NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 E 4.2910 8.3027 120.2274 55.7769 30.9786 174.4260 2 V 3.8554 8.1597 122.9030 62.6289 32.2327 173.6789 3 K 4.6833 9.9160 127.9232 54.7761 36.2710 174.9404 4 L 4.9741 8.6044 123.4477 52.9001 43.4426 174.4273 5 L 4.4722 8.7564 123.0503 53.4358 42.6117 175.9686 6 E 5.0744 8.8062 124.0069 56.3531 30.9703 175.8837 7 S 4.5041 9.3177 115.9533 57.9380 66.7678 175.1248 8 G 3.9715 9.2239 107.2793 45.2015 0.0000 174.0641 9 G 3.8287 7.4019 108.9355 44.4922 0.0000 172.7156 10 G 3.5697 7.5985 104.6660 44.4196 0.0000 171.7565 11 L 4.7198 8.1691 124.3177 54.7729 42.9707 177.5041 12 A 4.8609 9.0271 127.2651 50.1813 22.9561 175.0179 13 Q 4.6477 8.4866 118.4510 54.2040 30.7510 174.0423 14 P 4.6179 0.0000 0.0000 64.3814 31.8916 176.3208 15 G 4.0288 9.5090 111.9516 45.3356 0.0000 174.0160 16 G 4.0267 7.8391 107.0165 45.8489 0.0000 172.6772 17 S 5.2420 8.0962 114.2022 56.7845 66.1388 173.0005 18 L 4.3190 8.5636 119.9647 53.8516 45.8264 173.4630 19 K 4.7692 8.4815 126.6372 54.6672 33.9439 175.2435 20 L 4.7478 8.6445 128.7715 54.2299 43.5306 176.1447 21 S 5.4678 9.1856 115.4610 57.5455 67.5390 172.1560 22 C 5.2184 8.9547 119.9216 55.5895 46.4770 172.1497 23 A 5.0814 8.9373 128.2704 50.1072 20.9861 175.1142 24 A 5.3739 8.2760 124.0243 50.2726 21.9210 175.5755 25 S 4.2374 8.6774 114.2279 57.8668 67.0754 175.1624 26 G 3.9186 10.7355 107.0608 46.4416 0.0000 172.7389 27 F 4.8841 6.9205 112.2898 55.6450 40.6996 174.6220 28 D 4.6770 8.7925 121.6919 52.5354 39.4945 175.7255 29 F 4.1512 8.2826 125.9551 61.0018 39.7616 177.3540 30 R 3.9690 8.3157 117.8260 59.0964 29.8496 177.3988 31 R 4.2015 8.2583 114.6162 56.4309 30.7245 175.7183 32 Y 4.7151 7.4452 116.1549 55.6321 39.9945 175.6787 33 W 4.3861 8.8637 123.5655 57.1467 30.6136 174.9937 34 M 5.2567 9.1372 121.8394 54.0243 35.7513 174.7461 35 T 5.1809 8.8175 117.0087 61.7639 73.5405 172.8388 36 W 5.2526 8.7673 123.5970 55.1396 32.0472 175.2379 37 V 5.1519 9.1793 122.7512 61.3123 35.0323 174.1773 38 R 4.9424 9.2166 121.5646 54.5877 33.6147 174.2144 39 Q 4.8579 8.8549 120.5835 54.3344 32.0435 174.2178 40 A 4.5077 8.6360 128.5640 50.9461 20.1088 174.7394 41 P 4.3540 0.0000 0.0000 64.0688 31.7015 176.9988 42 G 3.9510 9.0501 110.1319 46.0027 0.0000 172.4176 43 K 4.6523 7.8481 118.2319 53.9832 35.5508 175.3655 44 G 4.0044 8.2765 108.9206 44.7752 0.0000 172.9077 45 L 4.6729 8.1568 118.6461 54.3103 42.9456 176.7996 46 E 4.6662 9.3191 123.0224 53.9554 32.6797 174.4767 47 W 4.4823 9.1726 135.0000 58.2244 31.1541 175.1301 48 I 3.8378 8.2046 128.4764 61.6993 38.2615 176.0148 49 G 3.1638 6.3209 105.9313 46.0549 0.0000 170.8253 50 E 5.4846 8.4415 116.7737 54.8936 33.4744 174.2473 51 I 4.9891 8.9044 121.5022 59.1917 41.6989 174.6652 52 N 3.2484 7.8019 125.8948 50.7334 38.6516 174.2333 52A P 3.9518 0.0000 0.0000 65.5618 31.2039 177.3655 53 D 4.5893 7.6859 113.0923 52.7401 39.6472 176.0477 54 S 3.8154 7.5786 114.3989 60.3970 60.2897 171.5181 55 R 4.3511 8.4150 120.3634 56.4313 32.0018 176.4382 56 T 4.5331 7.7573 114.6979 61.8241 70.6804 173.8081 57 I 4.5456 8.3982 127.4959 59.6701 39.7827 174.6331 58 N 5.1014 8.8245 125.1958 52.0183 40.7007 174.2032 59 Y 4.9552 8.4430 118.6051 55.8350 42.4730 174.8490 60 M 4.3882 8.9977 122.1286 55.3810 33.0864 175.1408 61 P 4.2664 0.0000 0.0000 66.0441 31.9387 177.9653 62 S 4.0632 8.3713 110.7804 61.3287 61.9635 174.8603 63 L 4.4449 8.0138 117.6210 54.2503 41.5723 178.0667 64 K 3.4705 7.7087 121.0743 59.4051 32.4882 177.5395 65 D 4.5994 7.4029 118.5284 50.0195 38.3652 174.0323 66 K 4.4063 6.9191 130.4450 56.8392 36.8746 174.6866 67 F 5.2503 8.2073 116.6269 55.4699 41.8977 175.1564 68 I 4.6891 8.5974 123.5764 59.6840 39.8935 174.4681 69 I 5.1300 8.9564 128.6046 60.0721 38.9287 175.1990 70 S 4.9984 8.9872 119.5949 57.4232 67.0872 172.5682 71 R 5.1279 8.5038 114.9465 55.0607 32.6306 174.5517 72 D 4.8152 9.4385 120.5110 52.4112 42.7349 175.8186 73 N 4.6098 8.9742 124.0306 55.9359 38.9755 177.6250 74 A 4.0862 7.8701 120.1816 54.1081 18.5685 178.1800 75 K 4.3075 8.0317 113.4767 55.2936 32.8231 176.1803 76 N 3.1559 7.3925 115.7990 54.1316 36.7705 173.8479 77 S 4.7528 6.9394 111.9122 56.4455 67.7845 174.1847 78 L 5.0287 8.5715 125.0789 53.4990 45.1972 174.6959 79 Y 5.6545 9.3959 121.9804 56.2977 42.5037 174.4601 80 L 4.7531 8.9255 123.6999 53.4733 45.3851 174.6943 81 Q 4.6947 9.2153 128.9843 54.6589 30.7756 173.9891 82 L 4.5121 8.9750 128.1249 52.9376 43.9997 175.8211 82A S 4.6954 8.0136 116.9325 55.8816 66.7761 173.4469 82B R 3.7125 8.3311 115.9141 57.1640 27.4235 177.3311 82C L 4.3100 7.6665 117.2989 54.8043 42.6778 177.4595 83 R 4.9740 9.2769 121.9400 53.7251 33.8988 176.8076 84 S 4.1942 8.6045 113.1845 61.5643 62.9880 176.5328 85 E 4.0694 8.2200 119.2859 58.9666 29.2620 177.3764 86 D 4.7519 8.2110 117.2373 55.3622 41.2947 176.6704 87 S 4.5985 8.1298 116.7552 59.1216 63.2350 173.5313 88 A 4.3723 8.6503 125.0993 51.3836 23.5946 174.5888 89 L 4.6142 8.1411 119.5940 54.4855 43.3002 175.9877 90 Y 4.8984 8.8404 121.6390 56.5142 40.3634 174.1632 91 Y 5.5094 9.8161 123.5756 56.3681 40.8636 174.2021 92 C 3.8946 10.6468 125.8735 55.9761 44.0189 172.3717 93 V 4.6063 8.1638 125.8435 60.9009 34.7997 173.9976 94 R 4.4815 8.6453 128.4763 55.4473 31.5456 174.4989 95 L 4.9257 8.4310 128.8087 53.6267 43.6182 174.9301 96 D 5.0036 9.3408 127.9023 53.4386 42.3047 175.2363 97 F 4.7280 8.7044 128.1556 57.2307 41.7767 174.9738 98 D 4.5929 7.9112 116.0996 53.4875 43.3898 176.1807 99 V 3.5438 8.0889 123.7636 65.9021 32.1914 177.4923 100 Y 3.9540 8.3118 115.1782 61.4363 37.6046 177.4628 100A N 4.4324 8.0314 113.2797 53.2751 39.3228 174.7497 100B H 4.1052 7.7096 114.6526 56.6435 26.4903 174.1741 100C Y 4.6486 6.4586 119.5297 56.1726 42.7012 174.1096 100D Y 4.7856 7.7465 123.1497 56.3634 42.1405 174.6510 100E V 4.2382 8.4472 123.0021 61.2914 35.6506 174.2478 100F L 4.8410 8.7084 127.9360 54.2859 40.4732 175.5009 101 D 4.6274 8.7644 123.6401 54.4851 41.1399 176.7632 102 Y 4.7607 7.8317 116.3298 55.4837 40.9512 174.8691 103 W 5.0507 8.9819 123.1326 54.5196 32.0490 175.8783 104 G 3.9800 9.6401 112.6209 46.3277 0.0000 174.0916 105 Q 4.3489 8.9080 120.0774 57.1416 29.1698 177.9513 106 G 4.5040 9.1023 102.6991 45.1755 0.0000 172.2078 107 T 4.6803 8.1631 113.4104 59.9456 70.8483 172.7045 108 S 4.9377 8.6027 122.7726 57.8464 64.3730 172.6515 109 V 4.9145 8.9400 125.9473 61.4425 34.6507 174.0562 110 T 4.8945 8.6396 123.9937 61.7275 71.6964 172.9760 111 V 4.7074 8.5293 127.3189 61.8823 32.5584 174.9798 112 S 4.7877 8.5152 119.8939 57.9100 65.5806 175.8457 113 S 4.4226 9.0833 119.6854 58.7312 63.6264 174.3899 114 A 4.0701 7.6601 124.7526 52.3229 18.6024 177.3303 115 S 4.7780 8.1614 115.0922 57.0413 64.9446 174.2194 116 T 4.5413 8.2743 117.8891 63.9797 69.2158 173.9814 117 K 4.6302 9.5054 125.9884 54.8398 35.6874 175.8926 118 G 4.2588 8.9120 114.8305 45.2731 0.0000 171.3188 119 P 4.9735 0.0000 0.0000 62.3294 32.8917 175.7143 120 S 4.4070 8.7065 117.4668 57.6239 64.7918 173.3916 121 V 4.5595 7.6599 122.5226 61.1156 33.4964 174.5033 122 F 5.3727 8.9797 127.2916 54.8254 42.0623 173.2897 123 P 4.8148 0.0000 0.0000 63.1195 32.4898 176.4761 124 L 5.0348 9.6191 123.4838 52.1148 42.0008 174.7325 125 A 4.5986 8.3426 125.1229 51.1335 19.4178 175.3238 126 P 4.6869 0.0000 0.0000 62.2535 33.7787 175.1145 127 S 4.8599 8.2400 114.0469 56.1649 65.2127 174.6653 128 S 4.1912 8.8621 121.1732 60.4456 62.3807 175.0733 129 K 4.2562 8.2911 117.8785 57.1466 33.1433 176.6780 130 S 4.8990 7.8625 116.2844 57.2521 62.8115 173.5034 124 T 5.0448 9.6091 115.2838 58.8148 69.4008 171.8325 125 S 4.7486 8.4126 117.0229 56.9335 64.1178 172.1238 126 G 4.2269 8.6756 109.1215 44.0535 0.0000 172.7145 127 G 4.3499 8.2600 107.1469 42.9649 0.0000 174.9653 128 T 4.0712 8.7021 119.0732 63.9456 68.3807 175.1733 129 A 4.2562 8.2411 121.2785 53.4466 19.1433 177.8780 130 A 4.7490 7.7925 124.3844 51.4521 18.1115 176.7034 140 L 4.7357 8.4898 120.7210 54.8669 44.6765 175.3620 141 G 4.3639 7.8725 104.7806 46.5486 0.0000 172.7907 142 C 5.4718 9.3458 116.7404 55.0759 42.6458 173.4266 143 L 4.8453 9.4789 126.2216 53.9576 43.2992 175.4984 144 V 4.5824 9.0803 128.6114 61.5196 32.5047 174.1839 145 K 4.8040 8.9086 130.0096 54.8587 35.2674 174.8802 146 D 4.6125 8.7187 124.1094 55.7500 37.4817 172.1752 147 Y 5.2571 7.7646 117.9145 55.5789 42.3994 176.2168 148 F 5.2299 9.2233 120.8780 56.9987 43.5516 172.1697 149 P 3.8638 0.0000 0.0000 61.0420 33.5758 175.0926 150 E 4.1447 8.1856 118.7522 56.1312 29.7826 174.5523 151 P 4.8253 0.0000 0.0000 61.4668 33.6652 174.5380 152 V 4.6153 7.9006 111.1221 59.6550 34.3925 175.4610 153 T 4.6144 8.2775 113.9337 60.0611 71.3305 173.5400 154 V 5.1916 8.2585 123.2276 60.0706 35.2672 174.4614 *156 S 4.9833 8.3709 120.4968 58.3312 65.3708 171.9634 157 W 5.2717 8.2904 118.5034 53.3702 31.9722 176.4669 *162 N 4.6278 8.2359 122.8434 54.4625 39.1529 174.4935 163 S 3.8151 10.1355 106.5149 59.4489 61.6298 174.6870 164 G 4.0016 8.5474 108.2217 45.3238 0.0000 175.3887 165 A 3.9955 7.9976 122.0829 53.9665 18.5319 177.0990 166 L 4.6611 7.8308 118.0088 53.7735 42.7642 175.5303 167 T 4.4798 8.3788 115.0946 62.7100 70.9475 175.1553 168 S 3.9768 8.0113 117.1948 59.9521 63.4065 174.8110 169 G 3.6796 8.6121 112.2098 45.7007 0.0000 172.7171 *171 V 4.1823 7.3763 118.4056 63.0209 32.7306 174.2939 172 H 4.7150 9.0087 123.7393 54.4469 32.3385 172.3799 173 T 4.7603 8.4201 120.7789 62.0925 69.4018 175.0193 174 F 4.3635 8.9688 125.9579 56.0791 40.0366 174.1288 175 P 4.2841 0.0000 0.0000 63.0080 31.7206 176.3664 176 A 4.5503 8.6308 123.8723 52.3397 19.3713 176.7138 177 V 4.4980 9.1600 120.0693 60.9847 34.8971 174.2950 178 L 4.3293 8.4022 128.7092 53.7372 42.7819 176.1573 179 Q 4.4523 8.6803 126.4112 54.9888 29.8755 177.6416 180 S 3.9578 8.6021 114.9542 61.0257 63.2163 176.1982 *182 S 4.3721 7.4235 113.5619 57.2966 64.3842 174.6933 183 G 3.7536 8.2386 109.0313 44.7985 0.0000 172.9190 184 L 4.7205 7.2258 119.4869 53.2162 44.6711 175.5539 185 Y 4.7920 8.6100 119.3195 57.4250 40.2548 174.5908 186 S 5.4490 8.9033 114.9478 57.3867 66.5264 172.7943 187 L 5.2101 9.3596 125.3433 54.7284 44.2956 174.3712 188 S 5.3976 8.8874 113.4951 56.7596 66.9530 172.5158 189 S 5.4984 9.2446 115.3337 56.9408 65.5895 173.1507 190 V 5.0921 9.2580 119.1306 59.6129 36.1319 174.5529 191 V 4.5778 8.8201 122.5825 61.1675 34.4869 174.2623 192 T 5.5396 8.1880 117.3204 60.2404 70.7111 174.0945 193 V 4.5636 7.9540 115.8076 58.6778 36.1039 173.6353 194 P 4.4110 0.0000 0.0000 63.1050 32.0997 177.1286 195 S 4.1226 9.0684 119.8282 62.3083 62.6220 177.4048 196 S 4.3375 8.0666 114.8653 60.4661 62.8890 175.5596 197 S 4.5666 8.1227 116.7660 58.2520 62.9315 175.4849 198 L 4.1487 7.8078 124.9536 58.6326 42.0394 178.1628 199 G 3.8772 7.9174 103.7661 46.9680 0.0000 174.4240 200 T 3.8586 8.0444 118.1852 65.9247 68.7974 174.4713 *203 Q 4.2274 7.6108 117.5319 56.1343 29.6651 173.9444 *205 T 4.0047 7.9246 113.1253 63.6046 69.6353 173.2005 206 Y 5.1048 8.2883 121.6263 56.4577 41.2419 174.4749 207 I 5.1231 9.6507 125.9635 59.5168 40.8748 172.1817 208 C 3.8637 8.4666 122.2958 54.0254 37.7965 172.2191 209 N 5.3579 8.8148 121.2146 51.5506 40.4062 173.9780 210 V 4.5945 8.8799 124.2589 60.9966 34.5778 173.5085 211 N 5.2647 8.7997 126.7574 52.1398 42.0448 172.7856 212 H 4.6289 9.3017 125.4821 53.9816 31.3494 173.6546 213 K 3.8821 8.5884 125.0338 58.7715 32.2468 177.9447 214 P 4.1700 0.0000 0.0000 64.6858 31.2815 177.1184 215 S 4.6538 7.8301 110.4367 56.9889 63.3612 173.5820 216 N 3.8793 7.8489 116.4876 54.8740 36.7252 174.1484 217 T 4.4977 7.7008 114.0167 62.2688 70.2920 174.6054 218 K 5.0413 8.6077 125.6660 54.5009 35.2629 175.8825 219 V 4.3925 8.8045 124.0541 61.2023 35.2127 173.5099 220 D 5.2655 8.7916 127.1716 52.5062 43.0580 175.3183 221 K 4.4844 8.5679 125.9169 54.1739 34.4774 174.9534 222 K 4.5900 8.7787 129.6261 56.4219 33.1709 176.5387 223 V 4.2008 9.0442 128.4459 61.3112 32.1498 174.0844 *226 E 4.4893 8.3073 124.8023 55.0656 30.6997 174.5787 227 P 4.5759 0.0000 0.0000 63.1957 32.1156 176.7117 228 K 4.0447 8.0741 118.7026 57.5375 32.9878 174.9369 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ 1 E 8.30 4.29 0.00 2.06 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 2.33 2.33 0.00 2 V 8.16 3.86 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 0.38 0.00 0.00 0.17 0.00 0.00 3 K 9.92 4.68 0.00 1.72 1.66 0.00 1.66 0.00 0.00 1.64 0.00 0.00 2.82 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.36 1.53 7.81 4 L 8.60 4.97 0.00 1.55 1.60 1.03 1.18 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 5 L 8.76 4.47 0.00 1.62 1.64 0.93 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 6 E 8.81 5.07 0.00 1.95 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 2.59 2.46 0.00 7 S 9.32 4.50 0.00 3.87 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 8 G 9.22 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 9 G 7.40 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 10 G 7.60 3.57 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 0.00 0.00 0.00 11 L 8.17 4.72 0.00 1.65 1.59 0.97 1.05 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 12 A 9.03 4.86 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 Q 8.49 4.65 0.00 2.02 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 7.00 0.00 0.00 0.00 0.00 0.00 2.44 2.41 0.00 14 P 0.00 4.62 0.00 2.05 2.02 0.00 3.70 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.12 0.00 15 G 9.51 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 16 G 7.84 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 17 S 8.10 5.24 0.00 3.89 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 18 L 8.56 4.32 0.00 1.55 1.24 0.83 0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.00 0.00 0.00 0.00 0.00 0.00 19 K 8.48 4.77 0.00 1.65 1.59 0.00 1.68 0.00 0.00 1.59 0.00 0.00 2.47 0.00 0.00 2.42 0.00 0.00 0.00 0.00 1.29 1.36 7.81 20 L 8.64 4.75 0.00 1.07 1.47 0.35 0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 0.00 0.00 0.00 0.00 21 S 9.19 5.47 0.00 4.01 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 0.00 22 C 8.95 5.22 0.00 2.98 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 23 A 8.94 5.08 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 A 8.28 5.37 1.02 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 0.00 0.00 25 S 8.68 4.24 0.00 3.80 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 G 10.74 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27 F 6.92 4.88 0.00 3.03 2.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 D 8.79 4.68 0.00 2.92 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 29 F 8.28 4.15 0.00 2.65 3.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 R 8.32 3.97 0.00 2.05 2.02 0.00 3.27 0.00 0.00 3.24 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.76 0.00 31 R 8.26 4.20 0.00 1.62 1.59 0.00 3.21 0.00 0.00 3.10 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.66 0.00 32 Y 7.45 4.72 0.00 3.07 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 33 W 8.86 4.39 0.00 3.27 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 34 M 9.14 5.26 0.00 1.78 1.82 0.00 0.00 0.00 0.00 0.00 2.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.33 0.00 35 T 8.82 5.18 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 1.44 0.00 0.00 36 W 8.77 5.25 0.00 3.27 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 37 V 9.18 5.15 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 1.36 0.00 0.00 0.93 0.00 0.00 38 R 9.22 4.94 0.00 1.10 1.40 0.00 2.48 0.00 0.00 3.02 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.41 0.00 39 Q 8.85 4.86 0.00 2.41 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.95 0.00 0.00 0.00 0.00 0.00 2.33 2.65 0.00 40 A 8.64 4.51 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 41 P 0.00 4.35 0.00 2.13 2.09 0.00 3.86 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.14 0.00 42 G 9.05 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 0.00 0.00 0.00 43 K 7.85 4.65 0.00 1.94 1.76 0.00 1.74 0.00 0.00 1.74 0.00 0.00 2.98 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.39 1.52 7.81 44 G 8.28 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 45 L 8.16 4.67 0.00 1.65 1.79 0.92 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 46 E 9.32 4.67 0.00 2.02 1.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 2.29 0.00 47 W 9.17 4.48 0.00 3.33 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 48 I 8.20 3.84 2.01 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 0.39 0.79 0.00 0.00 49 G 6.32 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 0.00 0.00 0.00 50 E 8.44 5.48 0.00 2.47 2.46 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 2.69 2.69 0.00 51 I 8.90 4.99 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 1.13 1.55 0.89 0.00 0.00 52 N 7.80 3.25 0.00 1.44 1.42 0.00 0.00 6.81 7.11 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 52A P 0.00 3.95 0.00 1.86 2.33 0.00 3.00 0.00 0.00 2.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.86 0.00 53 D 7.69 4.59 0.00 2.69 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 54 S 7.58 3.82 0.00 3.98 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 0.00 55 R 8.41 4.35 0.00 1.69 1.93 0.00 3.41 0.00 0.00 3.19 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.51 0.00 56 T 7.76 4.53 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 1.50 0.00 0.00 57 I 8.40 4.55 1.90 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.59 0.54 0.00 0.00 58 N 8.82 5.10 0.00 3.09 3.15 0.00 0.00 6.47 7.59 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 59 Y 8.44 4.96 0.00 2.83 2.73 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 0.00 0.00 0.00 60 M 9.00 4.39 0.00 2.09 2.24 0.00 0.00 0.00 0.00 0.00 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.85 2.64 0.00 61 P 0.00 4.27 0.00 2.26 2.18 0.00 3.80 0.00 0.00 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 2.21 0.00 62 S 8.37 4.06 0.00 3.84 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 L 8.01 4.44 0.00 1.46 1.13 0.58 0.50 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 64 K 7.71 3.47 0.00 1.81 1.85 0.00 1.84 0.00 0.00 1.76 0.00 0.00 3.06 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.32 1.30 7.81 65 D 7.40 4.60 0.00 2.76 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 66 K 6.92 4.41 0.00 1.89 2.16 0.00 1.77 0.00 0.00 2.09 0.00 0.00 3.10 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.57 1.53 7.81 67 F 8.21 5.25 0.00 2.95 2.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 68 I 8.60 4.69 1.87 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 1.22 0.68 0.98 0.00 0.00 69 I 8.96 5.13 1.89 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 1.49 0.77 1.12 0.00 0.00 70 S 8.99 5.00 0.00 4.01 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 71 R 8.50 5.13 0.00 2.10 2.00 0.00 2.91 0.00 0.00 3.27 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.71 0.00 72 D 9.44 4.82 0.00 2.95 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 73 N 8.97 4.61 0.00 2.86 2.96 0.00 0.00 6.93 7.86 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 74 A 7.87 4.09 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 75 K 8.03 4.31 0.00 1.76 1.77 0.00 1.95 0.00 0.00 1.74 0.00 0.00 2.98 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.37 1.39 7.81 76 N 7.39 3.16 0.00 2.43 2.17 0.00 0.00 6.77 8.31 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 77 S 6.94 4.75 0.00 3.47 3.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 L 8.57 5.03 0.00 1.84 1.39 1.10 -0.00 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 79 Y 9.40 5.65 0.00 2.98 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 80 L 8.93 4.75 0.00 0.27 0.14 0.97 0.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.59 0.00 0.00 0.00 0.00 0.00 0.00 81 Q 9.22 4.69 0.00 2.03 1.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.62 6.56 0.00 0.00 0.00 0.00 0.00 2.14 2.18 0.00 82 L 8.97 4.51 0.00 1.13 1.00 0.26 -0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 82A S 8.01 4.70 0.00 3.75 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82B R 8.33 3.71 0.00 1.93 2.00 0.00 3.20 0.00 0.00 3.23 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.60 0.00 82C L 7.67 4.31 0.00 1.73 1.58 0.82 1.22 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 83 R 9.28 4.97 0.00 1.83 1.83 0.00 3.16 0.00 0.00 3.24 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.55 0.00 84 S 8.60 4.19 0.00 4.06 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 85 E 8.22 4.07 0.00 2.04 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 2.36 2.38 0.00 86 D 8.21 4.75 0.00 2.89 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 87 S 8.13 4.60 0.00 3.94 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 88 A 8.65 4.37 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 89 L 8.14 4.61 0.00 1.49 0.94 0.99 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 90 Y 8.84 4.90 0.00 3.01 3.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 91 Y 9.82 5.51 0.00 2.95 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 92 C 10.65 3.89 0.00 2.53 2.88 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 93 V 8.16 4.61 1.54 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 -0.01 0.00 0.00 -0.16 0.00 0.00 94 R 8.65 4.48 0.00 1.73 1.58 0.00 2.21 0.00 0.00 2.26 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.44 0.00 95 L 8.43 4.93 0.00 1.84 1.95 1.04 1.52 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 96 D 9.34 5.00 0.00 3.11 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 97 F 8.70 4.73 0.00 2.89 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 98 D 7.91 4.59 0.00 2.85 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 99 V 8.09 3.54 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.85 0.00 0.00 1.08 0.00 0.00 100 Y 8.31 3.95 0.00 2.88 2.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 100A N 8.03 4.43 0.00 2.71 2.77 0.00 0.00 7.19 8.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 100B H 7.71 4.11 0.00 3.36 3.36 0.00 5.63 0.00 0.00 0.00 0.00 7.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 100C Y 6.46 4.65 0.00 3.04 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 100D Y 7.75 4.79 0.00 2.49 2.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 100E V 8.45 4.24 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 0.93 0.00 0.00 0.45 0.00 0.00 100F L 8.71 4.84 0.00 1.83 1.55 1.05 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 101 D 8.76 4.63 0.00 2.51 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 0.00 102 Y 7.83 4.76 0.00 2.73 2.84 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 0.00 103 W 8.98 5.05 0.00 3.01 3.11 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 0.00 104 G 9.64 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 105 Q 8.91 4.35 0.00 2.17 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.40 0.00 0.00 0.00 0.00 0.00 2.47 2.46 0.00 106 G 9.10 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 0.00 0.00 0.00 0.00 107 T 8.16 4.68 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 1.32 0.00 0.00 108 S 8.60 4.94 0.00 3.94 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 0.00 109 V 8.94 4.91 2.24 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 0.85 0.00 0.00 0.71 0.00 0.00 110 T 8.64 4.89 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 1.25 0.00 0.00 111 V 8.53 4.71 2.24 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 0.75 0.00 0.00 1.00 0.00 0.00 112 S 8.52 4.79 0.00 4.14 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 S 9.08 4.42 0.00 4.03 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 114 A 7.66 4.07 0.93 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 0.00 115 S 8.16 4.78 0.00 4.04 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 0.00 116 T 8.27 4.54 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 1.44 0.00 0.00 117 K 9.51 4.63 0.00 1.87 1.75 0.00 1.67 0.00 0.00 1.98 0.00 0.00 2.88 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.40 1.45 7.81 118 G 8.91 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 0.00 119 P 0.00 4.97 0.00 2.00 2.03 0.00 3.71 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 1.84 1.71 0.00 120 S 8.71 4.41 0.00 3.47 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 0.00 121 V 7.66 4.56 1.91 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 0.71 0.00 0.00 0.77 0.00 0.00 122 F 8.98 5.37 0.00 3.02 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 0.00 123 P 0.00 4.81 0.00 2.17 2.16 0.00 3.97 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.10 0.00 124 L 9.62 5.03 0.00 1.78 1.70 1.05 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 125 A 8.34 4.60 1.26 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 0.00 126 P 0.00 4.69 0.00 2.07 2.22 0.00 3.86 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 1.85 0.00 127 S 8.24 4.86 0.00 3.82 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 128 S 8.86 4.19 0.00 3.87 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 0.00 129 K 8.29 4.26 0.00 1.87 1.82 0.00 1.67 0.00 0.00 1.65 0.00 0.00 2.92 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.43 1.40 7.81 130 S 7.86 4.90 0.00 3.84 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 0.00 124 T 9.61 5.04 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 0.00 125 S 8.41 4.75 0.00 3.64 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 126 G 8.68 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 0.00 0.00 0.00 0.00 127 G 8.26 4.35 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 0.00 128 T 8.70 4.07 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 0.00 129 A 8.24 4.26 1.42 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 0.00 0.00 130 A 7.79 4.75 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 140 L 8.49 4.74 0.00 1.60 1.53 0.43 -0.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 0.00 0.00 0.00 0.00 141 G 7.87 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 0.00 0.00 0.00 0.00 142 C 9.35 5.47 0.00 2.85 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 0.00 143 L 9.48 4.85 0.00 1.88 1.80 1.08 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 144 V 9.08 4.58 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 0.79 0.00 0.00 0.88 0.00 0.00 145 K 8.91 4.80 0.00 1.98 1.77 0.00 1.98 0.00 0.00 1.86 0.00 0.00 2.98 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.45 1.49 7.81 146 D 8.72 4.61 0.00 2.96 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 0.00 147 Y 7.76 5.26 0.00 2.90 2.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 148 F 9.22 5.23 0.00 3.23 3.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 149 P 0.00 3.86 0.00 1.68 0.95 0.00 3.78 0.00 0.00 3.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.74 0.00 150 E 8.19 4.14 0.00 1.73 1.77 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 1.47 1.47 0.00 151 P 0.00 4.83 0.00 2.13 2.02 0.00 3.65 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 1.93 0.00 152 V 7.90 4.62 1.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 0.68 0.00 0.00 153 T 8.28 4.61 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 1.18 0.00 0.00 154 V 8.26 5.19 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 1.10 0.00 0.00 0.86 0.00 0.00 *156 S 8.37 4.98 0.00 4.00 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 0.00 157 W 8.29 5.27 0.00 3.50 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 *162 N 8.24 4.63 0.00 2.98 2.90 0.00 0.00 7.26 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 163 S 10.14 3.82 0.00 3.93 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 0.00 164 G 8.55 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 0.00 165 A 8.00 4.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 166 L 7.83 4.66 0.00 1.73 1.96 0.96 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 167 T 8.38 4.48 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 1.29 0.00 0.00 168 S 8.01 3.98 0.00 3.86 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 0.00 169 G 8.61 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *171 V 7.38 4.18 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 0.92 0.00 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3.96 0.00 3.96 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 *182 S 7.42 4.37 0.00 3.97 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 0.00 183 G 8.24 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 184 L 7.23 4.72 0.00 1.51 1.54 0.92 0.78 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 0.00 185 Y 8.61 4.79 0.00 1.67 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 0.00 0.00 0.00 0.00 186 S 8.90 5.45 0.00 3.91 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 187 L 9.36 5.21 0.00 1.94 1.95 1.05 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 188 S 8.89 5.40 0.00 4.00 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 0.00 189 S 9.24 5.50 0.00 4.08 4.02 0.00 0.00 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0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 198 L 7.81 4.15 0.00 1.86 1.79 0.86 1.06 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 0.00 199 G 7.92 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 0.00 200 T 8.04 3.86 4.51 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 1.21 0.00 0.00 *203 Q 7.61 4.23 0.00 2.04 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.06 6.66 0.00 0.00 0.00 0.00 0.00 2.22 1.78 0.00 *205 T 7.92 4.00 4.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 206 Y 8.29 5.10 0.00 3.06 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 0.00 207 I 9.65 5.12 1.92 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 1.34 0.97 0.94 0.00 0.00 208 C 8.47 3.86 0.00 1.48 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 209 N 8.81 5.36 0.00 2.56 2.74 0.00 0.00 6.04 7.58 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 0.00 210 V 8.88 4.59 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 0.86 0.00 0.00 0.74 0.00 0.00 211 N 8.80 5.26 0.00 2.81 2.55 0.00 0.00 6.14 7.93 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 0.00 212 H 9.30 4.63 0.00 2.95 3.05 0.00 5.65 0.00 0.00 0.00 0.00 6.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 213 K 8.59 3.88 0.00 1.78 1.80 0.00 1.70 0.00 0.00 1.79 0.00 0.00 2.89 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.49 1.42 7.81 214 P 0.00 4.17 0.00 1.88 2.04 0.00 3.04 0.00 0.00 3.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.96 0.00 215 S 7.83 4.65 0.00 4.03 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 0.00 216 N 7.85 3.88 0.00 2.84 2.90 0.00 0.00 6.84 7.09 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 0.00 217 T 7.70 4.50 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 1.17 0.00 0.00 218 K 8.61 5.04 0.00 1.56 1.64 0.00 1.66 0.00 0.00 1.60 0.00 0.00 2.87 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.28 1.44 7.81 219 V 8.80 4.39 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 0.81 0.00 0.00 0.86 0.00 0.00 220 D 8.79 5.27 0.00 2.53 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 0.00 221 K 8.57 4.48 0.00 1.79 1.57 0.00 1.50 0.00 0.00 1.71 0.00 0.00 2.96 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.34 1.42 7.81 222 K 8.78 4.59 0.00 1.85 1.75 0.00 1.83 0.00 0.00 1.67 0.00 0.00 2.92 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.51 1.51 7.81 223 V 9.04 4.20 2.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.00 0.00 1.25 0.00 0.00 *226 E 8.31 4.49 0.00 2.09 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 2.28 2.37 0.00 227 P 0.00 4.58 0.00 2.09 2.04 0.00 3.83 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.22 0.00 228 K 8.07 4.04 0.00 1.72 1.66 0.00 1.82 0.00 0.00 1.78 0.00 0.00 3.05 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.22 1.29 7.81 * Residues marked with a * may have inaccurate shift predictions.