NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.5688 8.3049 118.2270 55.0373 32.8336 174.5309 2 L 4.4135 8.5995 120.4822 53.7837 43.6939 174.2305 3 I 4.7618 9.3541 125.3554 59.5570 39.9106 174.3179 4 A 5.7669 9.0506 128.7801 49.0641 22.4936 175.1713 5 V 4.9571 8.0073 118.9222 59.2138 34.5253 173.1962 6 P 5.1296 0.0000 0.0000 62.8556 32.7417 175.5412 7 L 4.9157 9.0115 120.7806 53.8330 46.5241 175.9325 8 D 5.4806 8.6385 122.5420 52.7411 41.5515 176.0283 9 D 4.2591 7.9254 119.7471 53.5018 39.8527 175.7280 10 T 4.1408 9.1495 114.7547 63.6632 69.6878 174.8434 11 N 4.2050 8.9713 121.5086 52.3444 35.4533 173.6765 12 F 4.0504 8.4185 121.2251 62.5185 39.4447 175.6738 13 S 4.2926 8.5529 115.3928 61.0149 62.6981 176.6984 14 E 3.9817 8.0283 119.4584 59.3862 29.4989 178.7389 15 N 4.2943 8.1176 117.5013 55.7444 38.4507 177.1849 16 L 3.7383 8.1098 124.7196 58.5394 42.1614 179.7095 17 K 3.8956 7.8226 123.6429 59.8475 31.4865 181.0365 18 K 4.1733 8.0555 119.4780 59.1294 31.8719 179.3587 19 A 3.9396 8.2067 121.5554 54.9122 18.2439 179.5328 20 K 3.8955 8.4059 120.7843 60.4180 32.1583 179.4386 21 E 4.0034 7.9866 117.3438 61.1402 29.7495 180.8496 22 K 4.4588 8.1317 117.2189 56.9495 32.2321 177.9198 23 G 4.0685 7.6777 107.9102 45.0853 0.0000 173.8432 24 A 4.1563 8.0316 122.6251 52.1697 19.1079 177.9089 25 D 4.7902 8.9821 120.9962 55.3353 43.0670 176.7869 26 I 5.2220 7.5526 117.3939 59.3416 42.1459 174.5047 27 V 4.6942 8.7037 125.2032 61.1449 34.2066 173.8103 28 E 4.8385 9.1163 129.8710 54.9157 31.2769 174.9474 29 L 4.6607 8.8083 128.7123 54.3462 42.6855 176.9247 30 R 4.4634 8.6834 125.6368 54.3110 28.8185 177.5721 31 V 2.4544 8.2778 122.9295 64.8772 32.1110 177.7608 32 D 4.4662 8.0334 118.4385 55.2980 39.4846 177.1925 33 Q 4.6983 8.1984 118.0197 55.6085 29.2224 175.4321 34 F 4.8027 8.1225 119.6816 57.2073 39.6470 176.6046 35 S 4.5194 8.8530 119.8741 58.4396 62.4908 173.0268 36 D 4.5664 7.7505 119.4148 54.2660 43.4843 174.5567 37 T 4.7002 8.3928 115.7637 60.9926 69.6047 174.7432 38 S 4.2791 8.5968 117.9492 58.9272 64.8289 174.8303 39 L 3.9807 8.5716 123.5328 58.1425 41.2712 179.5231 40 N 4.3273 8.0876 116.4385 56.5928 38.9522 176.0799 41 Y 4.0817 7.7173 120.2314 60.9454 38.8826 178.5158 42 V 3.5886 7.9163 118.9557 65.5576 31.5232 177.8039 43 K 3.8713 7.9907 119.4611 59.7623 32.0364 178.6359 44 E 4.0922 8.4466 119.0003 59.2626 29.3751 179.6621 45 K 3.7973 7.5409 118.6294 59.3019 32.1079 179.3564 46 L 3.9949 7.9612 119.2617 57.9526 41.4704 179.5271 47 E 4.0624 8.4654 118.7004 59.2900 28.9798 179.0342 48 E 3.9685 8.4156 119.7209 59.0429 29.6706 179.0976 49 V 3.6434 7.8502 118.2165 66.4224 31.5808 177.8091 50 H 4.5971 8.0605 117.1796 58.5095 28.2861 177.9720 51 S 4.1797 8.2141 116.2548 60.9122 62.6716 175.6240 52 Q 4.4653 7.8088 118.6836 55.2333 28.7818 176.3903 53 G 3.9169 8.1936 108.5839 45.5001 0.0000 173.3522 54 L 4.8161 7.5103 118.6984 52.7905 44.8485 176.0446 55 K 4.8890 8.6489 120.8195 56.0511 34.3551 175.8712 56 T 5.2849 9.6253 111.4237 60.1162 72.6231 172.8815 57 I 5.1192 8.3804 122.7929 59.6183 40.6215 174.3844 58 L 4.7602 9.1387 130.7697 54.3728 43.0598 175.2039 59 T 4.9369 8.5840 123.2918 61.5201 71.7278 174.2677 60 I 4.8264 8.0509 125.0353 58.7169 37.2882 174.6256 61 R 4.7089 8.4965 123.3345 56.0182 31.4124 176.5719 62 S 4.5807 9.0254 120.6610 57.2313 63.9821 173.2937 63 P 4.5833 0.0000 0.0000 65.2371 31.0383 177.6169 64 E 4.1328 8.2015 115.6832 58.1410 29.8337 176.7660 65 E 4.7233 7.6283 119.1200 55.9265 30.0441 176.8613 66 G 3.7400 8.6632 105.4993 45.0899 0.0000 174.7092 67 G 4.5391 7.9690 110.2014 45.5709 0.0000 173.7901 68 R 4.9760 8.4708 125.3422 55.6415 33.7123 172.9717 69 E 4.1234 8.7797 118.8494 56.8918 30.7408 177.6252 70 V 4.1766 8.1790 122.8493 59.9669 33.4735 175.4842 71 K 3.8119 8.9527 129.4476 59.5086 31.9566 177.5533 72 N 4.8504 8.0183 116.8385 53.4710 38.2145 177.8252 73 R 3.6609 8.1233 122.5333 62.6496 29.4253 180.5431 74 E 4.4511 8.3574 122.1881 59.8311 29.5942 179.3119 75 E 4.3282 7.9937 119.1843 60.4681 29.8533 181.1209 76 L 4.1181 8.0537 120.2341 57.6585 41.5959 179.6868 77 F 4.4179 7.9042 117.5628 60.6933 38.3622 177.4035 78 E 4.0147 8.3624 118.1231 59.7378 29.1039 179.3362 79 E 4.1379 8.2339 116.8008 58.4149 29.9693 178.2310 80 L 4.4817 8.5826 118.1775 55.9363 42.1133 178.9085 81 S 4.2168 8.3251 115.7243 61.1726 62.5536 174.5622 82 P 4.4181 0.0000 0.0000 64.0564 31.2783 177.2695 83 L 4.5539 7.9480 116.4464 53.5469 42.9994 175.8788 84 S 4.8913 7.0990 113.4246 56.2212 64.4500 173.4652 85 D 4.5215 8.5676 126.8244 57.2362 41.6838 176.0653 86 Y 5.4730 8.5468 114.0874 56.5307 42.9409 174.8449 87 T 5.0990 8.8935 117.6534 61.9796 72.5266 172.3457 88 D 5.2952 9.1744 126.9084 52.7534 42.4856 175.1887 89 I 4.6005 8.5409 126.5302 58.9186 41.5892 174.3930 90 E 4.5262 8.6266 127.3741 56.0768 30.1201 177.6098 91 L 4.0071 9.0373 126.5966 58.1687 42.2181 178.5645 92 S 4.2408 7.6378 114.1114 60.3516 63.9791 174.8570 93 S 4.5611 7.7762 120.9120 56.8524 61.5475 175.0437 94 R 3.7180 7.9209 122.5813 59.4840 30.4594 179.8511 95 G 3.6936 8.0544 104.5890 47.3847 0.0000 173.7100 96 L 4.5026 7.8170 118.7312 54.9155 43.2028 178.2593 97 L 3.7974 7.3636 119.5733 58.0065 41.4582 179.3746 98 V 3.7496 7.7794 117.1208 65.9485 31.5369 177.8665 99 K 3.9280 8.0319 118.6983 59.7900 32.1824 178.7155 100 L 4.0356 8.3940 119.3674 57.5164 41.3444 179.0182 101 Y 4.0656 8.2222 119.9321 60.7289 38.8145 177.5482 102 N 4.1451 8.3033 117.4148 56.2314 38.7288 177.4606 103 I 3.6757 7.6999 121.3410 64.5717 37.2576 178.6310 104 T 3.8075 7.8743 110.5418 64.5721 68.5703 176.1557 105 K 3.6072 7.9312 123.1534 59.2239 31.9260 178.3468 106 E 3.9050 7.9264 117.5542 58.7267 29.6133 177.6454 107 A 4.3863 7.5862 117.7972 51.4181 19.0121 177.5457 108 G 3.7197 7.6680 105.2418 46.1313 0.0000 173.8232 109 K 4.4864 8.1145 119.6687 54.5024 34.8795 175.5434 110 K 4.7115 8.4724 119.3785 54.7332 35.4275 175.3973 111 L 5.1992 8.5445 124.7711 53.5028 44.6816 174.7252 112 I 4.8496 9.1970 127.4842 59.7975 39.6977 174.6746 113 I 4.8909 8.6217 127.8151 59.7746 39.4591 175.0741 114 S 5.2879 8.8738 122.4597 57.0552 66.2169 172.6552 115 Y 5.1302 8.4292 121.1945 56.5234 42.0152 173.3586 116 H 4.7897 8.4676 123.1958 53.7178 32.4803 173.1232 117 N 4.4647 8.1889 120.0272 51.8857 41.2790 174.5305 118 F 4.4836 8.8510 124.1758 58.1793 39.5459 176.1620 119 E 4.5069 8.1778 120.1968 57.4160 31.1028 175.3084 120 L 4.5813 7.9860 115.3753 56.1917 43.5377 174.1698 121 T 4.2943 8.0770 115.7441 61.0803 68.5046 173.3282 122 P 4.3887 0.0000 0.0000 61.5364 32.2955 174.3877 123 P 4.3421 0.0000 0.0000 62.7584 32.0455 177.2325 124 N 4.2673 8.9372 117.9745 56.5149 38.4197 177.6761 125 W 4.2383 8.2314 117.3423 59.5853 28.0624 178.3785 126 I 2.9447 6.4488 120.2007 63.7019 36.5265 178.2191 127 I 3.4900 7.3017 120.1157 64.5709 36.9135 178.5805 128 R 3.9580 8.1277 118.9286 59.1108 29.8090 178.7917 129 E 3.9430 8.2772 119.2561 59.1544 29.6619 178.9777 130 V 3.4486 7.7309 118.3825 65.8855 31.6299 178.0551 131 L 3.7696 7.6745 118.1945 57.9044 41.4851 179.7578 132 R 4.1395 8.3276 118.3380 59.3570 30.0033 179.0511 133 E 4.1303 8.7649 119.0658 59.2063 29.3859 179.4799 134 G 3.5948 8.0625 105.8380 48.2190 0.0000 175.3896 135 Y 4.3195 7.6666 119.0077 60.6541 37.6418 178.3156 136 R 3.8805 8.0677 119.1324 59.0195 30.1730 177.1543 137 Y 4.3359 7.8419 114.1660 57.0688 38.0105 175.7467 138 G 3.7123 7.9206 107.7533 46.2657 0.0000 173.4252 139 G 4.3553 8.1767 106.6146 43.9714 0.0000 173.0129 140 I 4.5378 8.9602 121.5827 59.0692 38.1732 174.3011 141 P 4.7686 0.0000 0.0000 62.6205 32.6491 175.1490 142 K 4.9942 9.0630 124.2170 54.6347 35.4438 174.5471 143 I 4.9482 8.8934 127.7457 59.4330 40.5681 174.3040 144 A 4.9266 8.7521 128.9016 50.1728 21.3173 174.9899 145 V 4.6816 8.3988 114.4311 59.7893 36.1726 175.4741 146 K 4.5041 8.6106 126.0740 56.4530 32.6435 175.9280 147 A 4.5200 8.4799 129.6459 50.0801 19.7357 176.6779 148 N 4.7938 8.9781 119.1629 52.3100 38.9317 174.3508 149 S 2.7900 6.4344 111.8704 56.1149 65.1351 176.6581 150 Y 4.0991 7.4814 118.4083 61.0756 37.4297 178.2342 151 E 4.0036 8.1702 119.2912 59.6419 29.5349 178.9671 152 D 4.2739 7.9346 118.5601 56.9943 40.7617 179.1222 153 V 3.4655 7.2608 118.4076 65.9459 31.5768 177.8114 154 A 3.8830 7.9116 120.5512 55.1529 18.0972 179.5703 155 R 3.7417 8.1260 117.1629 59.4297 30.2161 178.3501 156 L 3.8572 7.7103 120.0632 58.2171 41.8250 179.0137 157 L 3.6142 7.3687 117.3635 57.8752 41.5751 179.0576 158 C 4.3756 8.1075 116.9543 62.9244 28.1073 176.2945 159 I 3.7986 8.1756 122.0483 64.0832 36.5368 178.5548 160 S 4.2246 7.9508 114.7786 61.2938 62.4808 176.5462 161 R 4.1632 7.6779 120.6174 58.3804 29.9149 178.0180 162 Q 4.4973 7.9471 116.6499 56.2050 29.2371 176.1296 163 V 4.2517 7.3293 119.0847 60.1581 32.2749 174.3066 164 E 3.9517 8.5272 127.1943 56.2670 30.1642 175.4277 165 G 4.2318 8.6943 109.0782 43.5184 0.0000 173.0384 166 E 4.4353 8.3874 119.7198 56.4533 30.7940 176.0484 167 K 4.7093 8.5702 119.3899 56.4407 36.8076 173.8931 168 I 4.8679 8.7419 119.9855 59.8257 40.5148 174.7984 169 L 5.1555 9.0018 127.6041 52.9251 44.3704 176.4369 170 I 4.5324 8.7073 123.8570 59.8929 41.7692 174.3343 171 S 5.0372 8.8992 124.2234 57.2590 64.1596 174.1131 172 M 4.4709 8.7249 125.6876 55.4039 33.1724 177.0142 173 G 4.1399 8.8042 106.2092 44.7645 0.0000 174.3695 174 D 4.3347 8.5162 117.4097 56.4816 39.5123 178.4709 175 Y 3.9818 8.0443 117.1816 60.6764 37.9965 177.9377 176 G 4.3116 8.0670 105.1620 44.0852 0.0000 174.8200 177 K 3.8465 7.7552 122.8119 59.9478 32.1007 178.2224 178 I 3.7505 7.9377 118.0598 63.9476 37.8340 177.7006 179 S 4.3573 8.5090 115.5150 61.1808 62.5311 176.6012 180 R 4.0786 7.9454 121.0583 58.0783 29.7854 177.6236 181 L 4.4742 7.6426 118.2255 56.9384 43.4468 177.7318 182 A 4.4988 8.5804 120.3134 54.0671 18.3572 179.4147 183 G 3.8900 8.2488 105.0116 48.1855 0.0000 174.8969 184 Y 4.7190 8.2662 122.4330 60.1908 38.4320 178.5700 185 V 3.3986 7.6447 116.7735 64.8018 31.4984 176.8820 186 F 4.6874 8.0863 116.2531 56.9722 39.6490 176.5396 187 G 3.8469 7.9113 107.0892 45.2565 0.0000 173.5379 188 S 4.8553 7.9003 115.4158 58.2188 62.8612 174.6028 189 V 4.3235 8.7988 121.0877 62.3992 32.8783 175.9548 190 I 5.0360 7.7279 119.9123 59.6370 40.9229 174.5040 191 T 4.8745 8.8139 120.1652 60.5064 70.8079 171.9021 192 Y 5.1751 8.8667 123.6400 56.5405 40.3783 174.6345 193 C 5.2135 9.1174 121.1335 57.9564 31.7819 173.1555 194 S 4.7696 8.4999 114.2197 56.7539 64.4203 175.5111 195 L 3.8070 8.7385 125.7893 58.4577 42.1770 178.1213 *197 K 4.0985 7.7064 117.4655 53.6973 33.0919 178.4191 198 A 4.2203 8.5878 126.2612 52.9904 18.8590 178.3638 *199 F 4.6157 9.0766 119.1994 56.4665 40.1589 174.2555 200 A 4.8349 7.6630 120.2747 49.8675 22.1622 173.4278 201 P 4.3557 0.0000 0.0000 64.5076 31.6697 177.2087 202 G 4.1092 8.8271 110.9170 46.4364 0.0000 173.6539 203 Q 4.3523 7.4463 117.4877 55.9767 29.8469 175.8085 204 I 4.6609 8.0766 121.2100 58.7794 41.0909 173.3516 205 P 4.8066 0.0000 0.0000 61.9110 32.2599 176.8922 206 L 3.8959 8.7917 125.8782 58.7612 41.8004 179.5258 207 E 3.9770 8.2026 117.5491 59.5900 29.4220 179.1860 208 E 3.9941 8.0984 118.0232 59.6396 29.5683 178.9184 209 M 4.0883 8.1556 118.2948 58.3874 32.2200 178.4475 210 V 3.5680 7.8099 118.6817 66.0442 31.7121 177.7256 211 E 3.9978 7.9760 119.0624 59.1136 29.3940 178.7624 212 L 4.1346 8.0829 119.3378 57.7148 41.7118 179.3473 213 R 3.9693 8.4272 119.1618 59.1794 30.0083 178.6015 214 K 3.9492 7.9395 119.1387 59.3492 32.0393 178.7948 215 K 3.7473 7.9726 118.7670 59.1966 32.1486 178.0784 216 F 4.2895 8.0303 116.3494 58.3967 39.4244 176.0966 217 Y 4.9688 7.5332 112.1707 56.6323 39.3350 175.3482 218 R 3.8760 8.9147 117.5181 57.0643 28.5274 176.2616 219 L 4.0520 8.2373 121.9007 55.2797 41.1910 174.6020 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 4.57 0.00 1.85 2.24 0.00 0.00 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.43 2.42 0.00 2 L 8.60 4.41 0.00 1.57 1.58 1.04 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 3 I 9.35 4.76 1.83 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 1.14 0.77 0.88 0.00 0.00 4 A 9.05 5.77 0.68 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 5 V 8.01 4.96 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 0.81 0.00 0.00 1.02 0.00 0.00 6 P 0.00 5.13 0.00 2.20 2.39 0.00 4.05 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.11 0.00 7 L 9.01 4.92 0.00 1.88 1.79 0.79 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 8 D 8.64 5.48 0.00 2.95 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 9 D 7.93 4.26 0.00 2.49 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 0.00 0.00 0.00 0.00 10 T 9.15 4.14 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 1.24 0.00 0.00 11 N 8.97 4.20 0.00 2.75 2.83 0.00 0.00 6.52 8.12 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 12 F 8.42 4.05 0.00 3.21 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 13 S 8.55 4.29 0.00 3.92 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 14 E 8.03 3.98 0.00 2.16 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.58 0.00 15 N 8.12 4.29 0.00 2.74 2.80 0.00 0.00 6.60 6.34 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 16 L 8.11 3.74 0.00 0.98 1.53 0.81 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 17 K 7.82 3.90 0.00 1.82 1.81 0.00 1.86 0.00 0.00 1.65 0.00 0.00 2.88 0.00 0.00 2.75 0.00 0.00 0.00 0.00 1.38 1.36 7.81 18 K 8.06 4.17 0.00 1.92 1.85 0.00 1.61 0.00 0.00 1.63 0.00 0.00 2.94 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.43 1.62 7.81 19 A 8.21 3.94 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 20 K 8.41 3.90 0.00 1.79 1.96 0.00 1.73 0.00 0.00 1.67 0.00 0.00 2.97 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.42 1.44 7.81 21 E 7.99 4.00 0.00 2.12 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 2.23 0.00 22 K 8.13 4.46 0.00 1.78 1.88 0.00 1.62 0.00 0.00 1.70 0.00 0.00 3.03 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.61 1.54 7.81 23 G 7.68 4.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 A 8.03 4.16 1.32 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 25 D 8.98 4.79 0.00 2.68 2.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 I 7.55 5.22 1.76 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 1.34 0.82 0.93 0.00 0.00 27 V 8.70 4.69 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 0.92 0.00 0.00 28 E 9.12 4.84 0.00 2.20 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 2.35 2.39 0.00 29 L 8.81 4.66 0.00 1.66 1.41 1.06 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 30 R 8.68 4.46 0.00 2.01 2.04 0.00 3.34 0.00 0.00 3.15 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.78 0.00 31 V 8.28 2.45 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 0.64 0.00 0.00 0.47 0.00 0.00 32 D 8.03 4.47 0.00 2.92 2.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 Q 8.20 4.70 0.00 2.33 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.86 0.00 0.00 0.00 0.00 0.00 2.35 2.51 0.00 34 F 8.12 4.80 0.00 3.12 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 35 S 8.85 4.52 0.00 3.65 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 36 D 7.75 4.57 0.00 1.95 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 0.00 0.00 0.00 0.00 37 T 8.39 4.70 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 1.22 0.00 0.00 38 S 8.60 4.28 0.00 4.08 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 39 L 8.57 3.98 0.00 1.72 1.78 0.92 0.54 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 40 N 8.09 4.33 0.00 2.86 2.85 0.00 0.00 6.85 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 Y 7.72 4.08 0.00 3.11 3.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 V 7.92 3.59 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 0.77 0.00 0.00 0.98 0.00 0.00 43 K 7.99 3.87 0.00 2.00 1.97 0.00 1.70 0.00 0.00 1.65 0.00 0.00 2.94 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.44 1.49 7.81 44 E 8.45 4.09 0.00 1.90 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 2.32 2.67 0.00 45 K 7.54 3.80 0.00 1.71 1.42 0.00 0.61 0.00 0.00 0.91 0.00 0.00 2.13 0.00 0.00 2.44 0.00 0.00 0.00 0.00 0.98 1.13 7.81 46 L 7.96 3.99 0.00 1.86 1.67 0.92 0.82 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 47 E 8.47 4.06 0.00 2.15 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 0.00 2.36 2.61 0.00 48 E 8.42 3.97 0.00 2.30 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 2.37 2.37 0.00 49 V 7.85 3.64 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 1.08 0.00 0.00 1.18 0.00 0.00 50 H 8.06 4.60 0.00 3.45 3.32 0.00 5.70 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 S 8.21 4.18 0.00 4.05 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 52 Q 7.81 4.47 0.00 2.20 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.01 0.00 0.00 0.00 0.00 0.00 2.49 2.47 0.00 53 G 8.19 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 54 L 7.51 4.82 0.00 1.67 1.60 0.96 0.97 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 55 K 8.65 4.89 0.00 1.87 1.94 0.00 1.72 0.00 0.00 1.77 0.00 0.00 2.91 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.71 1.44 7.81 56 T 9.63 5.28 4.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 57 I 8.38 5.12 1.95 0.00 0.00 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.91 1.02 0.00 0.00 58 L 9.14 4.76 0.00 1.81 1.70 0.82 0.59 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 59 T 8.58 4.94 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 1.29 0.00 0.00 60 I 8.05 4.83 1.64 0.00 0.00 -0.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.90 0.29 0.71 0.00 0.00 61 R 8.50 4.71 0.00 1.94 1.98 0.00 3.29 0.00 0.00 3.57 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.58 0.00 62 S 9.03 4.58 0.00 4.32 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 63 P 0.00 4.58 0.00 2.18 2.22 0.00 3.38 0.00 0.00 2.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.92 0.00 64 E 8.20 4.13 0.00 2.12 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 0.00 2.29 2.30 0.00 65 E 7.63 4.72 0.00 2.02 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 2.22 2.22 0.00 66 G 8.66 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 67 G 7.97 4.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 68 R 8.47 4.98 0.00 1.55 1.64 0.00 3.28 0.00 0.00 3.26 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.20 0.00 69 E 8.78 4.12 0.00 1.75 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 2.23 1.88 0.00 70 V 8.18 4.18 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 0.96 0.00 0.00 0.87 0.00 0.00 71 K 8.95 3.81 0.00 1.73 1.84 0.00 1.80 0.00 0.00 1.74 0.00 0.00 2.92 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.42 1.46 7.81 72 N 8.02 4.85 0.00 2.87 2.98 0.00 0.00 6.26 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 73 R 8.12 3.66 0.00 1.83 1.99 0.00 3.28 0.00 0.00 3.09 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.52 0.00 74 E 8.36 4.45 0.00 2.11 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 0.00 2.44 2.48 0.00 75 E 7.99 4.33 0.00 2.01 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 2.31 1.83 0.00 76 L 8.05 4.12 0.00 1.50 1.49 0.73 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 77 F 7.90 4.42 0.00 3.29 2.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 E 8.36 4.01 0.00 2.21 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 0.00 2.40 2.73 0.00 79 E 8.23 4.14 0.00 1.95 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.49 0.00 80 L 8.58 4.48 0.00 1.74 1.70 0.86 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 81 S 8.33 4.22 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 82 P 0.00 4.42 0.00 2.03 2.10 0.00 3.71 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 2.04 2.18 0.00 83 L 7.95 4.55 0.00 1.71 1.72 0.94 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 84 S 7.10 4.89 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 85 D 8.57 4.52 0.00 2.86 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 0.00 0.00 0.00 86 Y 8.55 5.47 0.00 2.87 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 87 T 8.89 5.10 4.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 88 D 9.17 5.30 0.00 2.75 2.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 89 I 8.54 4.60 1.50 0.00 0.00 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 1.28 0.82 0.00 0.00 90 E 8.63 4.53 0.00 2.02 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 2.42 2.40 0.00 91 L 9.04 4.01 0.00 1.56 1.73 0.85 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 92 S 7.64 4.24 0.00 4.10 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 93 S 7.78 4.56 0.00 3.98 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 94 R 7.92 3.72 0.00 1.81 1.97 0.00 3.29 0.00 0.00 3.18 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.60 0.00 95 G 8.05 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 0.00 0.00 0.00 96 L 7.82 4.50 0.00 1.60 1.55 1.00 0.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 97 L 7.36 3.80 0.00 1.36 1.35 -0.33 0.43 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 98 V 7.78 3.75 2.16 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 1.13 0.00 0.00 1.09 0.00 0.00 99 K 8.03 3.93 0.00 1.88 1.98 0.00 1.80 0.00 0.00 1.84 0.00 0.00 3.19 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.52 1.56 7.81 100 L 8.39 4.04 0.00 1.74 1.60 0.84 -0.02 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 0.00 101 Y 8.22 4.07 0.00 3.15 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 0.00 102 N 8.30 4.15 0.00 2.96 2.85 0.00 0.00 7.08 7.06 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 0.00 103 I 7.70 3.68 1.98 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 1.58 1.10 0.92 0.00 0.00 104 T 7.87 3.81 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 1.27 0.00 0.00 105 K 7.93 3.61 0.00 1.07 1.59 0.00 1.40 0.00 0.00 1.44 0.00 0.00 2.96 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.20 1.34 7.81 106 E 7.93 3.90 0.00 1.96 1.99 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 2.29 2.30 0.00 107 A 7.59 4.39 1.31 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 0.00 108 G 7.67 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 K 8.11 4.49 0.00 1.55 1.92 0.00 1.75 0.00 0.00 1.63 0.00 0.00 2.90 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.50 1.74 7.81 110 K 8.47 4.71 0.00 1.49 1.78 0.00 1.24 0.00 0.00 1.67 0.00 0.00 2.78 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.31 1.13 7.81 111 L 8.54 5.20 0.00 1.82 1.63 0.95 1.08 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 0.00 112 I 9.20 4.85 1.94 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 1.30 0.76 0.99 0.00 0.00 113 I 8.62 4.89 1.84 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 1.24 0.78 0.84 0.00 0.00 114 S 8.87 5.29 0.00 3.75 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 0.00 115 Y 8.43 5.13 0.00 3.00 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 0.00 116 H 8.47 4.79 0.00 2.57 2.18 0.00 5.85 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 0.00 117 N 8.19 4.46 0.00 2.48 2.57 0.00 0.00 7.13 7.23 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 0.00 118 F 8.85 4.48 0.00 3.07 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 0.00 119 E 8.18 4.51 0.00 2.09 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.25 2.32 0.00 120 L 7.99 4.58 0.00 1.66 1.60 0.90 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 121 T 8.08 4.29 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 1.15 0.00 0.00 122 P 0.00 4.39 0.00 1.89 1.98 0.00 3.76 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 1.86 2.02 0.00 123 P 0.00 4.34 0.00 1.94 2.11 0.00 3.35 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.13 0.00 124 N 8.94 4.27 0.00 2.78 2.90 0.00 0.00 6.62 7.68 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 0.00 125 W 8.23 4.24 0.00 3.59 3.33 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 0.00 126 I 6.45 2.94 1.32 0.00 0.00 0.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 -0.36 0.29 0.00 0.00 127 I 7.30 3.49 1.94 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 1.52 1.08 0.85 0.00 0.00 128 R 8.13 3.96 0.00 1.89 2.02 0.00 3.17 0.00 0.00 3.37 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.79 0.00 129 E 8.28 3.94 0.00 2.28 1.99 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 2.31 2.38 0.00 130 V 7.73 3.45 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 0.88 0.00 0.00 0.35 0.00 0.00 131 L 7.67 3.77 0.00 1.94 1.73 0.95 0.64 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 0.00 132 R 8.33 4.14 0.00 1.94 2.03 0.00 3.17 0.00 0.00 3.21 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.88 0.00 133 E 8.76 4.13 0.00 2.03 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.51 2.53 0.00 134 G 8.06 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 135 Y 7.67 4.32 0.00 3.21 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 0.00 136 R 8.07 3.88 0.00 1.81 2.07 0.00 3.12 0.00 0.00 3.25 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 1.43 0.00 137 Y 7.84 4.34 0.00 2.97 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 0.00 138 G 7.92 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 0.00 0.00 0.00 139 G 8.18 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 0.00 140 I 8.96 4.54 1.97 0.00 0.00 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.01 0.99 0.00 0.00 141 P 0.00 4.77 0.00 1.86 1.77 0.00 3.57 0.00 0.00 3.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.56 0.00 142 K 9.06 4.99 0.00 1.79 1.60 0.00 1.54 0.00 0.00 1.66 0.00 0.00 2.49 0.00 0.00 2.53 0.00 0.00 0.00 0.00 1.15 1.29 7.81 143 I 8.89 4.95 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 1.16 0.51 0.94 0.00 0.00 144 A 8.75 4.93 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 145 V 8.40 4.68 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.68 0.00 0.00 0.87 0.00 0.00 146 K 8.61 4.50 0.00 1.77 1.70 0.00 1.91 0.00 0.00 1.90 0.00 0.00 2.83 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.47 1.43 7.81 147 A 8.48 4.52 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 0.00 148 N 8.98 4.79 0.00 2.82 2.74 0.00 0.00 6.29 7.18 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 0.00 149 S 6.43 2.79 0.00 3.58 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 150 Y 7.48 4.10 0.00 3.04 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 0.00 151 E 8.17 4.00 0.00 1.91 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.36 2.32 0.00 152 D 7.93 4.27 0.00 2.81 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 0.00 153 V 7.26 3.47 2.29 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 1.02 0.00 0.00 1.05 0.00 0.00 154 A 7.91 3.88 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 155 R 8.13 3.74 0.00 1.98 2.02 0.00 3.21 0.00 0.00 3.07 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.61 0.00 156 L 7.71 3.86 0.00 1.74 1.71 0.86 0.67 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 0.00 157 L 7.37 3.61 0.00 1.07 0.13 0.62 0.72 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 0.00 158 C 8.11 4.38 0.00 2.97 3.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 159 I 8.18 3.80 1.90 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 1.75 1.37 0.96 0.00 0.00 160 S 7.95 4.22 0.00 4.08 4.28 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 0.00 161 R 7.68 4.16 0.00 1.95 2.09 0.00 3.52 0.00 0.00 3.41 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 2.08 0.00 162 Q 7.95 4.50 0.00 2.15 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.03 6.90 0.00 0.00 0.00 0.00 0.00 2.42 2.51 0.00 163 V 7.33 4.25 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 1.02 0.00 0.00 0.99 0.00 0.00 164 E 8.53 3.95 0.00 1.93 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 2.18 2.26 0.00 165 G 8.69 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 0.00 166 E 8.39 4.44 0.00 2.08 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 0.00 2.40 2.46 0.00 167 K 8.57 4.71 0.00 1.96 2.03 0.00 1.33 0.00 0.00 1.70 0.00 0.00 3.01 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.43 1.49 7.81 168 I 8.74 4.87 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 1.31 0.89 1.09 0.00 0.00 169 L 9.00 5.16 0.00 1.50 1.53 0.95 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 170 I 8.71 4.53 1.76 0.00 0.00 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 1.00 0.88 0.00 0.00 171 S 8.90 5.04 0.00 3.78 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 172 M 8.72 4.47 0.00 1.97 1.93 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.44 0.00 173 G 8.80 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 D 8.52 4.33 0.00 2.73 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 0.00 175 Y 8.04 3.98 0.00 2.91 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 0.00 176 G 8.07 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 0.00 177 K 7.76 3.85 0.00 1.98 1.90 0.00 1.66 0.00 0.00 1.60 0.00 0.00 2.90 0.00 0.00 3.22 0.00 0.00 0.00 0.00 1.47 1.70 7.81 178 I 7.94 3.75 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 1.69 1.13 0.97 0.00 0.00 179 S 8.51 4.36 0.00 4.05 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 0.00 180 R 7.95 4.08 0.00 1.99 2.10 0.00 3.26 0.00 0.00 3.21 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.67 0.00 181 L 7.64 4.47 0.00 1.58 1.74 0.86 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 182 A 8.58 4.50 1.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 183 G 8.25 3.89 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 0.00 184 Y 8.27 4.72 0.00 2.89 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 0.00 185 V 7.64 3.40 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 0.31 0.00 0.00 0.99 0.00 0.00 186 F 8.09 4.69 0.00 3.20 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 0.00 187 G 7.91 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 0.00 0.00 0.00 188 S 7.90 4.86 0.00 4.02 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 189 V 8.80 4.32 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.75 0.00 0.00 1.03 0.00 0.00 190 I 7.73 5.04 1.82 0.00 0.00 0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.54 0.37 0.00 0.00 191 T 8.81 4.87 4.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 192 Y 8.87 5.18 0.00 2.84 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 0.00 193 C 9.12 5.21 0.00 2.80 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 0.00 194 S 8.50 4.77 0.00 3.93 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 0.00 195 L 8.74 3.81 0.00 1.62 1.75 0.90 0.54 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 *197 K 7.71 4.10 0.00 1.84 1.62 0.00 1.86 0.00 0.00 1.71 0.00 0.00 2.92 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.26 1.02 7.81 198 A 8.59 4.22 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 *199 F 9.08 4.62 0.00 2.28 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 200 A 7.66 4.83 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 0.00 201 P 0.00 4.36 0.00 2.04 2.00 0.00 3.68 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.09 0.00 202 G 8.83 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 0.00 0.00 0.00 0.00 203 Q 7.45 4.35 0.00 2.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.62 6.53 0.00 0.00 0.00 0.00 0.00 2.43 2.54 0.00 204 I 8.08 4.66 1.91 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 1.37 0.85 0.94 0.00 0.00 205 P 0.00 4.81 0.00 2.08 1.97 0.00 3.92 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 1.94 0.00 206 L 8.79 3.90 0.00 1.77 1.69 0.90 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 207 E 8.20 3.98 0.00 2.05 1.99 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 2.40 2.41 0.00 208 E 8.10 3.99 0.00 2.19 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 2.41 2.37 0.00 209 M 8.16 4.09 0.00 2.16 2.08 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 2.61 0.00 210 V 7.81 3.57 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 0.94 0.00 0.00 1.05 0.00 0.00 211 E 7.98 4.00 0.00 2.09 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 0.00 2.30 2.38 0.00 212 L 8.08 4.13 0.00 1.95 1.81 0.95 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 213 R 8.43 3.97 0.00 1.98 2.10 0.00 3.07 0.00 0.00 3.10 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.72 0.00 214 K 7.94 3.95 0.00 1.86 1.94 0.00 1.84 0.00 0.00 1.56 0.00 0.00 2.89 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.41 1.43 7.81 215 K 7.97 3.75 0.00 1.72 1.75 0.00 1.45 0.00 0.00 1.30 0.00 0.00 2.89 0.00 0.00 2.86 0.00 0.00 0.00 0.00 0.68 1.17 7.81 216 F 8.03 4.29 0.00 2.53 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 0.00 0.00 0.00 0.00 217 Y 7.53 4.97 0.00 3.02 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 0.00 218 R 8.91 3.88 0.00 2.02 2.02 0.00 3.24 0.00 0.00 3.23 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.59 0.00 219 L 8.24 4.05 0.00 1.82 1.75 0.95 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.80 0.00 0.00 0.00 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.