NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4697 8.3049 118.1928 54.6810 33.2313 176.1301 2 L 3.9085 7.9476 119.1910 54.9008 42.1115 175.1629 3 G 3.9937 8.9030 107.0919 46.2188 0.0000 173.5028 4 L 4.2032 8.0492 118.2432 54.6093 42.3311 177.4895 5 K 4.5792 8.4355 120.8556 56.2831 32.7568 176.5952 6 T 4.2217 7.6738 108.9417 61.6283 69.6705 174.8255 7 S 4.3625 9.3911 119.5124 61.1225 63.5387 174.6853 8 I 4.3106 8.4333 117.9389 62.8484 39.1044 175.7771 9 I 3.9547 7.9019 122.7717 63.8533 36.7334 176.2233 10 G 4.1498 9.1709 114.6899 45.1127 0.0000 174.0694 11 R 4.1069 8.0096 118.9163 58.7940 30.4945 177.0732 12 R 4.8382 7.7179 114.6256 54.3626 34.7893 174.6308 13 V 4.9144 8.4052 121.1323 61.3516 34.7473 174.3381 14 I 4.3925 9.2396 129.1003 59.9034 39.1025 173.8123 15 Y 5.2214 8.4860 128.5417 56.0337 40.6796 174.6580 16 F 4.2944 8.3231 123.7941 55.4820 42.1594 176.1817 17 Q 4.0549 8.3455 121.5871 58.2240 29.7292 175.8303 18 E 5.0642 7.8502 117.0848 55.0630 32.8669 174.0431 19 I 4.4308 8.2208 124.2814 60.1141 41.8693 175.4852 20 T 4.1374 8.5205 115.6359 63.5659 69.6960 174.2828 21 S 4.8264 7.5248 116.1175 55.2191 65.6266 175.2074 22 T 3.8194 9.3485 119.5887 64.8324 68.4348 176.7181 23 N 4.3110 7.9674 118.9287 56.1853 38.7470 177.0285 24 E 3.9838 8.0610 119.6118 59.3430 29.4256 179.2131 25 F 3.9931 8.3531 120.4694 61.2426 39.2369 177.0789 26 A 4.0185 8.1077 119.3964 55.0589 18.2027 179.4765 27 K 4.0817 7.9982 116.6803 59.0010 32.2901 178.7175 28 T 4.2854 7.4899 106.8539 60.9016 69.6629 174.5814 29 S 4.5668 6.7744 118.0059 56.5977 65.4188 173.1043 30 Y 4.2416 8.4230 125.2900 57.2089 38.9015 174.8088 31 L 4.5314 7.3635 126.2959 52.5153 46.1330 176.1484 32 E 4.0083 8.2489 119.8383 55.3378 30.5471 175.8088 33 E 4.1148 8.4392 120.9770 58.2085 30.1420 177.3596 34 G 4.4075 9.3759 114.0727 46.4877 0.0000 173.3161 35 T 4.4816 7.7113 117.5710 63.6984 69.7754 173.3994 36 V 4.8108 8.7990 126.2371 61.2879 34.0795 174.1735 37 I 5.2047 9.0745 129.4054 59.7100 39.2416 175.0853 38 V 5.2008 9.2069 126.2644 60.0497 34.9445 174.4094 39 A 5.0916 8.7239 123.2738 50.4357 21.5965 176.0952 40 D 4.6551 9.0302 120.7065 57.1593 42.2152 176.5666 41 K 5.0750 8.0936 117.5499 55.1158 36.2292 174.9186 42 Q 5.1422 8.3559 124.4406 54.4742 31.1400 175.8524 43 T 4.2177 8.9158 113.4968 62.6060 70.6170 174.7717 44 M 5.1140 7.9793 122.2893 54.4414 32.1261 176.2304 45 G 3.8969 8.0795 105.9460 46.7472 0.0000 173.0813 46 H 5.4751 8.3476 116.5776 53.8602 31.7249 173.8571 47 G 4.0796 8.9154 110.0732 45.3025 0.0000 173.0419 48 A 4.4005 8.3935 125.3822 51.1593 21.0567 177.8505 49 L 3.3725 7.9873 118.7881 56.8237 40.1347 176.0255 50 N 4.9457 8.5327 116.9471 54.2701 39.4707 175.0376 51 R 4.3813 8.0124 116.9793 55.6765 31.8554 176.0709 52 K 4.7729 8.5330 123.2574 55.2417 33.8043 175.4998 53 W 4.5601 8.5234 135.0000 55.2560 32.1633 175.1872 54 E 3.7025 8.0383 127.6742 56.0720 29.3713 177.9623 55 S 3.2679 7.6286 121.4942 56.1377 62.9128 171.4809 56 P 4.8176 0.0000 0.0000 61.5913 32.9366 176.1625 57 E 4.7581 7.9592 117.8009 57.3562 29.8963 177.2032 58 G 3.9975 9.0188 110.1269 45.2800 0.0000 173.7211 59 G 3.3245 7.2540 105.1695 44.2916 0.0000 172.9463 60 L 4.1868 7.4263 121.9684 52.9998 43.7539 175.3526 61 W 5.5511 8.2070 127.5557 55.0771 31.6601 174.8056 62 L 5.3590 8.9340 124.4262 54.6192 44.2357 175.0484 63 S 5.1990 9.3624 114.9280 56.9243 67.5349 173.2553 64 I 4.9428 8.5757 123.4862 59.4801 40.6931 174.6880 65 V 4.3184 8.5417 127.1674 62.1765 32.6788 174.7929 66 L 4.9536 9.0518 127.5422 52.6937 45.5741 176.4486 67 S 4.6504 7.9719 113.9996 56.4191 62.6572 171.9668 68 P 4.5283 0.0000 0.0000 62.6749 32.6298 178.6722 69 K 4.3607 8.4846 126.2874 55.8746 30.8123 175.7573 70 V 4.4986 6.9985 111.2388 58.2855 36.2336 174.4893 71 P 4.3806 0.0000 0.0000 62.7045 32.0163 177.4475 72 Q 4.0414 8.9115 121.9315 59.4325 28.6442 179.0909 73 K 4.2332 8.0873 117.6055 59.2322 32.9140 177.6475 74 D 4.7051 8.1846 119.4565 55.3097 41.2246 178.1485 75 L 4.1228 7.8337 119.9298 57.3423 41.4397 177.2111 76 P 4.3512 0.0000 0.0000 64.2171 31.6049 176.9706 77 K 4.0498 8.0816 117.6112 57.2020 33.0399 178.8190 78 I 3.3476 7.5235 121.1392 64.2026 36.8838 178.3600 79 V 3.4696 7.3750 119.3655 64.9176 30.9457 178.3446 80 F 4.5530 7.5185 118.2160 60.2273 38.6397 177.5535 81 L 4.1178 7.7865 118.5570 57.6929 41.3964 179.8325 82 G 3.4813 7.9392 104.8606 47.6648 0.0000 175.4439 83 A 3.9979 7.9990 123.6148 54.9278 18.3651 179.9669 84 V 3.6912 8.3995 117.3847 65.9246 31.5889 178.3918 85 G 3.6166 8.3016 105.7361 47.8010 0.0000 175.8454 86 V 3.5888 7.8309 120.7092 65.6338 31.5889 178.1904 87 V 3.6031 7.8751 117.9788 66.1628 31.3254 177.8419 88 E 4.0130 8.5020 118.4953 59.7210 28.8267 179.5464 89 T 3.9804 8.0351 115.7019 66.6654 68.4565 176.6441 90 L 4.0545 8.2932 121.3024 57.8409 41.5627 179.5376 91 K 4.1565 8.1497 120.7507 59.0517 31.8796 178.6655 92 E 3.8857 7.9444 117.5781 59.0702 29.5151 177.6324 93 F 4.4651 7.9700 114.8330 56.9079 38.8982 175.6854 94 S 3.8441 8.1862 115.2699 59.9589 60.5465 171.6710 95 I 4.3832 8.0940 120.4904 59.5034 39.2926 174.8287 96 D 4.7710 8.7160 125.1436 52.9620 40.4797 175.1861 97 G 4.2686 8.3084 113.5090 44.7383 0.0000 171.4603 98 R 5.0213 9.1338 121.2061 54.0483 34.3289 174.7426 99 I 4.5363 9.0476 124.3368 60.8555 38.8697 174.7425 100 K 4.7440 9.0378 129.3226 54.0891 33.6122 175.3739 101 W 4.5392 9.1572 135.0000 57.7345 30.8831 173.6257 102 P 4.2847 0.0000 0.0000 62.4479 31.9414 174.8758 103 N 4.9840 7.7726 114.6477 52.4163 39.4332 173.1812 104 D 5.5136 8.3286 119.5591 52.8880 44.3786 175.2887 105 V 4.8704 8.5612 120.7332 61.2646 34.3665 174.3870 106 L 5.3454 9.4152 127.6780 52.9664 45.4376 175.7637 107 V 4.4586 8.6487 121.4633 61.2537 34.2424 175.3865 108 N 3.9807 9.5361 126.8017 54.7304 35.9218 174.8597 109 Y 4.0251 8.0550 111.7125 58.4064 36.1708 169.5983 110 K 4.5429 7.9062 120.8016 54.2353 33.9500 175.5073 111 K 4.6248 8.6769 125.3905 56.8901 32.6784 176.5496 112 I 4.6472 9.2850 127.1396 60.7132 40.4791 174.4992 113 A 5.3384 7.9138 121.5094 51.3436 22.5929 175.1875 114 G 4.2498 8.9277 105.6866 44.4675 0.0000 171.8367 115 V 4.7699 8.2422 121.5830 60.5937 34.5125 174.8526 116 L 4.4858 8.8859 128.7503 53.4989 45.0672 174.7724 117 V 4.7493 8.3103 126.4555 61.3085 33.4138 174.6708 118 E 4.6689 9.1770 126.6768 54.5178 33.5370 174.6049 119 G 4.3093 8.7105 110.9749 44.4454 0.0000 173.2299 120 K 4.4520 8.9988 125.4485 54.8990 34.5448 176.1696 121 G 3.7277 8.2793 118.7146 47.3896 0.0000 172.5312 122 D 4.7690 8.8361 125.0138 53.7165 41.0749 175.1703 123 K 4.7626 8.1139 121.9450 54.7135 34.6811 174.8544 124 I 4.8453 8.8557 128.1401 59.4857 40.1480 174.5204 125 V 4.6007 8.8904 127.1633 61.1329 33.6232 174.0944 126 L 4.5586 8.8774 131.6929 53.6621 43.2943 174.9698 127 G 4.6063 8.7228 114.7891 43.9589 0.0000 171.6510 128 I 5.0007 9.0045 124.5496 59.2271 41.7013 174.3867 129 G 4.6397 8.8820 114.0749 44.3407 0.0000 171.4747 130 L 5.4144 9.0275 127.7081 53.1758 45.4880 175.0466 131 N 4.5660 9.4300 124.8668 53.7543 39.1234 173.8264 132 V 4.1839 8.9758 123.6570 62.2607 33.4124 175.6378 133 N 5.0792 8.6447 120.0628 52.8703 40.0735 174.5527 134 N 4.7982 8.0535 116.6190 51.8965 38.8703 175.2436 135 K 4.2250 8.5609 119.1443 56.5194 32.8525 177.0344 136 V 4.4960 7.8420 114.4302 58.4095 35.4441 173.8792 137 P 4.4079 0.0000 0.0000 62.1696 31.9118 175.5844 138 N 4.4908 8.4301 116.8860 55.3108 38.7915 175.1493 139 G 3.9194 9.1140 110.5810 45.0399 0.0000 173.1440 140 A 4.5589 7.3802 120.6861 51.4392 20.4437 175.4641 141 T 4.8231 8.6076 112.7165 61.3456 71.8552 172.1150 142 S 4.7287 8.3159 116.1296 56.0685 66.4714 175.1435 143 M 4.0191 8.8021 120.3126 58.4279 31.4745 179.0948 144 K 4.1672 8.2346 121.3733 59.0723 32.1560 178.9302 145 L 4.0151 7.7844 118.2260 57.6355 41.5564 178.9348 146 E 4.1653 8.0235 118.0169 58.6790 29.6041 178.3571 147 L 4.4417 8.2056 117.6322 54.4063 42.2673 177.9752 148 G 3.9881 9.5563 106.5887 45.3177 0.0000 173.0655 149 S 4.6118 7.3759 112.3244 56.1412 65.7504 173.1155 150 E 4.0423 8.7144 122.9796 56.5279 29.8238 176.1280 151 V 4.2354 8.7676 126.5536 60.1985 33.1171 173.2564 152 P 4.2609 0.0000 0.0000 62.6579 31.4552 176.5205 153 L 3.8612 8.7335 126.1166 58.2599 41.8547 178.5675 154 L 4.0209 7.8897 119.5304 58.2521 42.0326 178.9523 155 S 4.2221 8.0416 114.9393 61.5255 62.6621 176.8285 156 V 3.5948 7.7639 120.6172 65.6790 31.2393 177.6586 157 F 4.0427 8.3067 120.4446 61.4045 39.2967 177.2027 158 R 3.8754 8.4654 117.8905 59.3117 29.9043 178.9734 159 S 4.0814 8.1537 112.7092 61.3265 62.4080 175.9567 160 L 4.1720 7.9669 124.4754 57.7912 41.8420 178.9369 161 I 3.5142 7.5954 119.9323 64.5092 36.8996 178.6130 162 T 3.8375 7.8300 116.5276 66.6780 68.2376 176.5141 163 N 4.3463 8.2154 118.3284 56.3502 38.5389 177.5056 164 L 3.9638 8.2461 120.7962 57.7249 41.6329 179.0167 165 D 4.3912 8.2356 118.0460 57.3362 41.1537 178.3847 166 R 3.8956 7.8551 118.6476 59.4960 30.1377 178.4152 167 L 4.0524 8.1590 118.9674 57.9452 41.6120 179.0159 168 Y 4.2350 8.5386 119.8013 60.8328 38.3706 177.8299 169 L 3.8573 8.1896 120.0405 57.8817 41.6246 179.1451 170 N 4.1757 8.2954 117.0210 56.4419 38.6562 176.7020 171 F 4.0497 8.1381 121.5067 61.3375 39.5365 176.8757 172 L 3.8266 7.7055 117.5372 56.9081 41.3318 178.8655 173 K 4.3117 7.0967 116.9013 56.9378 34.4593 176.8482 174 N 4.9142 8.4835 116.8656 50.1244 38.6310 173.2079 175 P 3.9756 0.0000 0.0000 64.7558 32.0122 178.1327 176 M 4.3216 7.7712 118.0256 56.8409 32.8003 177.7915 177 D 4.4011 8.1247 119.4413 57.4575 40.9188 178.4099 178 I 3.7339 8.0168 118.4486 64.0332 37.8304 177.6807 179 L 3.9237 7.8594 119.5634 57.8455 41.4726 178.9970 180 N 4.3204 7.9650 116.8726 56.5227 38.6325 176.9857 181 L 4.0062 7.8117 119.4074 57.5316 42.0078 179.2217 182 V 3.6370 7.8130 118.1890 66.0194 31.1076 178.1098 183 R 3.9027 7.9652 117.8632 59.5500 29.8049 178.2835 184 D 4.7493 8.0389 115.2097 55.4939 41.1386 176.5607 185 N 5.0116 8.2053 116.2706 52.6869 40.1984 173.0253 186 M 5.1002 7.5009 116.6228 53.6857 35.0061 175.6387 187 I 4.2173 8.5331 125.1451 61.0599 36.2547 175.1553 188 L 4.6782 8.0843 126.1232 53.3379 46.6853 177.3984 189 G 3.8993 9.1253 105.7922 46.2735 0.0000 173.6236 190 V 4.6245 7.0260 111.2342 58.8146 36.0906 174.9307 191 R 4.6175 8.5011 122.6938 56.6616 30.8825 175.7858 192 V 4.6261 9.0224 118.1021 59.7299 36.6883 174.0541 193 K 4.9956 8.2519 121.2027 53.4171 35.2158 175.0006 *199 S 4.2040 8.2649 115.4832 58.0952 62.8182 172.5247 200 F 5.0431 7.6496 119.6851 55.6236 40.7864 172.4613 201 E 4.8496 9.0965 119.7155 54.2394 33.2464 175.4438 202 G 4.0413 7.8137 107.6201 46.6526 0.0000 171.3255 203 I 4.7101 7.7706 120.5934 60.2907 38.7562 175.9789 204 A 4.5611 8.8495 129.2869 51.9485 17.9147 177.5810 205 E 3.9879 9.0879 122.4267 59.4193 30.7875 176.5043 206 D 4.3006 7.0531 116.4966 54.1810 44.2875 173.9226 207 I 4.8847 8.1540 113.1701 58.8273 40.0477 175.5275 208 D 4.7533 8.5178 122.8935 52.5529 41.2415 176.0625 209 D 4.5188 8.8109 117.1741 56.4945 41.2486 176.9016 210 F 4.4097 9.0642 116.2319 57.5654 39.4436 176.6911 211 G 4.4311 8.5258 109.3787 45.4029 0.0000 174.0751 212 R 4.6007 8.1264 118.9441 55.7993 31.8139 175.3730 213 L 4.1734 7.9616 125.4351 54.6258 43.3045 175.4419 214 I 4.6859 8.7773 128.0002 60.2336 38.7831 174.6703 215 I 4.9133 8.7637 128.4825 59.3942 40.4879 174.6447 216 R 4.7880 8.6789 127.4246 54.5978 31.4034 175.9078 217 L 4.6172 8.8249 127.4728 54.0656 42.5126 178.1201 218 D 4.3620 8.6348 120.3759 57.4692 40.7936 178.3237 219 S 4.2029 7.9103 111.8008 59.2663 63.4093 174.9229 220 G 3.9767 8.1667 110.0240 44.9056 0.0000 173.6893 221 E 4.0264 7.8795 121.0410 56.3939 30.8846 175.5778 222 V 4.7865 8.2458 125.5144 61.1261 33.4251 174.7223 223 K 4.6660 8.9460 126.9043 54.4299 35.7312 175.1662 224 K 4.8672 8.5534 122.1930 54.7401 34.4261 175.5981 225 V 4.2039 8.7242 126.4779 61.5300 33.1483 176.1590 226 I 4.2988 8.4909 127.4802 61.7053 37.2058 175.5448 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 M 8.30 4.47 0.00 2.10 2.24 0.00 0.00 0.00 0.00 0.00 -0.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.43 2.59 0.00 2 L 7.95 3.91 0.00 1.77 1.81 0.89 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 3 G 8.90 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 0.00 0.00 0.00 4 L 8.05 4.20 0.00 1.69 1.65 1.14 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 5 K 8.44 4.58 0.00 1.71 1.78 0.00 1.75 0.00 0.00 1.76 0.00 0.00 3.03 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.34 1.39 7.81 6 T 7.67 4.22 4.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 7 S 9.39 4.36 0.00 3.97 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 8 I 8.43 4.31 2.04 0.00 0.00 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 1.38 1.30 1.08 0.00 0.00 9 I 7.90 3.95 1.84 0.00 0.00 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.41 0.81 0.00 0.00 10 G 9.17 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 0.00 0.00 0.00 0.00 11 R 8.01 4.11 0.00 1.83 2.04 0.00 3.19 0.00 0.00 3.25 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.86 0.00 12 R 7.72 4.84 0.00 1.73 1.78 0.00 3.15 0.00 0.00 3.29 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.63 0.00 13 V 8.41 4.91 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 0.90 0.00 0.00 1.14 0.00 0.00 14 I 9.24 4.39 2.03 0.00 0.00 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 1.15 0.75 0.55 0.00 0.00 15 Y 8.49 5.22 0.00 2.86 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 16 F 8.32 4.29 0.00 2.65 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 17 Q 8.35 4.05 0.00 1.96 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.82 0.00 0.00 0.00 0.00 0.00 2.58 2.24 0.00 18 E 7.85 5.06 0.00 1.92 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 2.29 0.00 19 I 8.22 4.43 1.28 0.00 0.00 -0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.72 0.68 0.00 0.00 20 T 8.52 4.14 4.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 21 S 7.52 4.83 0.00 3.99 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 22 T 9.35 3.82 4.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 23 N 7.97 4.31 0.00 2.71 3.01 0.00 0.00 7.17 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 24 E 8.06 3.98 0.00 2.18 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 2.44 2.50 0.00 25 F 8.35 3.99 0.00 3.00 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 26 A 8.11 4.02 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 27 K 8.00 4.08 0.00 1.87 1.85 0.00 1.80 0.00 0.00 1.75 0.00 0.00 3.05 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.45 1.60 7.81 28 T 7.49 4.29 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 1.22 0.00 0.00 29 S 6.77 4.57 0.00 3.30 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 30 Y 8.42 4.24 0.00 2.91 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 31 L 7.36 4.53 0.00 1.46 1.40 0.95 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 32 E 8.25 4.01 0.00 2.12 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.27 0.00 33 E 8.44 4.11 0.00 1.96 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.36 0.00 34 G 9.38 4.41 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 0.00 0.00 0.00 35 T 7.71 4.48 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 1.28 0.00 0.00 36 V 8.80 4.81 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 1.05 0.00 0.00 1.01 0.00 0.00 37 I 9.07 5.20 1.96 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 1.43 1.16 0.92 0.00 0.00 38 V 9.21 5.20 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 0.76 0.00 0.00 1.04 0.00 0.00 39 A 8.72 5.09 1.23 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 40 D 9.03 4.66 0.00 2.99 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 41 K 8.09 5.07 0.00 1.90 1.64 0.00 1.56 0.00 0.00 1.64 0.00 0.00 2.84 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.31 1.49 7.81 42 Q 8.36 5.14 0.00 1.72 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.69 0.00 0.00 0.00 0.00 0.00 2.20 2.15 0.00 43 T 8.92 4.22 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 1.19 0.00 0.00 44 M 7.98 5.11 0.00 1.83 2.08 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 2.50 2.59 0.00 45 G 8.08 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 H 8.35 5.48 0.00 3.22 3.23 0.00 5.51 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 47 G 8.92 4.08 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 0.00 48 A 8.39 4.40 1.23 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 49 L 7.99 3.37 0.00 1.77 1.49 0.92 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 0.00 0.00 0.00 0.00 0.00 0.00 50 N 8.53 4.95 0.00 2.69 2.80 0.00 0.00 6.77 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 51 R 8.01 4.38 0.00 1.83 1.88 0.00 3.24 0.00 0.00 3.14 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.64 0.00 52 K 8.53 4.77 0.00 1.75 1.66 0.00 1.69 0.00 0.00 1.69 0.00 0.00 2.81 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.31 1.52 7.81 53 W 8.52 4.56 0.00 3.35 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 54 E 8.04 3.70 0.00 1.40 1.60 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 2.01 2.07 0.00 55 S 7.63 3.27 0.00 3.43 2.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 P 0.00 4.82 0.00 2.29 2.19 0.00 3.72 0.00 0.00 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 1.99 0.00 57 E 7.96 4.76 0.00 2.05 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.41 2.34 0.00 58 G 9.02 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 59 G 7.25 3.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 60 L 7.43 4.19 0.00 1.50 1.31 1.01 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 61 W 8.21 5.55 0.00 3.29 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 62 L 8.93 5.36 0.00 1.97 1.86 0.91 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 63 S 9.36 5.20 0.00 3.74 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 I 8.58 4.94 1.74 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.80 0.75 0.00 0.00 65 V 8.54 4.32 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 0.91 0.00 0.00 0.90 0.00 0.00 66 L 9.05 4.95 0.00 1.45 1.38 0.60 -0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 67 S 7.97 4.65 0.00 3.93 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 68 P 0.00 4.53 0.00 2.47 2.46 0.00 3.90 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 2.14 2.18 0.00 69 K 8.48 4.36 0.00 1.73 1.83 0.00 1.56 0.00 0.00 1.71 0.00 0.00 3.11 0.00 0.00 3.18 0.00 0.00 0.00 0.00 1.45 1.55 7.81 70 V 7.00 4.50 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 0.53 0.00 0.00 1.08 0.00 0.00 71 P 0.00 4.38 0.00 2.31 1.96 0.00 3.73 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 2.05 2.04 0.00 72 Q 8.91 4.04 0.00 2.19 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.01 6.91 0.00 0.00 0.00 0.00 0.00 2.47 2.55 0.00 73 K 8.09 4.23 0.00 2.03 2.05 0.00 1.45 0.00 0.00 1.72 0.00 0.00 2.98 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.41 1.47 7.81 74 D 8.18 4.71 0.00 2.88 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 75 L 7.83 4.12 0.00 1.73 1.76 1.01 1.33 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 76 P 0.00 4.35 0.00 2.10 2.12 0.00 3.83 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 2.14 2.15 0.00 77 K 8.08 4.05 0.00 2.22 2.06 0.00 2.03 0.00 0.00 1.81 0.00 0.00 3.01 0.00 0.00 3.40 0.00 0.00 0.00 0.00 1.78 1.57 7.81 78 I 7.52 3.35 1.70 0.00 0.00 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.20 0.74 0.00 0.00 79 V 7.38 3.47 1.78 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 0.13 0.00 0.00 0.77 0.00 0.00 80 F 7.52 4.55 0.00 3.27 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 81 L 7.79 4.12 0.00 1.74 1.66 0.53 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 82 G 7.94 3.48 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 0.00 0.00 0.00 83 A 8.00 4.00 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 84 V 8.40 3.69 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.00 0.00 0.95 0.00 0.00 85 G 8.30 3.62 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 86 V 7.83 3.59 2.23 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 1.08 0.00 0.00 0.98 0.00 0.00 87 V 7.88 3.60 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 1.10 0.00 0.00 1.02 0.00 0.00 88 E 8.50 4.01 0.00 2.20 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.59 0.00 89 T 8.04 3.98 4.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 90 L 8.29 4.05 0.00 1.86 1.89 0.94 0.70 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 91 K 8.15 4.16 0.00 1.95 2.01 0.00 1.70 0.00 0.00 1.76 0.00 0.00 2.96 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.45 1.36 7.81 92 E 7.94 3.89 0.00 2.35 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 2.33 2.47 0.00 93 F 7.97 4.47 0.00 3.11 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 94 S 8.19 3.84 0.00 4.05 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 95 I 8.09 4.38 2.05 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 1.22 1.53 0.93 0.00 0.00 96 D 8.72 4.77 0.00 2.61 2.60 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 97 G 8.31 4.27 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 0.00 0.00 0.00 98 R 9.13 5.02 0.00 1.72 1.83 0.00 3.13 0.00 0.00 3.14 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.56 0.00 99 I 9.05 4.54 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 1.16 0.82 1.03 0.00 0.00 100 K 9.04 4.74 0.00 1.89 1.77 0.00 1.73 0.00 0.00 1.64 0.00 0.00 2.82 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.46 1.46 7.81 101 W 9.16 4.54 0.00 3.33 3.18 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 0.00 102 P 0.00 4.28 0.00 1.26 0.49 0.00 3.50 0.00 0.00 3.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.91 0.00 103 N 7.77 4.98 0.00 2.75 2.79 0.00 0.00 6.10 8.07 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 0.00 104 D 8.33 5.51 0.00 2.80 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 0.00 105 V 8.56 4.87 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 1.11 0.00 0.00 0.96 0.00 0.00 106 L 9.42 5.35 0.00 1.68 1.64 1.10 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 107 V 8.65 4.46 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.00 0.00 0.95 0.00 0.00 108 N 9.54 3.98 0.00 2.87 2.83 0.00 0.00 7.24 7.46 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 0.00 109 Y 8.05 4.03 0.00 3.17 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 0.00 110 K 7.91 4.54 0.00 1.98 1.81 0.00 1.69 0.00 0.00 1.75 0.00 0.00 2.92 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.54 1.57 7.81 111 K 8.68 4.62 0.00 1.93 1.77 0.00 1.81 0.00 0.00 1.91 0.00 0.00 3.35 0.00 0.00 3.45 0.00 0.00 0.00 0.00 1.74 1.60 7.81 112 I 9.28 4.65 1.92 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 1.15 2.17 1.04 0.00 0.00 113 A 7.91 5.34 1.28 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 0.00 0.00 114 G 8.93 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 0.00 0.00 0.00 115 V 8.24 4.77 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.71 0.00 0.00 0.85 0.00 0.00 116 L 8.89 4.49 0.00 1.52 1.27 0.85 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.00 0.00 0.00 0.00 0.00 0.00 117 V 8.31 4.75 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 0.76 0.00 0.00 0.80 0.00 0.00 118 E 9.18 4.67 0.00 1.86 1.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.19 0.00 119 G 8.71 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 0.00 0.00 0.00 0.00 120 K 9.00 4.45 0.00 1.63 1.64 0.00 1.78 0.00 0.00 1.65 0.00 0.00 3.06 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.31 1.65 7.81 121 G 8.28 3.73 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 0.00 0.00 0.00 122 D 8.84 4.77 0.00 2.70 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 0.00 123 K 8.11 4.76 0.00 1.82 1.82 0.00 1.51 0.00 0.00 1.57 0.00 0.00 2.79 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.30 1.34 7.81 124 I 8.86 4.85 1.85 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.49 0.85 0.00 0.00 125 V 8.89 4.60 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 0.99 0.00 0.00 0.89 0.00 0.00 126 L 8.88 4.56 0.00 1.65 1.40 0.79 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 127 G 8.72 4.61 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 0.00 128 I 9.00 5.00 1.83 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 1.07 0.89 0.86 0.00 0.00 129 G 8.88 4.64 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 0.00 0.00 0.00 130 L 9.03 5.41 0.00 1.72 1.41 0.98 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 131 N 9.43 4.57 0.00 2.86 2.81 0.00 0.00 6.03 8.51 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 0.00 132 V 8.98 4.18 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 0.92 0.00 0.00 0.79 0.00 0.00 133 N 8.64 5.08 0.00 2.56 2.89 0.00 0.00 7.22 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 134 N 8.05 4.80 0.00 2.89 3.09 0.00 0.00 6.16 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 0.00 135 K 8.56 4.23 0.00 1.77 1.77 0.00 1.70 0.00 0.00 1.71 0.00 0.00 2.99 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.46 1.41 7.81 136 V 7.84 4.50 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 0.90 0.00 0.00 0.94 0.00 0.00 137 P 0.00 4.41 0.00 2.12 2.04 0.00 3.56 0.00 0.00 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.75 0.00 138 N 8.43 4.49 0.00 2.71 2.81 0.00 0.00 7.20 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 0.00 139 G 9.11 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 0.00 140 A 7.38 4.56 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 141 T 8.61 4.82 4.27 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 1.33 0.00 0.00 142 S 8.32 4.73 0.00 4.03 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 0.00 143 M 8.80 4.02 0.00 1.97 2.04 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.69 2.44 0.00 144 K 8.23 4.17 0.00 2.04 1.84 0.00 1.81 0.00 0.00 1.74 0.00 0.00 2.95 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.44 1.49 7.81 145 L 7.78 4.02 0.00 1.84 1.72 0.93 1.00 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 0.00 146 E 8.02 4.17 0.00 2.09 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 2.58 2.50 0.00 147 L 8.21 4.44 0.00 1.68 1.76 1.03 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 148 G 9.56 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 0.00 0.00 0.00 149 S 7.38 4.61 0.00 3.98 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 0.00 150 E 8.71 4.04 0.00 1.93 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 2.29 2.36 0.00 151 V 8.77 4.24 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.75 0.00 0.00 0.95 0.00 0.00 152 P 0.00 4.26 0.00 2.29 2.03 0.00 3.80 0.00 0.00 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.11 0.00 153 L 8.73 3.86 0.00 1.69 1.62 0.76 0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 154 L 7.89 4.02 0.00 1.73 1.65 0.87 0.94 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 0.00 155 S 8.04 4.22 0.00 4.26 4.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 156 V 7.76 3.59 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 0.52 0.00 0.00 157 F 8.31 4.04 0.00 3.17 3.22 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 0.00 158 R 8.47 3.88 0.00 2.12 2.02 0.00 3.26 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 1.81 2.03 0.00 159 S 8.15 4.08 0.00 4.07 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 0.00 160 L 7.97 4.17 0.00 1.77 1.49 0.90 1.10 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 0.00 161 I 7.60 3.51 1.51 0.00 0.00 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.62 -0.36 0.75 0.00 0.00 162 T 7.83 3.84 4.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 163 N 8.22 4.35 0.00 2.86 2.99 0.00 0.00 7.08 6.33 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 0.00 164 L 8.25 3.96 0.00 1.58 1.65 0.82 0.78 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 0.00 165 D 8.24 4.39 0.00 2.90 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 0.00 166 R 7.86 3.90 0.00 1.93 2.08 0.00 3.17 0.00 0.00 3.18 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.69 0.00 167 L 8.16 4.05 0.00 1.92 1.76 1.02 0.84 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 0.00 168 Y 8.54 4.23 0.00 3.05 3.18 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 0.00 169 L 8.19 3.86 0.00 1.90 1.70 1.12 0.45 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 0.00 170 N 8.30 4.18 0.00 2.87 2.98 0.00 0.00 6.84 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 0.00 171 F 8.14 4.05 0.00 3.14 3.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 172 L 7.71 3.83 0.00 1.62 1.54 0.57 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 173 K 7.10 4.31 0.00 1.59 1.79 0.00 1.60 0.00 0.00 1.67 0.00 0.00 2.98 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.35 1.52 7.81 174 N 8.48 4.91 0.00 2.70 2.65 0.00 0.00 6.79 8.32 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 0.00 175 P 0.00 3.98 0.00 1.84 1.44 0.00 3.64 0.00 0.00 3.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.74 0.00 176 M 7.77 4.32 0.00 2.05 2.11 0.00 0.00 0.00 0.00 0.00 2.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.42 0.00 177 D 8.12 4.40 0.00 2.87 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 0.00 178 I 8.02 3.73 2.06 0.00 0.00 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 1.79 1.35 1.19 0.00 0.00 179 L 7.86 3.92 0.00 1.88 1.71 0.97 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 180 N 7.96 4.32 0.00 2.81 2.81 0.00 0.00 7.26 6.51 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 0.00 181 L 7.81 4.01 0.00 1.83 1.72 0.95 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 182 V 7.81 3.64 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 0.66 0.00 0.00 0.63 0.00 0.00 183 R 7.97 3.90 0.00 2.02 1.96 0.00 3.16 0.00 0.00 3.23 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.93 0.00 184 D 8.04 4.75 0.00 2.65 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 0.00 185 N 8.21 5.01 0.00 2.81 2.75 0.00 0.00 6.36 7.17 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 0.00 186 M 7.50 5.10 0.00 2.06 2.00 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.80 2.56 0.00 187 I 8.53 4.22 1.98 0.00 0.00 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 1.35 0.88 1.06 0.00 0.00 188 L 8.08 4.68 0.00 1.55 1.64 0.92 1.29 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 0.00 189 G 9.13 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 0.00 190 V 7.03 4.62 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 0.75 0.00 0.00 0.96 0.00 0.00 191 R 8.50 4.62 0.00 1.83 1.81 0.00 3.18 0.00 0.00 3.22 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.67 0.00 192 V 9.02 4.63 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 0.76 0.00 0.00 0.92 0.00 0.00 193 K 8.25 5.00 0.00 1.62 1.60 0.00 1.60 0.00 0.00 0.83 0.00 0.00 2.72 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.22 1.25 7.81 *199 S 8.26 4.20 0.00 3.88 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 200 F 7.65 5.04 0.00 3.22 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 0.00 201 E 9.10 4.85 0.00 1.87 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 2.30 0.00 202 G 7.81 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 0.00 0.00 0.00 203 I 7.77 4.71 1.98 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 1.17 0.60 0.93 0.00 0.00 204 A 8.85 4.56 1.24 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 0.00 205 E 9.09 3.99 0.00 1.92 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.39 0.00 206 D 7.05 4.30 0.00 2.70 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 0.00 207 I 8.15 4.88 1.97 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 1.39 0.71 0.92 0.00 0.00 208 D 8.52 4.75 0.00 3.05 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 0.00 209 D 8.81 4.52 0.00 2.72 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 0.00 210 F 9.06 4.41 0.00 3.25 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 0.00 211 G 8.53 4.43 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 0.00 212 R 8.13 4.60 0.00 2.18 1.97 0.00 3.15 0.00 0.00 3.28 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 1.83 0.00 213 L 7.96 4.17 0.00 0.27 0.36 0.62 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 214 I 8.78 4.69 1.90 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 1.31 0.87 0.89 0.00 0.00 215 I 8.76 4.91 2.06 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 1.10 1.12 1.08 0.00 0.00 216 R 8.68 4.79 0.00 1.88 1.80 0.00 3.08 0.00 0.00 3.17 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.57 0.00 217 L 8.82 4.62 0.00 1.81 1.54 0.77 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 218 D 8.63 4.36 0.00 2.67 2.75 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 0.00 219 S 7.91 4.20 0.00 3.95 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 0.00 220 G 8.17 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 0.00 221 E 7.88 4.03 0.00 2.01 1.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.17 0.00 222 V 8.25 4.79 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 0.84 0.00 0.00 0.91 0.00 0.00 223 K 8.95 4.67 0.00 1.54 1.55 0.00 0.61 0.00 0.00 0.64 0.00 0.00 2.58 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.07 1.03 7.81 224 K 8.55 4.87 0.00 1.59 1.70 0.00 1.69 0.00 0.00 1.76 0.00 0.00 2.83 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.31 1.36 7.81 225 V 8.72 4.20 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 1.08 0.00 0.00 0.93 0.00 0.00 226 I 8.49 4.30 1.99 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.77 1.02 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.