.04 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.16 6.65 0.00 0.00 0.00 0.00 0.00 2.41 2.52 0.00 35 R 8.10 4.41 0.00 1.87 2.01 0.00 3.50 0.00 0.00 3.48 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.88 0.00 36 G 7.41 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 37 I 7.95 4.01 2.16 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 1.35 0.95 1.05 0.00 0.00 38 Y 7.47 4.81 0.00 3.21 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 39 P 0.00 4.46 0.00 2.29 2.26 0.00 3.85 0.00 0.00 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 2.17 0.00 40 S 8.91 4.72 0.00 4.34 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 41 E 8.25 4.29 0.00 2.15 2.19 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 2.35 2.32 0.00 42 T 8.15 3.89 4.54 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 0.40 0.00 0.00 43 F 7.99 5.13 0.00 2.78 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 44 T 8.71 4.75 4.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 45 R 8.54 4.63 0.00 1.72 1.82 0.00 3.27 0.00 0.00 3.21 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.61 0.00 46 V 8.66 4.51 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 0.68 0.00 0.00 1.11 0.00 0.00 47 Q 8.36 4.98 0.00 1.86 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.66 6.66 0.00 0.00 0.00 0.00 0.00 2.25 2.24 0.00 48 K 9.05 3.94 0.00 1.16 0.83 0.00 0.88 0.00 0.00 1.04 0.00 0.00 2.38 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.30 0.21 7.81 49 Y 8.89 3.79 0.00 3.04 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 50 G 8.35 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 51 L 8.19 4.78 0.00 1.72 1.54 0.96 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 0.00 0.00 0.00 0.00 52 T 8.32 4.94 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 53 L 8.91 4.81 0.00 1.62 1.65 0.86 0.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 54 L 8.23 5.24 0.00 0.68 0.98 0.62 -0.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 55 V 8.73 4.93 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 0.67 0.00 0.00 0.92 0.00 0.00 56 T 9.77 3.43 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.00 0.00 57 T 7.71 4.28 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 1.14 0.00 0.00 58 D 7.42 4.27 0.00 2.50 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 59 L 8.58 3.94 0.00 1.75 1.64 0.89 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 60 E 8.23 3.92 0.00 2.18 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.39 2.36 0.00 61 L 8.32 3.97 0.00 1.59 1.63 0.96 0.22 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 62 I 8.39 3.62 1.99 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.29 0.85 0.00 0.00 63 K 8.62 3.93 0.00 1.99 1.87 0.00 1.65 0.00 0.00 1.75 0.00 0.00 2.90 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.45 1.44 7.81 64 Y 8.09 4.12 0.00 3.01 3.15 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 65 L 8.20 3.70 0.00 1.66 1.61 0.85 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 66 N 7.88 4.27 0.00 2.84 2.81 0.00 0.00 7.03 8.27 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 67 N 7.73 4.26 0.00 2.70 2.82 0.00 0.00 6.68 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 68 V 7.38 3.64 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 0.38 0.00 0.00 69 V 8.05 3.57 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 0.00 0.00 0.93 0.00 0.00 70 E 8.50 3.95 0.00 2.21 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 2.26 2.30 0.00 71 Q 8.01 3.51 0.00 2.05 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.53 0.00 0.00 0.00 0.00 0.00 1.49 1.16 0.00 72 L 8.34 4.12 0.00 2.15 1.83 1.17 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 73 K 8.45 4.00 0.00 2.03 1.94 0.00 1.72 0.00 0.00 1.68 0.00 0.00 2.95 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.45 1.54 7.81 74 D 7.58 4.34 0.00 2.57 2.59 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 75 W 7.98 4.52 0.00 3.59 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 76 L 8.43 4.25 0.00 1.96 1.74 1.13 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 77 Y 7.94 4.17 0.00 3.02 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 78 K 7.81 4.27 0.00 1.88 1.88 0.00 2.02 0.00 0.00 1.84 0.00 0.00 3.24 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.61 1.85 7.81 79 C 7.98 4.20 0.00 3.12 3.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 80 S 8.78 4.21 0.00 3.75 3.71 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 81 V 7.65 4.20 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 0.88 0.00 0.00 0.97 0.00 0.00 82 Q 9.51 4.49 0.00 2.46 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.54 6.74 0.00 0.00 0.00 0.00 0.00 2.45 2.45 0.00 83 K 7.95 5.05 0.00 1.75 1.71 0.00 1.30 0.00 0.00 1.63 0.00 0.00 2.17 0.00 0.00 2.35 0.00 0.00 0.00 0.00 1.57 1.43 7.81 84 L 9.14 5.25 0.00 1.39 1.37 0.93 0.63 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 85 V 9.35 5.04 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.00 0.00 1.03 0.00 0.00 86 V 9.11 4.76 2.38 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 0.97 0.00 0.00 1.12 0.00 0.00 87 V 9.19 4.61 2.20 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 0.98 0.00 0.00 1.03 0.00 0.00 88 I 8.96 5.31 2.20 0.00 0.00 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 1.50 0.95 1.04 0.00 0.00 89 S 8.83 5.12 0.00 3.94 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 90 N 9.17 4.60 0.00 2.78 2.85 0.00 0.00 7.22 7.62 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 91 I 8.98 3.47 1.95 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 1.14 0.88 0.00 0.00 92 E 8.54 4.36 0.00 2.16 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 2.23 2.21 0.00 93 S 9.08 4.14 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 94 G 7.98 4.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 E 8.42 4.04 0.00 2.08 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.29 0.00 96 V 8.51 4.10 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.00 0.00 0.98 0.00 0.00 97 L 9.45 4.78 0.00 1.64 1.72 0.96 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 98 E 8.03 5.24 0.00 2.13 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.43 2.39 0.00 99 R 9.30 5.04 0.00 1.91 1.75 0.00 3.32 0.00 0.00 3.31 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.71 0.00 100 W 9.52 4.90 0.00 3.50 3.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 101 Q 9.00 4.96 0.00 2.11 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.52 6.76 0.00 0.00 0.00 0.00 0.00 2.27 2.36 0.00 102 F 9.38 5.33 0.00 3.50 3.45 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 0.00 103 D 9.24 5.30 0.00 2.64 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 0.00 104 I 9.03 5.02 2.15 0.00 0.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.78 1.06 0.00 0.00 105 E 9.24 4.81 0.00 1.99 1.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.21 0.00 106 C 8.82 5.31 0.00 2.88 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 0.00 107 D 8.52 4.59 0.00 2.74 2.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 108 K 8.85 3.88 0.00 1.74 1.85 0.00 1.65 0.00 0.00 1.74 0.00 0.00 3.14 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.43 1.48 7.81 109 T 8.46 4.14 4.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 110 A 8.26 4.19 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 K 7.98 4.13 0.00 1.80 1.80 0.00 1.47 0.00 0.00 1.62 0.00 0.00 2.97 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.49 1.43 7.81 112 D 7.91 5.00 0.00 2.62 2.67 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 0.00 113 D 7.73 4.68 0.00 2.75 2.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 114 S 8.58 4.31 0.00 3.87 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 0.00 115 A 7.49 4.62 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 116 P 0.00 4.54 0.00 2.12 2.03 0.00 3.69 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 2.05 2.15 0.00 117 R 8.60 4.12 0.00 1.78 1.84 0.00 3.10 0.00 0.00 3.16 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.61 0.00 118 E 8.69 4.59 0.00 1.87 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.34 0.00 119 K 7.80 4.68 0.00 1.56 1.58 0.00 1.67 0.00 0.00 1.72 0.00 0.00 2.98 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.27 1.54 7.81 120 S 8.90 4.60 0.00 4.02 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 0.00 121 Q 9.18 3.94 0.00 2.09 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.78 0.00 0.00 0.00 0.00 0.00 2.66 2.53 0.00 122 K 8.18 3.87 0.00 1.86 1.93 0.00 1.62 0.00 0.00 1.82 0.00 0.00 3.06 0.00 0.00 3.33 0.00 0.00 0.00 0.00 1.51 1.59 7.81 123 A 7.78 3.94 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 124 I 7.59 3.74 2.01 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.67 0.92 0.00 0.00 125 Q 8.12 3.91 0.00 2.27 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.79 0.00 0.00 0.00 0.00 0.00 2.56 2.60 0.00 126 D 8.06 4.57 0.00 2.85 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 0.00 127 E 7.85 4.12 0.00 2.19 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.38 2.66 0.00 128 I 7.24 3.09 1.18 0.00 0.00 -0.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 -0.36 -0.25 0.00 0.00 129 R 8.21 3.83 0.00 1.99 2.04 0.00 3.11 0.00 0.00 3.45 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.66 0.00 130 S 7.81 4.13 0.00 4.13 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 0.00 131 V 7.53 3.70 2.31 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 1.43 0.00 0.00 1.14 0.00 0.00 132 I 7.93 3.80 1.90 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 1.63 0.61 0.97 0.00 0.00 133 R 8.02 3.97 0.00 1.94 2.02 0.00 3.15 0.00 0.00 3.11 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.87 0.00 134 Q 7.67 4.05 0.00 2.16 2.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.91 0.00 0.00 0.00 0.00 0.00 2.52 2.51 0.00 135 I 8.20 4.13 2.16 0.00 0.00 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.54 0.90 0.00 0.00 136 T 8.24 4.24 4.49 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 0.00 0.00 1.24 0.00 0.00 137 A 8.24 4.14 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 138 T 7.72 3.56 4.66 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 1.29 0.00 0.00 139 V 7.34 3.45 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.82 0.00 0.00 0.99 0.00 0.00 140 T 7.17 3.98 4.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 141 F 7.46 4.54 0.00 3.08 3.16 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 0.00 142 L 6.50 3.60 0.00 1.39 1.42 0.96 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 143 P 0.00 4.32 0.00 2.00 1.94 0.00 3.35 0.00 0.00 2.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.86 0.00 144 L 8.27 4.12 0.00 1.61 1.57 0.90 0.93 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 0.00 145 L 8.04 4.50 0.00 1.64 1.64 1.03 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 146 E 8.36 4.01 0.00 2.07 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 2.30 0.00 147 V 7.43 3.99 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 0.73 0.00 0.00 0.94 0.00 0.00 148 S 8.36 4.57 0.00 3.75 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 0.00 149 C 8.67 5.46 0.00 2.84 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 0.00 150 S 8.81 4.93 0.00 3.75 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 0.00 151 F 8.39 5.68 0.00 3.11 3.15 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 0.00 152 D 9.31 4.66 0.00 2.68 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 0.00 153 L 8.70 5.43 0.00 1.73 1.83 1.05 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 154 L 9.52 5.09 0.00 1.65 1.65 1.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 155 I 8.61 5.06 1.81 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.69 0.23 0.00 0.00 156 Y 8.74 4.64 0.00 3.06 2.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 157 T 7.24 4.64 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 0.60 0.00 0.00 158 D 8.27 4.45 0.00 2.61 2.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 159 K 8.63 3.79 0.00 1.79 1.85 0.00 1.49 0.00 0.00 1.60 0.00 0.00 2.89 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.35 1.41 7.81 160 D 9.40 4.79 0.00 2.54 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 0.00 161 L 7.85 4.49 0.00 1.52 1.30 0.88 0.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 0.00 0.00 0.00 0.00 162 V 8.21 3.99 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 0.91 0.00 0.00 0.95 0.00 0.00 163 V 7.93 4.20 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.66 0.00 0.00 1.00 0.00 0.00 164 P 0.00 4.56 0.00 2.52 2.14 0.00 3.81 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 2.32 2.20 0.00 165 E 8.83 4.10 0.00 2.01 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.36 2.35 0.00 166 K 8.25 3.98 0.00 1.71 1.95 0.00 1.66 0.00 0.00 1.70 0.00 0.00 3.00 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.53 1.69 7.81 167 W 7.93 4.71 0.00 3.43 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 0.00 168 E 8.57 4.89 0.00 2.07 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 2.19 2.32 0.00 169 E 8.66 4.06 0.00 2.00 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 2.34 2.34 0.00 170 S 8.30 4.49 0.00 3.82 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 0.00 171 G 8.20 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 0.00 0.00 0.00 0.00 172 P 0.00 4.00 0.00 0.49 1.74 0.00 3.83 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.78 0.00 173 Q 7.74 3.39 0.00 2.15 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.45 7.07 0.00 0.00 0.00 0.00 0.00 2.25 2.49 0.00 174 F 7.51 4.62 0.00 3.12 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 0.00 175 I 8.38 4.12 1.89 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.93 0.96 0.00 0.00 176 T 8.68 3.77 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 1.25 0.00 0.00 177 N 7.90 4.79 0.00 2.87 2.69 0.00 0.00 6.61 7.28 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 0.00 178 S 8.34 5.08 0.00 3.81 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 0.00 179 E 8.26 4.76 0.00 1.16 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 2.09 2.36 0.00 180 E 8.16 4.86 0.00 1.84 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 0.00 2.02 2.18 0.00 181 V 8.76 4.37 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.00 0.00 0.90 0.00 0.00 182 R 8.64 4.45 0.00 1.83 1.78 0.00 3.23 0.00 0.00 3.21 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.64 0.00 183 L 8.57 4.92 0.00 1.67 1.91 1.11 1.12 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 0.00 184 R 9.57 4.46 0.00 1.81 1.93 0.00 3.10 0.00 0.00 3.42 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.87 0.00 185 S 8.41 5.22 0.00 3.83 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 F 8.19 5.18 0.00 3.01 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 0.00 187 T 8.94 4.90 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 1.21 0.00 0.00 188 T 8.86 4.34 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 1.34 0.00 0.00 189 T 7.94 3.46 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 0.96 0.00 0.00 190 I 7.54 4.38 1.88 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.96 0.78 0.00 0.00 191 H 8.67 5.45 0.00 3.09 3.13 0.00 5.75 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 0.00 192 K 9.29 4.72 0.00 1.65 1.53 0.00 1.53 0.00 0.00 1.68 0.00 0.00 2.76 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.17 1.24 7.81 193 V 7.82 4.70 0.81 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 1.10 0.00 0.00 0.47 0.00 0.00 194 N 9.06 5.31 0.00 2.72 2.71 0.00 0.00 6.37 7.13 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 0.00 195 S 8.19 5.22 0.00 4.05 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 0.00 196 M 7.96 5.05 0.00 1.94 2.15 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.39 0.00 197 V 8.50 4.40 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 0.68 0.00 0.00 -0.42 0.00 0.00 198 A 8.67 5.12 1.11 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 0.00 0.00 0.00 0.00 0.00 199 Y 7.98 5.22 0.00 3.03 2.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 200 K 8.75 4.57 0.00 1.87 1.84 0.00 1.84 0.00 0.00 1.75 0.00 0.00 2.78 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.51 1.46 7.81 201 I 8.27 4.06 1.89 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.78 0.95 0.00 0.00 202 P 0.00 4.14 0.00 2.07 2.08 0.00 3.75 0.00 0.00 4.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.20 0.00 203 V 8.15 4.41 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 0.79 0.00 0.00 0.95 0.00 0.00 204 N 8.94 4.42 0.00 2.89 2.97 0.00 0.00 6.81 8.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *205 D 7.96 4.44 0.00 2.44 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 * Residues marked with a * may have inaccurate shift predictions.