NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 P 4.4378 0.0000 0.0000 62.1407 31.5724 175.9945 3 D 3.7590 8.4413 123.7572 52.1476 41.3330 174.2283 4 P 5.0816 0.0000 0.0000 60.5564 33.8149 175.3291 5 K 4.2850 8.1956 119.1606 55.2349 33.3225 177.7842 6 L 4.3207 8.3030 119.1497 56.2385 41.5117 178.1996 7 D 4.5261 7.9791 119.6608 55.7038 40.0307 177.2885 8 E 4.2779 7.9791 117.1520 57.1440 30.3968 176.4315 9 L 4.8369 7.5986 119.0567 53.8663 42.7307 176.2689 10 N 4.6686 9.7276 119.4195 53.3504 39.4751 175.4754 11 K 4.7985 8.3761 120.6417 54.4431 35.4449 177.7467 12 V 3.5351 8.4603 124.1104 66.2307 31.4160 178.7272 13 S 4.1854 8.4829 113.9235 61.4938 62.8590 176.1971 14 D 4.3553 8.1110 122.1010 57.1013 40.5191 177.7178 15 Y 4.0904 7.9824 119.6875 60.7718 38.8163 178.2710 16 K 3.8459 8.1385 120.3837 59.7025 32.0853 178.9623 17 S 4.1823 8.1126 114.4613 60.9940 62.6809 175.0001 18 N 4.6453 7.7792 118.1511 53.0254 38.6246 174.7924 19 K 3.8092 7.8066 115.7986 56.9788 30.0543 176.3852 20 G 2.8934 7.6395 107.4815 45.0858 0.0000 174.4936 21 T 4.2037 8.0022 117.7176 61.5222 69.3315 175.2641 22 M 4.1104 8.6120 127.3221 58.1270 32.1489 177.7852 23 G 3.7515 7.9588 106.4642 47.8697 0.0000 175.3064 24 N 4.1810 7.8617 118.5719 56.2461 38.3502 177.5793 25 V 2.9524 6.7821 118.9910 65.4077 31.5239 177.1964 26 M 4.1137 7.7882 118.2354 59.2815 31.9687 178.1983 27 N 4.5288 8.4598 116.2983 56.0796 38.4013 177.4290 28 L 3.9641 7.3089 118.5868 57.6730 41.6032 178.3743 29 Y 4.6155 7.7728 114.7371 59.0238 38.1341 177.5735 30 M 4.3562 8.4800 120.0212 56.9423 32.8293 177.2186 31 S 4.4923 7.6540 113.5297 57.5589 63.6999 172.4854 32 P 4.5157 0.0000 0.0000 62.3457 31.6314 174.7218 33 P 4.1635 0.0000 0.0000 62.0340 32.6440 175.8530 34 V 3.8154 8.2590 121.2594 62.9834 32.4477 174.7517 35 E 5.1242 8.5346 125.5778 55.0643 33.7247 174.5576 36 G 4.2648 8.7176 108.7307 45.1858 0.0000 171.7043 37 R 5.0146 8.1343 118.8872 54.4555 33.5157 175.7786 38 G 3.9019 8.9631 111.8805 46.9856 0.0000 173.8628 39 V 4.5216 7.9629 112.0067 59.2634 34.0022 175.3902 40 I 5.1854 8.0622 122.2080 59.0993 40.0293 175.6014 41 N 3.7599 8.6072 121.9881 52.7744 37.5793 175.1499 42 S 4.3288 8.3077 115.7377 60.2232 64.0749 173.6747 43 R 4.3876 7.0651 115.1036 56.1277 31.3858 172.7870 44 Q 4.7065 8.2699 115.1774 54.8618 32.0572 172.9002 45 F 4.6826 8.8884 120.0985 58.1925 41.0551 177.0039 46 L 4.2530 8.2500 119.3995 52.8583 43.5764 177.8544 47 S 4.2749 8.2624 113.5886 60.3375 63.4141 174.4499 48 H 4.8342 7.8376 116.7724 55.1448 28.5604 173.3073 49 D 5.4017 7.7647 118.6065 52.0439 42.8752 174.7291 50 L 4.7552 9.0872 118.0744 53.0527 46.2843 175.6135 51 I 4.9246 8.4670 123.5700 59.5424 40.0289 174.5922 52 F 5.0205 9.0520 125.2173 54.3736 42.1654 173.9657 53 P 5.2627 0.0000 0.0000 61.7323 28.9429 175.5225 54 I 4.8771 7.6268 113.6784 59.4245 41.5291 176.7074 55 E 5.0179 8.8570 122.7493 55.9817 30.3992 175.4669 56 Y 4.6401 8.5171 125.5237 56.2437 42.0662 174.9327 57 K 3.8808 7.9604 128.3359 58.0734 31.2372 176.4046 58 S 4.4091 8.5948 121.7976 59.4556 63.4055 173.5075 59 Y 4.4447 8.3782 120.3516 57.8283 38.6218 175.4540 60 N 5.1314 8.7667 117.8560 53.3486 41.0519 173.9602 61 E 5.2425 8.2028 116.6012 54.6353 34.1831 174.8468 62 V 4.5367 8.6814 121.1218 61.0712 35.3769 173.9910 63 K 4.7400 8.7987 129.3992 55.4769 33.6915 174.7934 64 T 4.9951 9.1430 122.9065 60.3687 70.0016 172.3890 65 E 4.9030 8.5374 128.8609 54.5433 31.9004 174.8405 66 L 5.1899 8.7353 126.4127 52.9175 44.0268 176.4801 67 E 4.1124 8.7484 121.2590 58.8996 29.9923 176.4529 68 N 4.9488 7.6476 114.7677 50.8082 41.4671 175.2179 69 T 4.0529 8.4228 116.7888 66.7086 68.4550 176.5126 70 E 3.9087 8.1738 120.7785 59.0833 29.4366 178.2206 71 L 3.9693 8.6131 120.5438 58.3663 42.1461 178.8497 72 A 4.3590 8.0488 120.3692 55.4165 18.0844 179.3988 73 N 4.3898 8.3763 114.4154 56.1465 38.6085 176.6012 74 N 4.3035 7.9557 118.0843 56.1184 39.1605 174.8115 75 Y 4.8051 7.3502 116.0730 57.6174 39.9084 175.6782 76 K 4.2777 7.9380 121.9329 57.6387 32.5171 177.2008 77 G 3.9775 9.8317 114.2132 45.6907 0.0000 173.3124 78 K 4.6959 7.7869 118.6398 54.4836 34.6506 176.2462 79 K 4.5228 8.6454 124.1434 56.6229 33.1675 176.1111 80 V 5.1676 9.0036 120.0709 59.8504 36.4381 174.1495 81 D 5.3111 9.1972 121.4248 52.8092 43.8136 175.7291 82 I 4.7626 8.2090 121.8054 59.5385 40.6810 174.8349 83 F 4.6130 8.9281 129.0802 57.7212 42.7864 173.3551 84 G 3.9982 8.1427 112.8883 46.0452 0.0000 171.1718 85 V 4.4334 8.8494 121.8585 60.8300 31.7310 174.5647 86 P 4.7386 0.0000 0.0000 62.5625 32.7815 174.5795 87 Y 4.4512 7.6695 117.8152 56.0522 41.7032 175.1950 88 F 4.3771 8.6811 114.8251 57.9824 41.9281 174.9635 89 Y 4.6988 8.3350 120.7380 59.0162 38.9173 175.7867 90 T 3.4272 8.7886 116.2198 61.5226 67.6604 172.4264 91 C 4.3434 8.1026 123.0974 56.7598 44.0273 172.3905 92 I 4.8253 8.1918 126.9188 59.7216 39.4685 175.3846 93 I 4.1628 8.6777 128.3124 58.8619 39.6144 173.6073 94 P 4.4314 0.0000 0.0000 61.8204 32.0929 176.8137 95 K 4.2418 8.4308 121.4022 56.0447 32.7485 177.6153 96 S 4.2695 8.4095 115.9414 61.5987 62.7604 177.0690 97 E 4.5464 7.6608 115.4699 57.2755 31.1813 176.0316 *103 N 4.6742 8.1847 116.3734 52.7135 40.4969 174.9357 104 F 5.0071 7.0209 112.5613 56.2252 38.4308 175.3404 105 G 4.2413 7.8710 109.9204 44.6676 0.0000 175.3257 106 G 4.1719 7.3220 105.2301 46.4040 0.0000 170.6870 107 C 4.3721 7.9720 122.1781 57.5702 34.3204 174.5482 108 C 5.3555 7.3799 122.4241 55.4994 43.4827 172.2326 109 M 5.0327 8.0337 116.3560 55.4716 34.5953 172.6837 110 Y 4.9736 8.7562 115.9517 56.5118 40.5074 177.7269 111 G 3.6005 9.7542 111.4031 49.0118 0.0000 175.5324 112 G 3.9596 8.9869 112.5324 44.4286 0.0000 171.6731 113 L 5.0342 7.6741 119.4073 52.9828 43.8066 176.0581 114 T 4.5680 8.3480 111.5214 59.6801 72.7097 173.1115 115 F 4.8749 8.3954 121.7926 57.4943 39.7047 174.8870 116 N 4.7907 8.9969 122.5441 54.0119 39.9734 174.4165 117 S 4.6383 8.4722 117.9973 57.0719 65.5252 175.2369 118 S 4.2396 8.8969 123.7995 61.5813 62.7127 175.4139 119 E 4.1790 7.8368 117.9501 58.0275 29.4666 177.3182 120 N 4.6453 7.7013 116.9735 51.8063 36.9935 172.5648 121 E 4.4127 7.7134 118.3736 55.0230 32.6051 173.5137 122 R 4.1306 8.7465 127.0003 55.2058 29.9988 176.1992 123 D 4.7526 8.5060 120.2220 54.6510 41.7673 175.9192 124 K 4.5889 9.2153 121.7218 55.1356 34.5923 175.3183 125 L 5.1609 8.3447 122.6143 53.2478 43.9446 176.0428 126 I 4.6542 8.9232 123.8166 59.7215 41.1408 174.2886 127 T 4.5702 8.4464 117.2312 60.3370 70.6765 174.0841 128 V 4.0109 8.2151 125.5360 61.1069 33.4916 174.2654 129 Q 4.4068 8.1865 127.5492 54.9295 29.8446 174.8861 130 V 4.4510 8.5079 124.2664 61.2622 34.2988 174.3228 131 T 4.9181 8.3255 124.0079 61.7312 71.7261 172.7928 132 I 4.7372 8.5062 127.1932 59.8985 39.9728 175.8383 133 D 4.5175 9.6817 127.9558 55.7408 38.8109 173.7477 134 N 4.1135 8.3523 112.1643 54.2126 38.2022 173.2433 135 R 4.3411 7.7647 116.7827 54.9985 30.1257 175.9193 136 Q 4.6254 8.4627 125.4259 55.8974 27.0449 174.8143 137 S 4.7814 8.2101 117.8603 57.7934 65.4360 173.5862 138 L 4.9846 7.8321 118.2851 52.9793 45.8131 175.7929 139 G 4.4681 8.4331 106.6266 45.0399 0.0000 171.6709 140 F 4.9624 8.2066 116.7509 55.1872 41.9088 173.0144 141 T 4.9736 8.2859 108.7674 59.7397 71.3842 172.9980 142 I 4.8887 8.7143 116.8625 59.3721 41.4096 173.9450 143 T 5.6659 8.2921 111.0125 59.3368 72.1133 173.0126 144 T 4.7683 8.1263 115.9777 60.4946 71.0443 173.6570 145 N 4.6583 8.9237 123.6623 53.0938 37.8665 174.6562 146 K 4.5788 7.7284 119.6821 55.4988 33.4999 176.2971 147 N 4.5281 9.9496 122.4930 56.2486 39.5536 174.8112 148 M 5.1924 8.0212 117.6367 53.5424 33.7224 175.9478 149 V 4.6529 8.6073 123.1622 59.6296 35.0044 175.6132 150 T 4.4771 8.2864 112.1339 61.3829 69.8555 175.4073 151 I 3.4850 8.4429 124.7885 64.5240 36.9708 178.2771 152 Q 3.4812 8.1502 119.9017 59.2463 28.6717 178.1636 153 E 3.6203 7.9878 119.8119 59.2827 29.5561 178.8302 154 L 4.0169 7.5315 118.1545 57.8147 41.6988 178.9206 155 D 4.6803 8.9518 118.2465 57.7345 41.3100 177.3801 156 Y 4.6145 8.6522 120.3846 61.2155 38.7903 178.5903 157 K 4.1740 8.4376 118.8686 59.2302 32.1748 179.2800 158 A 4.4138 8.3167 121.1015 55.6287 18.4040 180.0415 159 R 3.8932 8.5087 116.9815 59.3547 30.0239 178.8278 160 H 4.2984 8.6457 120.0154 58.3133 29.7482 177.0299 161 W 3.8796 8.1688 130.1919 60.5694 30.4347 178.0038 162 L 3.8625 7.9280 118.7206 57.9218 40.7472 179.7001 163 T 3.9635 7.7263 115.2090 66.2547 68.5208 176.6478 164 K 3.9435 7.7769 120.7148 58.9726 32.3108 177.9332 165 E 4.1213 7.6362 116.9857 56.3373 29.4490 176.9413 166 K 4.4383 7.2372 116.4399 55.3741 33.4335 176.4034 167 K 4.0322 8.0628 116.3931 57.0782 29.5354 177.5921 168 L 4.1437 7.4296 122.4477 57.8882 41.9607 176.8825 169 Y 5.0843 7.6297 113.0304 56.2308 41.0387 174.1538 170 E 4.9170 9.2820 122.1359 54.1696 33.7847 176.5775 171 F 4.1561 8.9495 120.5495 61.1070 39.3624 175.5339 172 D 5.0297 8.7021 118.2838 52.1873 42.7887 176.7215 173 G 4.1417 6.9907 105.7475 45.7117 0.0000 172.6265 174 S 4.7352 7.8914 116.8351 57.5574 64.8752 176.4029 175 A 3.7768 8.4350 127.3836 53.7683 18.0819 177.5146 176 F 4.9469 7.9249 113.9205 55.8547 42.0725 174.5151 177 E 4.5259 9.4178 122.0888 57.5588 31.8112 175.5139 178 S 4.9219 7.2963 111.2326 57.5966 66.5055 174.2103 179 G 4.5213 8.8175 107.2530 47.1006 0.0000 171.0465 180 Y 5.5412 8.0085 116.1757 56.0094 41.7292 173.4755 181 I 4.7436 8.9561 121.2727 59.2258 40.9488 174.1014 182 K 5.0861 9.1138 129.5660 54.7175 35.3256 174.4826 183 F 4.9848 8.9447 126.3212 55.8956 41.7687 174.8100 184 T 4.9709 8.5866 119.2260 61.8419 71.6585 174.0965 185 E 4.5789 9.2754 126.7763 54.9369 30.8690 177.5226 186 K 3.8117 8.8681 121.7946 60.0519 31.9510 177.3883 187 N 4.6022 8.1856 111.4806 52.7155 36.8315 174.2687 188 N 4.2132 8.1740 113.3465 54.6561 37.1343 174.3975 189 T 4.4693 7.8277 108.4128 61.3079 70.1504 173.4970 190 S 5.2105 8.2230 115.8910 57.6714 66.3128 172.5329 191 F 5.2151 8.3221 115.0209 55.8028 41.4711 172.6902 192 W 5.6747 7.9922 115.3189 55.0412 31.7201 174.0248 193 F 5.2736 9.1612 118.7319 55.5655 41.9457 174.4017 194 D 5.1885 9.0930 122.9620 54.6751 41.1555 176.1833 195 L 4.3190 9.0381 125.8865 56.3522 42.1732 177.0882 196 F 5.2850 8.6877 117.2279 54.6250 41.6667 173.5509 197 P 4.8535 0.0000 0.0000 62.1778 32.2564 176.5560 198 K 4.2939 8.6243 119.7482 56.3067 32.5894 178.5195 199 K 4.3960 8.7365 121.2581 59.7837 32.7375 178.0461 200 E 4.1239 8.2062 117.7717 58.1574 30.3671 176.9048 201 L 4.3998 8.0019 124.0825 53.7936 40.7778 175.9832 202 V 4.4811 7.1900 117.8561 60.1734 34.6179 173.1806 203 P 4.4799 0.0000 0.0000 62.3043 31.8794 175.5395 204 F 4.6880 8.7364 121.8151 57.6006 39.8632 174.9648 205 V 3.9640 7.3044 127.6330 60.1316 31.8167 173.8414 206 P 3.6210 0.0000 0.0000 65.1791 30.7473 178.0483 207 Y 3.8041 6.7217 113.3473 59.7735 37.5221 178.2238 208 K 3.8433 6.5602 117.7017 57.4876 32.2414 177.9745 209 F 4.2485 7.3400 119.9217 59.7741 40.3177 176.5792 210 L 4.1029 7.9221 117.0683 55.3235 41.8062 177.8674 211 N 3.1400 7.0980 117.0510 53.4791 37.0541 176.6549 212 I 3.4519 6.9480 115.1295 63.9100 37.4750 176.4194 213 Y 4.7479 7.4295 117.0565 58.2830 38.1252 177.2645 214 G 3.9597 8.3240 108.9074 46.9670 0.0000 174.9901 215 D 4.6676 8.0794 118.7432 53.7270 39.8014 175.3938 216 N 4.1351 8.0704 117.6137 54.0870 38.2402 173.8067 217 K 4.0632 8.1791 117.4549 56.4391 33.2454 175.5177 218 V 4.9791 8.3987 126.4044 61.3710 34.5405 174.4964 219 V 4.6386 8.7320 118.6875 59.5628 37.2265 173.8170 220 D 5.0948 8.6003 121.9601 53.8679 41.3265 177.0627 221 S 4.2770 9.2192 122.5557 61.0497 63.0391 176.1540 222 K 4.1455 8.5539 120.0637 58.4647 31.8584 177.4672 223 S 4.7243 7.7537 109.9183 57.5293 64.5018 174.6687 224 I 3.8754 7.7174 121.3125 61.2485 38.6488 174.7582 225 K 4.6313 8.7315 129.2083 54.8400 35.1238 174.5631 226 M 4.9358 8.3056 125.2553 53.5458 36.0944 174.1829 227 E 4.7281 8.6094 121.1910 54.5844 34.5764 174.3140 228 V 4.4154 8.1030 123.3974 60.8946 34.6441 174.2090 229 F 4.7749 8.3417 125.5884 55.5266 41.8632 174.0803 230 L 5.2049 8.8653 123.7978 52.7125 45.4964 175.0773 231 N 5.5805 9.2226 121.0353 52.2325 41.5555 174.9957 232 T 4.3228 9.3877 115.4408 62.4610 69.7940 174.5844 233 H 4.5867 7.9661 124.3997 56.1179 28.9771 174.6055 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 2 P 0.00 4.44 0.00 2.29 2.25 0.00 3.92 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.07 0.00 3 D 8.44 3.76 0.00 2.56 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 4 P 0.00 5.08 0.00 1.33 0.49 0.00 2.20 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.49 0.44 0.00 5 K 8.20 4.29 0.00 1.92 1.70 0.00 1.64 0.00 0.00 1.78 0.00 0.00 3.05 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.41 1.36 7.81 6 L 8.30 4.32 0.00 1.65 1.75 0.99 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 7 D 7.98 4.53 0.00 2.77 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 8 E 7.98 4.28 0.00 2.20 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 2.45 2.28 0.00 9 L 7.60 4.84 0.00 1.78 1.82 1.03 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 10 N 9.73 4.67 0.00 3.01 3.07 0.00 0.00 6.82 8.23 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 11 K 8.38 4.80 0.00 1.87 1.87 0.00 1.73 0.00 0.00 1.87 0.00 0.00 2.93 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.48 1.43 7.81 12 V 8.46 3.54 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 1.00 0.00 0.00 0.10 0.00 0.00 13 S 8.48 4.19 0.00 4.10 4.10 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 14 D 8.11 4.36 0.00 2.93 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 15 Y 7.98 4.09 0.00 3.17 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 16 K 8.14 3.85 0.00 1.90 1.80 0.00 1.69 0.00 0.00 1.65 0.00 0.00 3.13 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.42 1.47 7.81 17 S 8.11 4.18 0.00 3.88 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 18 N 7.78 4.65 0.00 2.76 2.65 0.00 0.00 7.26 6.43 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 19 K 7.81 3.81 0.00 1.89 1.85 0.00 1.73 0.00 0.00 1.68 0.00 0.00 2.98 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.32 1.33 7.81 20 G 7.64 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 0.00 0.00 0.00 21 T 8.00 4.20 4.11 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 0.58 0.00 0.00 22 M 8.61 4.11 0.00 2.38 2.17 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.76 3.08 0.00 23 G 7.96 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 24 N 7.86 4.18 0.00 2.10 2.42 0.00 0.00 6.51 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 25 V 6.78 2.95 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 -0.12 0.00 0.00 -0.29 0.00 0.00 26 M 7.79 4.11 0.00 2.34 2.19 0.00 0.00 0.00 0.00 0.00 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.89 2.73 0.00 27 N 8.46 4.53 0.00 2.80 2.94 0.00 0.00 7.11 7.41 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 28 L 7.31 3.96 0.00 1.35 1.34 0.91 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 29 Y 7.77 4.62 0.00 3.25 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 30 M 8.48 4.36 0.00 2.06 2.33 0.00 0.00 0.00 0.00 0.00 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.68 2.90 0.00 31 S 7.65 4.49 0.00 4.15 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 32 P 0.00 4.52 0.00 2.14 2.04 0.00 3.82 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 2.09 0.00 33 P 0.00 4.16 0.00 0.67 0.50 0.00 3.71 0.00 0.00 3.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.54 0.00 34 V 8.26 3.82 1.83 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 0.73 0.00 0.00 0.32 0.00 0.00 35 E 8.53 5.12 0.00 1.74 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 1.64 1.81 0.00 36 G 8.72 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 37 R 8.13 5.01 0.00 1.67 1.82 0.00 3.52 0.00 0.00 3.40 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.56 0.00 38 G 8.96 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 39 V 7.96 4.52 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 0.80 0.00 0.00 0.80 0.00 0.00 40 I 8.06 5.19 1.95 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 1.64 0.72 0.96 0.00 0.00 41 N 8.61 3.76 0.00 2.12 1.54 0.00 0.00 6.11 7.64 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 42 S 8.31 4.33 0.00 3.97 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 43 R 7.07 4.39 0.00 1.92 2.02 0.00 2.91 0.00 0.00 3.31 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.54 0.00 44 Q 8.27 4.71 0.00 1.98 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.90 6.94 0.00 0.00 0.00 0.00 0.00 2.34 2.27 0.00 45 F 8.89 4.68 0.00 2.67 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 46 L 8.25 4.25 0.00 1.24 1.19 0.52 0.19 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 47 S 8.26 4.27 0.00 3.94 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 48 H 7.84 4.83 0.00 3.46 3.59 0.00 5.40 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 D 7.76 5.40 0.00 2.75 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 50 L 9.09 4.76 0.00 1.54 1.05 1.14 0.84 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 51 I 8.47 4.92 1.90 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.66 0.88 0.00 0.00 52 F 9.05 5.02 0.00 3.00 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 53 P 0.00 5.26 0.00 2.12 2.13 0.00 3.97 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 2.07 2.03 0.00 54 I 7.63 4.88 1.90 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 1.33 0.75 0.96 0.00 0.00 55 E 8.86 5.02 0.00 2.04 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 2.30 2.18 0.00 56 Y 8.52 4.64 0.00 3.03 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 57 K 7.96 3.88 0.00 1.91 1.04 0.00 1.69 0.00 0.00 1.64 0.00 0.00 2.76 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.03 0.41 7.81 58 S 8.59 4.41 0.00 3.72 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 59 Y 8.38 4.44 0.00 3.41 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 60 N 8.77 5.13 0.00 2.69 2.84 0.00 0.00 6.72 7.66 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 61 E 8.20 5.24 0.00 1.82 1.80 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 2.23 2.33 0.00 62 V 8.68 4.54 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 0.86 0.00 0.00 0.90 0.00 0.00 63 K 8.80 4.74 0.00 1.79 1.52 0.00 1.97 0.00 0.00 1.69 0.00 0.00 2.69 0.00 0.00 2.73 0.00 0.00 0.00 0.00 1.31 1.36 7.81 64 T 9.14 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 1.40 0.00 0.00 65 E 8.54 4.90 0.00 1.75 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.32 0.00 66 L 8.74 5.19 0.00 1.68 1.66 1.07 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 67 E 8.75 4.11 0.00 2.15 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 2.31 2.23 0.00 68 N 7.65 4.95 0.00 2.98 2.86 0.00 0.00 6.30 7.22 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 69 T 8.42 4.05 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 1.25 0.00 0.00 70 E 8.17 3.91 0.00 2.03 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 0.00 2.37 2.36 0.00 71 L 8.61 3.97 0.00 1.93 1.91 1.06 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 72 A 8.05 4.36 1.47 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 0.00 0.00 73 N 8.38 4.39 0.00 2.84 2.90 0.00 0.00 6.98 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 74 N 7.96 4.30 0.00 2.58 2.52 0.00 0.00 7.06 6.83 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 75 Y 7.35 4.81 0.00 3.25 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 76 K 7.94 4.28 0.00 1.93 1.76 0.00 1.88 0.00 0.00 1.71 0.00 0.00 3.00 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.46 1.37 7.81 77 G 9.83 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 78 K 7.79 4.70 0.00 2.11 2.00 0.00 1.73 0.00 0.00 1.68 0.00 0.00 2.77 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.73 1.94 7.81 79 K 8.65 4.52 0.00 1.93 1.80 0.00 1.71 0.00 0.00 1.99 0.00 0.00 2.86 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.59 1.61 7.81 80 V 9.00 5.17 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 0.96 0.00 0.00 0.87 0.00 0.00 81 D 9.20 5.31 0.00 2.49 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 82 I 8.21 4.76 1.71 0.00 0.00 0.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.37 0.50 0.64 0.00 0.00 83 F 8.93 4.61 0.00 3.01 2.70 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 84 G 8.14 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 85 V 8.85 4.43 2.22 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 0.72 0.00 0.00 1.05 0.00 0.00 86 P 0.00 4.74 0.00 1.37 1.36 0.00 3.60 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 1.73 0.91 0.00 87 Y 7.67 4.45 0.00 2.93 2.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 88 F 8.68 4.38 0.00 3.29 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 89 Y 8.34 4.70 0.00 3.03 3.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 90 T 8.79 3.43 4.34 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 0.28 0.00 0.00 91 C 8.10 4.34 0.00 2.55 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 92 I 8.19 4.83 1.89 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 1.53 1.07 0.68 0.00 0.00 93 I 8.68 4.16 1.80 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.44 0.82 0.00 0.00 94 P 0.00 4.43 0.00 1.69 1.78 0.00 2.84 0.00 0.00 2.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.69 1.36 0.00 95 K 8.43 4.24 0.00 1.75 1.75 0.00 1.78 0.00 0.00 1.70 0.00 0.00 3.23 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.68 1.41 7.81 96 S 8.41 4.27 0.00 3.85 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 97 E 7.66 4.55 0.00 1.90 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.33 0.00 *103 N 8.18 4.67 0.00 2.77 2.95 0.00 0.00 6.88 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 0.00 104 F 7.02 5.01 0.00 3.04 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 0.00 105 G 7.87 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 0.00 0.00 0.00 0.00 106 G 7.32 4.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 107 C 7.97 4.37 0.00 2.28 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 0.00 108 C 7.38 5.36 0.00 1.23 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 0.00 0.00 0.00 0.00 109 M 8.03 5.03 0.00 1.88 2.11 0.00 0.00 0.00 0.00 0.00 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.36 2.33 0.00 110 Y 8.76 4.97 0.00 3.11 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 0.00 111 G 9.75 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 0.00 112 G 8.99 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 0.00 0.00 0.00 113 L 7.67 5.03 0.00 0.27 0.68 0.78 0.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 114 T 8.35 4.57 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 1.22 0.00 0.00 115 F 8.40 4.87 0.00 3.13 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 0.00 116 N 9.00 4.79 0.00 2.90 2.91 0.00 0.00 6.92 7.22 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 0.00 117 S 8.47 4.64 0.00 3.93 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 0.00 118 S 8.90 4.24 0.00 3.92 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 0.00 119 E 7.84 4.18 0.00 1.97 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.36 2.30 0.00 120 N 7.70 4.65 0.00 2.91 3.12 0.00 0.00 6.72 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 0.00 121 E 7.71 4.41 0.00 1.90 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 2.22 2.44 0.00 122 R 8.75 4.13 0.00 1.98 1.98 0.00 3.39 0.00 0.00 3.24 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.59 0.00 123 D 8.51 4.75 0.00 2.57 2.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 124 K 9.22 4.59 0.00 1.61 1.70 0.00 1.65 0.00 0.00 1.65 0.00 0.00 2.85 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.38 1.55 7.81 125 L 8.34 5.16 0.00 1.49 1.53 0.91 0.74 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 0.00 126 I 8.92 4.65 1.80 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.68 0.82 0.00 0.00 127 T 8.45 4.57 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 1.09 0.00 0.00 128 V 8.22 4.01 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 0.46 0.00 0.00 0.32 0.00 0.00 129 Q 8.19 4.41 0.00 1.76 1.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.55 0.00 0.00 0.00 0.00 0.00 2.12 2.28 0.00 130 V 8.51 4.45 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 0.86 0.00 0.00 1.02 0.00 0.00 131 T 8.33 4.92 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 1.25 0.00 0.00 132 I 8.51 4.74 1.93 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.82 1.09 0.00 0.00 133 D 9.68 4.52 0.00 2.80 2.78 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 0.00 134 N 8.35 4.11 0.00 2.86 2.91 0.00 0.00 7.21 7.65 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 0.00 135 R 7.76 4.34 0.00 1.99 1.87 0.00 3.20 0.00 0.00 3.12 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.87 0.00 136 Q 8.46 4.63 0.00 1.99 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.70 6.86 0.00 0.00 0.00 0.00 0.00 2.22 2.26 0.00 137 S 8.21 4.78 0.00 3.78 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 0.00 138 L 7.83 4.98 0.00 1.58 1.58 1.11 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 139 G 8.43 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 0.00 0.00 0.00 0.00 140 F 8.21 4.96 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 0.00 0.00 0.00 141 T 8.29 4.97 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 1.10 0.00 0.00 142 I 8.71 4.89 1.94 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 1.29 0.94 1.09 0.00 0.00 143 T 8.29 5.67 4.31 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 0.00 0.00 0.00 1.23 0.00 0.00 144 T 8.13 4.77 4.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 145 N 8.92 4.66 0.00 2.87 3.07 0.00 0.00 6.07 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 0.00 146 K 7.73 4.58 0.00 1.76 1.96 0.00 1.81 0.00 0.00 1.68 0.00 0.00 2.99 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.43 1.38 7.81 147 N 9.95 4.53 0.00 2.70 2.88 0.00 0.00 6.49 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 0.00 148 M 8.02 5.19 0.00 1.92 2.04 0.00 0.00 0.00 0.00 0.00 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.50 0.00 149 V 8.61 4.65 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 0.94 0.00 0.00 0.83 0.00 0.00 150 T 8.29 4.48 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 1.10 0.00 0.00 151 I 8.44 3.49 1.89 0.00 0.00 0.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.85 0.71 0.00 0.00 152 Q 8.15 3.48 0.00 1.74 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.86 0.00 0.00 0.00 0.00 0.00 2.10 1.16 0.00 153 E 7.99 3.62 0.00 1.60 1.80 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 1.73 1.47 0.00 154 L 7.53 4.02 0.00 2.08 1.96 1.03 0.85 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 0.00 155 D 8.95 4.68 0.00 3.40 3.21 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 0.00 156 Y 8.65 4.61 0.00 3.47 3.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 157 K 8.44 4.17 0.00 2.15 2.01 0.00 1.68 0.00 0.00 1.80 0.00 0.00 3.13 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.76 1.91 7.81 158 A 8.32 4.41 1.51 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 0.00 0.00 159 R 8.51 3.89 0.00 1.56 1.75 0.00 2.21 0.00 0.00 2.81 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.84 0.00 160 H 8.65 4.30 0.00 2.67 3.33 0.00 5.83 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 161 W 8.17 3.88 0.00 3.31 2.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 162 L 7.93 3.86 0.00 1.69 1.63 1.00 0.97 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 0.00 163 T 7.73 3.96 4.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 164 K 7.78 3.94 0.00 1.56 1.68 0.00 1.67 0.00 0.00 1.63 0.00 0.00 3.02 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.23 1.35 7.81 165 E 7.64 4.12 0.00 1.16 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.47 0.00 166 K 7.24 4.44 0.00 1.87 1.87 0.00 1.88 0.00 0.00 1.57 0.00 0.00 2.72 0.00 0.00 3.18 0.00 0.00 0.00 0.00 0.95 1.60 7.81 167 K 8.06 4.03 0.00 1.84 1.81 0.00 1.58 0.00 0.00 1.65 0.00 0.00 2.81 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.37 1.32 7.81 168 L 7.43 4.14 0.00 1.66 1.38 0.51 0.24 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 0.00 169 Y 7.63 5.08 0.00 3.03 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 0.00 170 E 9.28 4.92 0.00 2.00 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 0.00 2.25 2.25 0.00 171 F 8.95 4.16 0.00 3.14 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 0.00 172 D 8.70 5.03 0.00 2.77 2.65 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 0.00 173 G 6.99 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 0.00 0.00 0.00 0.00 174 S 7.89 4.74 0.00 3.94 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 0.00 175 A 8.44 3.78 0.43 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 0.00 0.00 176 F 7.92 4.95 0.00 3.17 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 0.00 177 E 9.42 4.53 0.00 2.02 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.26 0.00 178 S 7.30 4.92 0.00 4.05 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 0.00 179 G 8.82 4.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 180 Y 8.01 5.54 0.00 3.41 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 0.00 181 I 8.96 4.74 1.87 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.57 1.26 1.27 0.00 0.00 182 K 9.11 5.09 0.00 2.13 1.77 0.00 1.88 0.00 0.00 1.74 0.00 0.00 2.85 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.32 1.59 7.81 183 F 8.94 4.98 0.00 1.51 2.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 184 T 8.59 4.97 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 1.26 0.00 0.00 185 E 9.28 4.58 0.00 2.08 1.93 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 2.42 2.41 0.00 186 K 8.87 3.81 0.00 1.73 1.90 0.00 1.80 0.00 0.00 1.77 0.00 0.00 3.05 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.44 1.43 7.81 187 N 8.19 4.60 0.00 2.87 2.91 0.00 0.00 6.10 8.04 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 0.00 188 N 8.17 4.21 0.00 2.87 2.93 0.00 0.00 6.87 7.12 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 0.00 189 T 7.83 4.47 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 1.28 0.00 0.00 190 S 8.22 5.21 0.00 3.94 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 0.00 191 F 8.32 5.22 0.00 2.91 3.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 192 W 7.99 5.67 0.00 3.74 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 0.00 193 F 9.16 5.27 0.00 3.24 2.81 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 0.00 194 D 9.09 5.19 0.00 3.10 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 0.00 195 L 9.04 4.32 0.00 1.26 1.08 0.76 0.59 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 0.00 196 F 8.69 5.29 0.00 3.18 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 0.00 197 P 0.00 4.85 0.00 1.88 2.03 0.00 4.02 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 1.15 0.00 198 K 8.62 4.29 0.00 1.94 2.06 0.00 1.67 0.00 0.00 1.90 0.00 0.00 2.97 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.73 1.50 7.81 199 K 8.74 4.40 0.00 1.96 2.09 0.00 1.62 0.00 0.00 1.78 0.00 0.00 3.02 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.49 1.53 7.81 200 E 8.21 4.12 0.00 2.01 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 0.00 2.34 2.39 0.00 201 L 8.00 4.40 0.00 1.85 1.95 0.74 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 202 V 7.19 4.48 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 0.87 0.00 0.00 0.66 0.00 0.00 203 P 0.00 4.48 0.00 2.24 2.05 0.00 3.78 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.13 0.00 204 F 8.74 4.69 0.00 3.07 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 0.00 205 V 7.30 3.96 1.64 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 0.18 0.00 0.00 0.90 0.00 0.00 206 P 0.00 3.62 0.00 1.72 2.15 0.00 3.39 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 2.44 2.38 0.00 207 Y 6.72 3.80 0.00 3.36 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 0.00 208 K 6.56 3.84 0.00 1.38 1.60 0.00 1.33 0.00 0.00 1.41 0.00 0.00 2.93 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.05 0.21 7.81 209 F 7.34 4.25 0.00 2.75 3.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 210 L 7.92 4.10 0.00 1.75 1.92 1.16 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 211 N 7.10 3.14 0.00 2.36 2.23 0.00 0.00 6.60 7.65 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 0.00 212 I 6.95 3.45 0.93 0.00 0.00 -0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.60 -0.36 0.36 0.00 0.00 213 Y 7.43 4.75 0.00 3.18 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 0.00 214 G 8.32 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 0.00 0.00 0.00 215 D 8.08 4.67 0.00 2.77 2.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 216 N 8.07 4.14 0.00 2.88 2.97 0.00 0.00 7.07 6.72 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 0.00 217 K 8.18 4.06 0.00 2.06 1.64 0.00 1.44 0.00 0.00 1.35 0.00 0.00 2.78 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.11 1.38 7.81 218 V 8.40 4.98 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 0.96 0.00 0.00 219 V 8.73 4.64 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 0.77 0.00 0.00 0.95 0.00 0.00 220 D 8.60 5.09 0.00 2.75 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 0.00 221 S 9.22 4.28 0.00 3.87 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 0.00 222 K 8.55 4.15 0.00 1.95 1.92 0.00 1.65 0.00 0.00 1.76 0.00 0.00 3.02 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.48 1.38 7.81 223 S 7.75 4.72 0.00 3.83 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 0.00 224 I 7.72 3.88 2.05 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.81 0.94 0.00 0.00 225 K 8.73 4.63 0.00 1.83 1.68 0.00 1.59 0.00 0.00 1.61 0.00 0.00 2.78 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.22 1.30 7.81 226 M 8.31 4.94 0.00 1.56 1.61 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 2.52 2.26 0.00 227 E 8.61 4.73 0.00 1.90 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 2.07 2.12 0.00 228 V 8.10 4.42 1.80 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 0.79 0.00 0.00 0.75 0.00 0.00 229 F 8.34 4.77 0.00 1.78 2.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 230 L 8.87 5.20 0.00 1.12 0.88 -0.04 -0.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 231 N 9.22 5.58 0.00 2.79 2.83 0.00 0.00 6.91 7.72 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 0.00 232 T 9.39 4.32 4.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 233 H 7.97 4.59 0.00 3.20 3.23 0.00 5.73 0.00 0.00 0.00 0.00 6.91 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.