NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 A 4.3070 8.1227 123.5821 52.0417 21.5198 178.4404 4 I 3.5643 7.6998 113.0070 63.5215 37.7337 176.7537 5 A 4.2457 8.3575 122.4489 55.3735 18.4531 179.7668 6 K 4.0215 7.7783 121.7794 59.6585 32.1704 182.9988 7 R 4.1100 8.7319 120.8652 59.0824 30.0390 178.8224 8 L 4.0122 8.6185 122.7550 58.8522 41.9752 179.4138 9 D 4.3116 7.7501 119.8108 58.3464 39.8628 180.1156 10 A 4.1464 8.6309 123.1891 55.1617 18.4645 178.9943 11 C 3.8958 8.5888 117.1916 63.1199 31.6295 176.0934 12 Q 4.1065 8.7328 119.2333 58.5365 28.1910 178.6391 13 D 4.3030 8.0005 120.5235 57.4147 40.9389 178.3414 14 Q 3.9707 7.9837 119.9635 59.0857 28.9143 178.3055 15 L 3.8424 7.8119 119.7935 57.6405 41.6374 179.1305 16 L 4.1788 8.0848 122.6486 59.0017 41.8141 179.4705 17 E 4.0106 8.0294 116.7216 61.0398 29.8987 180.5436 18 L 4.2854 7.9738 120.0019 57.9004 41.2127 179.0472 19 Y 4.2306 8.0528 116.6247 61.5001 37.7352 178.9048 20 E 4.1859 8.3505 117.0633 58.5774 29.5969 178.4634 21 E 4.0403 8.0745 119.1761 56.6433 30.5968 175.8457 22 N 4.1621 7.8074 114.2928 54.1146 36.7517 174.0756 23 S 4.3265 7.8204 110.3456 58.6446 63.6191 173.3253 24 I 4.4671 8.1969 122.8805 60.9872 38.4992 174.6293 25 D 4.9185 7.9681 122.1034 52.5961 42.0202 176.7257 26 I 3.6465 8.5662 126.5957 64.7267 37.6233 177.3628 27 H 4.1595 9.2131 117.1617 58.3754 28.3282 177.8644 28 K 3.9660 8.0883 120.7396 59.5966 31.9331 179.0287 29 H 4.2577 7.7755 115.7288 58.4433 28.6789 177.7025 30 I 3.9056 7.6386 122.1251 64.3161 36.7964 178.3301 31 M 4.0083 7.7001 119.9017 58.4601 31.7895 177.8416 32 H 3.8019 8.2646 118.6562 59.3906 30.0419 177.1801 33 W 4.2427 7.9059 120.2234 59.6160 28.9379 178.5162 34 K 4.0360 8.0964 119.7792 59.6017 31.6505 178.8221 35 C 4.1294 8.6763 117.5296 62.7999 28.1314 175.8360 36 I 3.7038 8.2090 121.7773 64.5124 36.5754 178.4454 37 R 3.8985 7.9861 119.0709 59.1914 29.9621 178.2997 38 L 3.9158 7.6962 119.7875 58.2415 42.0894 178.5029 39 E 3.9918 8.6698 119.5878 59.4212 29.3678 178.7177 40 S 4.2179 8.0213 112.9972 60.9627 62.3747 176.1550 41 V 3.5797 8.1252 121.7035 65.7931 31.2761 177.7269 42 L 3.9805 8.5235 118.8120 58.1413 41.6449 179.8544 43 L 3.7715 8.3536 118.7869 57.7004 41.5450 179.2815 44 H 4.1397 7.9373 118.5740 59.1547 29.8922 177.1949 45 K 3.9030 8.2221 121.3575 59.2613 32.1433 178.4978 46 A 3.9617 8.7321 121.7021 55.2169 18.2150 179.4744 47 K 4.1748 7.9717 118.1382 59.3457 32.2300 179.3312 48 Q 4.1615 7.7638 121.0057 60.4782 27.8763 182.7678 49 M 4.6903 7.8016 117.2160 55.7471 31.9208 176.4512 50 G 4.0701 7.8224 107.7570 45.8198 0.0000 174.4776 51 L 4.1629 6.8612 117.8100 55.5838 42.0522 177.1344 52 S 4.5660 8.2741 109.2407 59.3866 65.9905 174.3842 53 H 4.9834 7.7835 116.8477 55.1949 32.6573 173.0061 54 I 4.4760 8.5276 124.6720 60.2304 40.4211 175.7737 55 G 3.7789 8.3542 116.5058 47.1498 0.0000 174.4738 56 L 4.4539 8.5818 124.3044 54.0653 42.4514 175.8041 57 Q 4.1988 8.0534 122.0796 55.3698 29.6704 174.7268 58 V 4.0072 8.2208 125.5265 62.5572 32.3537 175.5216 59 V 3.8975 7.9468 128.3160 62.3890 32.1715 174.1192 60 P 4.7488 0.0000 0.0000 60.5676 33.3017 173.9121 61 P 4.4405 0.0000 0.0000 62.5545 32.0448 177.9834 62 L 4.1247 8.5485 121.0364 58.0317 41.4388 180.1763 63 T 3.8371 7.8231 109.4177 64.8741 69.0469 176.4197 64 V 3.5844 7.9294 121.2290 66.0834 31.3164 178.0125 65 S 4.2898 8.1854 116.3867 61.7842 62.6066 177.0943 66 E 3.9124 8.0297 121.1127 61.3876 29.4691 181.9869 67 T 4.0236 8.2382 117.4851 66.3855 68.5850 176.6421 68 K 4.0171 8.0348 121.3962 59.5218 32.1043 179.0322 69 G 3.6075 8.5772 106.4635 47.8387 0.0000 175.1945 70 H 4.0449 8.3935 120.7684 59.2415 29.9259 177.0786 71 N 4.0271 8.4543 118.4329 56.0452 38.2392 177.0280 72 A 3.8527 7.9743 122.0624 55.5183 18.5333 179.8694 73 I 3.7250 7.4252 117.7012 64.1125 36.9908 178.3674 74 E 3.6921 7.4016 119.6643 59.5340 29.5602 178.6362 75 M 3.3016 7.3937 118.6608 57.9371 31.7656 178.6502 76 Q 3.8300 8.1761 119.8695 59.5738 29.4264 178.3952 77 M 4.0225 7.8942 119.6154 58.6487 31.9311 178.5696 78 H 4.4386 8.1460 116.4770 58.7833 28.8644 177.9244 79 L 3.4374 7.7977 120.9050 57.5855 41.1830 179.2737 80 E 3.8707 7.7119 117.3224 59.2767 29.6583 179.1319 81 S 4.2667 7.9324 112.6335 61.3912 62.5125 175.7531 82 L 2.7855 7.6513 122.6839 57.9280 41.3639 178.7392 83 A 3.7229 7.8559 119.3726 54.9163 18.2391 179.0658 84 K 4.1456 7.7593 115.0971 57.5702 32.6789 176.8160 85 T 4.4330 7.6877 111.2077 59.5329 70.6544 175.2074 86 Q 4.0520 7.9165 117.7455 58.3992 29.0888 177.4626 87 Y 4.2542 7.4015 116.4778 60.0792 38.3414 177.8956 88 G 3.5984 7.7584 108.3647 48.0744 0.0000 175.0445 89 V 3.8769 7.1764 111.3735 62.5397 31.8852 176.2221 90 E 4.2397 7.6662 119.2124 55.1171 29.9967 174.3965 91 P 4.6203 0.0000 0.0000 62.3241 32.0394 176.3400 92 W 4.8504 9.4032 125.1452 54.9458 31.7500 175.5417 93 T 4.3625 8.8796 115.7903 60.7894 69.5026 175.7855 94 L 3.5819 8.6267 123.8604 58.1466 42.1731 178.7062 95 Q 4.2336 8.0328 119.1171 58.9996 29.0323 177.2927 96 D 4.7614 8.1845 119.0774 56.4315 40.8070 177.2377 97 T 4.8456 7.4902 108.0714 61.2509 69.3866 175.0937 98 S 4.8764 8.0620 117.7286 58.8617 65.1907 174.2243 99 Y 4.2630 9.1158 123.6609 60.4828 38.9527 177.5218 100 E 4.1280 8.4163 118.6189 59.5650 29.8629 178.5045 101 M 4.0542 8.0066 119.2396 58.1717 32.2679 178.0035 102 W 4.0887 8.2513 127.7412 59.5339 30.4512 176.7533 103 L 4.3169 7.2297 116.7262 53.6450 41.6518 175.8762 104 T 4.4750 7.1714 116.8468 61.2157 69.6720 173.1388 105 P 4.2755 0.0000 0.0000 62.3247 31.8615 174.1959 106 P 4.2902 0.0000 0.0000 62.5115 31.8859 177.1389 107 K 3.7906 8.3224 124.7016 55.5141 32.1749 173.0573 108 R 2.0000 7.2705 118.8876 55.7978 27.7923 176.4057 109 C 4.4479 6.4887 112.4627 57.9914 32.4539 174.2635 110 F 4.8037 8.7581 122.0015 57.1112 40.5288 174.2595 111 K 5.0621 8.6100 118.2342 57.2275 34.7326 173.3339 112 K 4.7062 9.0312 119.1105 56.5081 36.6187 174.7497 113 Q 3.8217 8.7990 115.6640 56.8968 25.1104 174.6756 114 G 3.1871 8.1083 104.9807 45.5073 0.0000 174.0425 115 N 4.8892 8.9625 124.7730 52.5790 40.6097 174.6059 116 T 4.7851 8.3385 118.3192 62.6569 70.0548 174.3763 117 V 4.5926 8.7309 125.6043 60.9989 35.0267 173.6433 118 E 5.2154 8.8361 126.8518 54.3367 32.8404 174.6178 119 V 4.5200 8.8521 128.3206 61.5512 34.6047 174.6484 120 K 4.5210 8.7537 132.0787 53.9775 33.0096 173.4696 121 F 4.3121 8.9770 125.9260 58.7124 40.3790 176.6720 *128 V 4.2047 7.2835 114.5912 61.1155 33.0576 175.4920 129 M 4.8725 8.3564 114.1164 55.7598 36.4850 174.5138 130 E 5.0547 8.2709 120.1387 55.2062 32.3990 174.8127 131 Y 4.8283 8.6858 118.3305 56.7121 43.1479 173.9636 132 V 4.4576 8.5074 120.9093 61.3072 33.6332 175.0659 133 V 4.3165 8.5536 127.7296 60.8722 33.7424 174.3689 134 W 4.7439 8.8927 129.1869 56.6665 29.6524 177.9442 135 T 4.0611 8.8463 122.3490 66.1158 68.9736 174.8004 136 H 4.9732 8.5824 118.3045 53.9404 32.3292 172.9483 137 I 4.9475 8.3529 124.0748 59.5573 40.4548 174.0696 138 Y 4.9984 8.9977 124.7383 56.3782 39.8172 175.1643 139 L 4.4568 8.7667 124.8712 53.2020 44.1232 175.3530 140 Q 3.5654 7.9885 124.2816 54.0343 30.5375 174.3233 141 D 4.6159 8.6491 127.5225 52.9002 43.3115 177.7900 142 N 4.2178 9.0055 128.7221 54.4903 36.6928 174.9798 143 D 4.9684 9.3910 121.3662 54.6613 42.5062 174.1698 144 S 5.0319 8.2782 114.3351 56.7709 64.8645 173.0427 145 W 5.5652 8.6805 121.6575 55.1555 32.8763 174.7986 146 V 4.7691 8.8380 121.1620 61.1295 35.2251 173.9006 147 K 4.5937 8.7123 126.0947 54.7254 34.1738 175.1859 148 V 4.6023 8.4554 119.9692 59.8035 36.4550 173.8106 149 T 4.9977 8.2693 114.5634 60.8543 71.3229 172.3377 150 S 5.3351 8.0592 119.1622 57.4740 65.6945 173.3972 151 S 4.4740 8.0634 116.0906 57.6879 67.7187 173.7514 152 V 4.7124 7.8873 119.4959 61.4956 34.2833 174.2038 153 D 4.7554 8.6549 122.7268 52.7090 41.8227 175.3864 154 A 4.4256 8.8317 120.7282 55.5210 18.8745 179.1654 155 K 4.3576 9.3888 115.6374 57.1868 32.9853 177.6654 156 G 2.3539 6.7592 103.8925 44.5070 0.0000 170.5992 157 I 4.4981 6.4743 121.0700 59.9033 39.0251 174.9126 158 Y 4.8215 7.6955 123.3333 55.6932 41.7570 173.0932 159 Y 5.3637 8.2362 117.8277 55.6277 41.7787 174.3917 160 T 5.0852 8.6097 115.8393 62.1446 71.3784 174.4868 161 C 4.8199 9.0687 126.7669 55.6967 32.4271 173.7965 162 G 4.0915 8.2196 113.5285 44.1222 0.0000 173.8544 163 Q 4.2480 8.1412 122.4607 56.0262 29.5784 175.6228 164 F 4.8091 7.5498 117.5529 56.9359 39.9140 174.3184 165 K 4.8929 8.5466 123.5883 55.0386 34.9152 176.0701 166 T 4.3841 7.9933 119.1684 61.8828 71.5272 172.7720 167 Y 4.5232 8.7668 125.0639 57.6260 38.5307 175.2774 168 Y 4.8322 8.1919 120.4607 56.7106 39.9289 175.7769 169 V 4.2414 7.2285 120.4947 61.4850 35.2008 173.1557 170 N 4.4543 8.5605 126.9825 51.4372 39.1132 174.3113 171 F 4.0283 7.7887 124.7652 60.6908 39.3040 176.4614 172 N 3.4406 7.7513 118.2184 56.7650 38.6895 177.1267 173 K 3.7864 8.7931 125.0604 60.1002 31.5790 180.8038 174 E 4.1412 8.8569 120.4376 58.5577 29.2957 178.1687 175 A 4.2968 8.1875 119.4701 53.9722 19.0547 178.9076 176 Q 4.1232 8.0678 117.3418 58.3492 28.7845 177.8621 177 K 3.9130 6.8298 116.5501 55.6589 32.0149 176.1992 178 Y 4.7993 7.7085 114.6206 57.9704 38.2455 178.4783 179 G 3.9145 9.6645 113.8089 47.3126 0.0000 174.7733 180 S 4.2741 8.7240 119.3664 60.4937 62.8433 175.8347 181 T 4.5570 7.7892 112.2363 61.2854 70.1302 180.2193 182 N 5.3288 8.8010 117.1632 54.6979 38.6268 170.0461 *183 H 4.7600 8.2676 115.8826 53.2005 30.5200 176.7079 184 W 5.4811 7.5485 119.8359 54.2898 31.9327 172.9602 185 E 4.5441 9.4557 121.9140 54.4234 32.4627 174.3757 186 V 4.4229 8.7830 127.3539 61.5855 33.5721 174.0155 187 C 5.1201 9.1011 126.7526 58.3413 30.7650 172.5512 188 Y 4.6501 9.4779 126.6638 55.5096 40.1493 174.3683 189 G 3.8789 9.4463 119.4731 47.0220 0.0000 172.7672 190 S 4.0865 7.9780 110.4049 58.4734 61.2605 171.6397 191 T 4.6465 7.3467 116.0396 62.6786 70.2698 173.6602 192 V 4.9194 8.1568 124.0478 61.4994 34.2387 174.2506 193 I 4.5734 8.7908 129.3723 59.7972 39.4250 174.4131 194 C 4.9662 8.0998 128.2364 58.5913 34.5384 174.3357 195 S 3.9801 7.5397 121.4792 57.7361 60.8638 172.2649 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 3 A 8.12 4.31 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 4 I 7.70 3.56 1.87 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.44 0.91 0.00 0.00 5 A 8.36 4.25 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 6 K 7.78 4.02 0.00 1.78 1.82 0.00 1.80 0.00 0.00 1.82 0.00 0.00 2.88 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.42 1.09 7.81 7 R 8.73 4.11 0.00 1.88 2.01 0.00 3.10 0.00 0.00 3.09 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.85 0.00 8 L 8.62 4.01 0.00 1.74 1.76 0.93 1.30 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 9 D 7.75 4.31 0.00 2.75 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 10 A 8.63 4.15 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 11 C 8.59 3.90 0.00 3.00 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 12 Q 8.73 4.11 0.00 2.09 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.43 6.59 0.00 0.00 0.00 0.00 0.00 2.39 2.60 0.00 13 D 8.00 4.30 0.00 3.03 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 14 Q 7.98 3.97 0.00 2.12 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.80 0.00 0.00 0.00 0.00 0.00 2.31 2.38 0.00 15 L 7.81 3.84 0.00 1.98 1.78 0.89 0.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 16 L 8.08 4.18 0.00 1.92 1.88 0.95 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 17 E 8.03 4.01 0.00 2.12 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 2.23 0.00 18 L 7.97 4.29 0.00 1.72 1.58 0.85 0.64 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 19 Y 8.05 4.23 0.00 3.17 2.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 E 8.35 4.19 0.00 1.97 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 2.38 2.53 0.00 21 E 8.07 4.04 0.00 2.21 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.34 0.00 22 N 7.81 4.16 0.00 2.92 2.86 0.00 0.00 6.96 7.45 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 23 S 7.82 4.33 0.00 3.98 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 24 I 8.20 4.47 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 1.31 0.71 0.93 0.00 0.00 25 D 7.97 4.92 0.00 2.77 2.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 I 8.57 3.65 1.68 0.00 0.00 -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 1.22 0.70 0.66 0.00 0.00 27 H 9.21 4.16 0.00 3.47 3.29 0.00 5.67 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 28 K 8.09 3.97 0.00 1.68 1.72 0.00 1.67 0.00 0.00 1.60 0.00 0.00 2.91 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.40 1.54 7.81 29 H 7.78 4.26 0.00 3.26 3.32 0.00 5.62 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 30 I 7.64 3.91 2.00 0.00 0.00 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.62 0.93 0.00 0.00 31 M 7.70 4.01 0.00 1.97 2.22 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 2.60 2.52 0.00 32 H 8.26 3.80 0.00 2.90 3.15 0.00 5.59 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 W 7.91 4.24 0.00 3.57 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 34 K 8.10 4.04 0.00 2.06 1.91 0.00 1.63 0.00 0.00 1.64 0.00 0.00 2.94 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.43 1.48 7.81 35 C 8.68 4.13 0.00 2.95 2.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 I 8.21 3.70 2.10 0.00 0.00 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.67 0.99 0.00 0.00 37 R 7.99 3.90 0.00 2.00 2.16 0.00 3.14 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 1.62 1.68 0.00 38 L 7.70 3.92 0.00 1.83 1.81 0.92 0.63 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 39 E 8.67 3.99 0.00 2.01 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.33 0.00 40 S 8.02 4.22 0.00 4.11 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 41 V 8.13 3.58 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 0.99 0.00 0.00 0.98 0.00 0.00 42 L 8.52 3.98 0.00 1.68 1.72 0.94 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 43 L 8.35 3.77 0.00 1.71 1.74 0.98 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 44 H 7.94 4.14 0.00 3.35 3.52 0.00 5.79 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 K 8.22 3.90 0.00 1.92 1.97 0.00 1.57 0.00 0.00 1.66 0.00 0.00 3.03 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.44 1.50 7.81 46 A 8.73 3.96 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 K 7.97 4.17 0.00 1.77 1.82 0.00 1.98 0.00 0.00 1.72 0.00 0.00 3.05 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.43 1.43 7.81 48 Q 7.76 4.16 0.00 2.14 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.74 0.00 0.00 0.00 0.00 0.00 2.29 2.27 0.00 49 M 7.80 4.69 0.00 1.98 2.12 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.98 2.54 0.00 50 G 7.82 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 51 L 6.86 4.16 0.00 1.83 1.67 0.95 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 52 S 8.27 4.57 0.00 3.89 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 53 H 7.78 4.98 0.00 3.14 3.17 0.00 5.64 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 I 8.53 4.48 1.89 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 1.24 1.01 0.92 0.00 0.00 55 G 8.35 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 L 8.58 4.45 0.00 1.63 1.69 0.91 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 57 Q 8.05 4.20 0.00 2.11 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.93 7.02 0.00 0.00 0.00 0.00 0.00 2.36 2.30 0.00 58 V 8.22 4.01 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 0.71 0.00 0.00 0.99 0.00 0.00 59 V 7.95 3.90 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 0.79 0.00 0.00 0.94 0.00 0.00 60 P 0.00 4.75 0.00 1.99 1.99 0.00 3.74 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 2.01 2.11 0.00 61 P 0.00 4.44 0.00 2.18 1.98 0.00 3.61 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 2.12 2.11 0.00 62 L 8.55 4.12 0.00 1.71 1.79 0.90 0.53 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 63 T 7.82 3.84 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 64 V 7.93 3.58 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 0.94 0.00 0.00 65 S 8.19 4.29 0.00 3.97 4.09 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 66 E 8.03 3.91 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 2.24 2.23 0.00 67 T 8.24 4.02 4.37 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 1.20 0.00 0.00 68 K 8.03 4.02 0.00 2.03 1.82 0.00 1.67 0.00 0.00 1.68 0.00 0.00 3.00 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.50 1.51 7.81 69 G 8.58 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 70 H 8.39 4.04 0.00 3.33 3.47 0.00 5.79 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 71 N 8.45 4.03 0.00 2.37 2.00 0.00 0.00 6.97 6.86 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 72 A 7.97 3.85 1.59 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 73 I 7.43 3.72 1.88 0.00 0.00 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 1.36 0.73 0.81 0.00 0.00 74 E 7.40 3.69 0.00 1.90 1.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.39 0.00 75 M 7.39 3.30 0.00 0.51 0.57 0.00 0.00 0.00 0.00 0.00 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 1.87 0.00 76 Q 8.18 3.83 0.00 2.20 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.81 0.00 0.00 0.00 0.00 0.00 2.32 2.43 0.00 77 M 7.89 4.02 0.00 2.00 1.98 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.66 2.51 0.00 78 H 8.15 4.44 0.00 3.00 3.65 0.00 5.62 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 79 L 7.80 3.44 0.00 1.62 1.40 0.93 -0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 80 E 7.71 3.87 0.00 2.05 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 2.27 2.61 0.00 81 S 7.93 4.27 0.00 4.09 4.37 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 82 L 7.65 2.79 0.00 0.72 0.98 -0.85 -0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.63 0.00 0.00 0.00 0.00 0.00 0.00 83 A 7.86 3.72 1.08 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 0.00 0.00 84 K 7.76 4.15 0.00 1.88 1.87 0.00 1.73 0.00 0.00 1.77 0.00 0.00 3.10 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.46 1.64 7.81 85 T 7.69 4.43 4.04 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 1.30 0.00 0.00 86 Q 7.92 4.05 0.00 2.08 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.63 6.93 0.00 0.00 0.00 0.00 0.00 1.66 1.27 0.00 87 Y 7.40 4.25 0.00 3.08 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 88 G 7.76 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 89 V 7.18 3.88 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 0.70 0.00 0.00 1.02 0.00 0.00 90 E 7.67 4.24 0.00 1.92 1.67 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 2.39 2.53 0.00 91 P 0.00 4.62 0.00 1.81 1.94 0.00 3.41 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 1.95 2.06 0.00 92 W 9.40 4.85 0.00 3.01 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 93 T 8.88 4.36 4.30 0.00 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0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.81 0.00 102 W 8.25 4.09 0.00 3.29 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 0.00 103 L 7.23 4.32 0.00 1.70 1.55 0.62 0.69 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 0.00 104 T 7.17 4.47 4.50 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 1.63 0.00 0.00 105 P 0.00 4.28 0.00 2.35 2.38 0.00 3.86 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 2.20 2.18 0.00 106 P 0.00 4.29 0.00 1.96 2.14 0.00 2.92 0.00 0.00 2.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.22 0.00 107 K 8.32 3.79 0.00 1.80 1.64 0.00 1.95 0.00 0.00 1.70 0.00 0.00 2.90 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.36 1.04 7.81 108 R 7.27 2.00 0.00 1.33 1.23 0.00 3.01 0.00 0.00 3.05 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 1.08 0.00 109 C 6.49 4.45 0.00 2.54 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 0.00 110 F 8.76 4.80 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 0.00 111 K 8.61 5.06 0.00 1.71 1.50 0.00 0.98 0.00 0.00 1.47 0.00 0.00 2.30 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.30 0.21 7.81 112 K 9.03 4.71 0.00 1.90 2.13 0.00 1.02 0.00 0.00 0.86 0.00 0.00 2.13 0.00 0.00 2.54 0.00 0.00 0.00 0.00 1.40 1.45 7.81 113 Q 8.80 3.82 0.00 2.44 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 7.10 0.00 0.00 0.00 0.00 0.00 2.42 2.51 0.00 114 G 8.11 3.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 115 N 8.96 4.89 0.00 2.72 2.86 0.00 0.00 6.57 6.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 116 T 8.34 4.79 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 1.21 0.00 0.00 117 V 8.73 4.59 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 0.95 0.00 0.00 0.51 0.00 0.00 118 E 8.84 5.22 0.00 2.07 1.72 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 2.11 2.16 0.00 119 V 8.85 4.52 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 -0.05 0.00 0.00 0.09 0.00 0.00 120 K 8.75 4.52 0.00 1.45 1.67 0.00 1.84 0.00 0.00 1.65 0.00 0.00 2.79 0.00 0.00 2.76 0.00 0.00 0.00 0.00 1.30 1.27 7.81 121 F 8.98 4.31 0.00 3.05 3.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *128 V 7.28 4.20 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 0.93 0.00 0.00 129 M 8.36 4.87 0.00 1.52 2.23 0.00 0.00 0.00 0.00 0.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.19 0.00 130 E 8.27 5.05 0.00 1.68 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 2.17 2.22 0.00 131 Y 8.69 4.83 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 0.00 132 V 8.51 4.46 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 -1.05 0.00 0.00 0.80 0.00 0.00 133 V 8.55 4.32 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 0.81 0.00 0.00 0.63 0.00 0.00 134 W 8.89 4.74 0.00 3.43 3.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 135 T 8.85 4.06 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 1.04 0.00 0.00 136 H 8.58 4.97 0.00 3.17 2.90 0.00 5.55 0.00 0.00 0.00 0.00 6.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 137 I 8.35 4.95 1.65 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 1.02 0.85 0.46 0.00 0.00 138 Y 9.00 5.00 0.00 3.22 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 0.00 139 L 8.77 4.46 0.00 1.50 1.41 0.64 0.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 0.00 0.00 0.00 0.00 140 Q 7.99 3.57 0.00 0.93 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.57 6.92 0.00 0.00 0.00 0.00 0.00 1.95 1.57 0.00 141 D 8.65 4.62 0.00 2.62 2.44 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 0.00 142 N 9.01 4.22 0.00 2.88 2.34 0.00 0.00 6.89 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 0.00 143 D 9.39 4.97 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 0.00 144 S 8.28 5.03 0.00 3.97 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 0.00 145 W 8.68 5.57 0.00 3.47 3.42 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 0.00 146 V 8.84 4.77 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 0.99 0.00 0.00 1.01 0.00 0.00 147 K 8.71 4.59 0.00 1.06 1.55 0.00 1.65 0.00 0.00 1.70 0.00 0.00 2.64 0.00 0.00 2.59 0.00 0.00 0.00 0.00 1.07 0.65 7.81 148 V 8.46 4.60 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 0.69 0.00 0.00 0.70 0.00 0.00 149 T 8.27 5.00 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 1.23 0.00 0.00 150 S 8.06 5.34 0.00 4.03 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 0.00 151 S 8.06 4.47 0.00 2.72 3.46 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 0.00 152 V 7.89 4.71 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 0.91 0.00 0.00 0.33 0.00 0.00 153 D 8.65 4.76 0.00 3.09 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 0.00 154 A 8.83 4.43 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 0.00 155 K 9.39 4.36 0.00 1.81 1.58 0.00 1.63 0.00 0.00 1.42 0.00 0.00 2.87 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.47 1.44 7.81 156 G 6.76 2.35 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 0.00 157 I 6.47 4.50 1.16 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.36 0.51 0.00 0.00 158 Y 7.70 4.82 0.00 2.27 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 159 Y 8.24 5.36 0.00 3.25 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 0.00 160 T 8.61 5.09 4.36 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 1.31 0.00 0.00 161 C 9.07 4.82 0.00 3.07 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 0.00 162 G 8.22 4.09 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 0.00 0.00 0.00 163 Q 8.14 4.25 0.00 1.47 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.08 6.87 0.00 0.00 0.00 0.00 0.00 2.04 2.07 0.00 164 F 7.55 4.81 0.00 3.17 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 0.00 165 K 8.55 4.89 0.00 1.49 1.22 0.00 1.33 0.00 0.00 0.61 0.00 0.00 2.88 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.29 1.37 7.81 166 T 7.99 4.38 2.77 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 1.05 0.00 0.00 167 Y 8.77 4.52 0.00 2.70 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 0.00 168 Y 8.19 4.83 0.00 2.92 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 0.00 169 V 7.23 4.24 1.67 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 0.60 0.00 0.00 1.00 0.00 0.00 170 N 8.56 4.45 0.00 2.65 2.54 0.00 0.00 7.18 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 0.00 171 F 7.79 4.03 0.00 2.63 1.84 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 0.00 172 N 7.75 3.44 0.00 2.83 2.90 0.00 0.00 7.30 6.75 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 0.00 173 K 8.79 3.79 0.00 1.75 1.83 0.00 1.87 0.00 0.00 1.57 0.00 0.00 2.84 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.38 1.34 7.81 174 E 8.86 4.14 0.00 2.24 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 0.00 2.58 3.02 0.00 175 A 8.19 4.30 1.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176 Q 8.07 4.12 0.00 2.04 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.09 6.85 0.00 0.00 0.00 0.00 0.00 2.37 2.65 0.00 177 K 6.83 3.91 0.00 0.79 1.03 0.00 1.54 0.00 0.00 1.74 0.00 0.00 2.79 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.21 1.18 7.81 178 Y 7.71 4.80 0.00 2.42 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 179 G 9.66 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 180 S 8.72 4.27 0.00 3.65 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 0.00 181 T 7.79 4.56 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 1.21 0.00 0.00 182 N 8.80 5.33 0.00 2.69 2.66 0.00 0.00 6.29 7.90 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 *183 H 8.27 4.76 0.00 2.90 2.85 0.00 7.17 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 184 W 7.55 5.48 0.00 3.06 3.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 185 E 9.46 4.54 0.00 1.91 1.71 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 2.13 2.16 0.00 186 V 8.78 4.42 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 0.94 0.00 0.00 0.65 0.00 0.00 187 C 9.10 5.12 0.00 2.84 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 0.00 188 Y 9.48 4.65 0.00 2.84 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 0.00 189 G 9.45 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 S 7.98 4.09 0.00 3.83 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 0.00 191 T 7.35 4.65 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 1.26 0.00 0.00 192 V 8.16 4.92 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 0.87 0.00 0.00 0.93 0.00 0.00 193 I 8.79 4.57 1.97 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.74 1.00 0.00 0.00 194 C 8.10 4.97 0.00 2.87 2.68 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 0.00 195 S 7.54 3.98 0.00 3.55 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 * Residues marked with a * may have inaccurate shift predictions.