NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 4 E 4.4163 8.4293 118.8062 55.2089 29.5163 174.3201 5 P 4.4028 0.0000 0.0000 62.4692 32.1367 177.0331 6 K 3.9050 9.6106 124.5322 58.5065 33.2749 177.7491 7 Y 4.8911 7.0043 111.9506 56.2342 40.8322 175.3295 8 Q 4.4443 9.3801 121.9722 57.1629 31.0220 175.6983 9 R 5.1103 8.1139 119.9582 55.1569 33.2432 173.8194 10 I 4.9683 8.7146 119.7496 58.8846 41.6228 174.2861 11 L 5.0152 8.3571 124.1225 53.3980 44.8106 175.2109 12 I 4.4685 8.9102 128.9973 60.6198 38.5531 174.8785 13 K 5.0068 8.7061 129.1371 54.8414 33.4259 175.3273 14 L 4.9643 8.8760 127.7233 52.8669 45.2887 175.9836 15 S 4.7471 8.4888 116.4972 57.3601 64.8784 175.2489 16 G 3.8644 8.0660 111.7177 47.5477 0.0000 175.6571 17 E 3.9606 7.6879 119.4709 59.3944 29.3552 179.2412 18 A 4.1228 7.6764 118.3988 54.1640 18.6415 178.3425 19 L 4.5414 8.1628 116.0270 54.5742 42.6811 178.2552 20 A 4.5505 7.7264 122.0893 52.4029 19.1240 179.2532 21 G 3.8226 7.8830 103.5286 45.1749 0.0000 172.6837 22 E 3.6215 8.3998 114.9336 59.8246 29.5889 178.9160 23 K 3.6859 7.2685 118.5263 58.5021 32.9775 176.7383 24 G 3.7470 7.0085 106.1872 45.5147 0.0000 173.7503 25 V 4.4993 7.1451 112.1971 60.3575 35.7220 176.4062 26 G 3.8689 9.2823 111.1519 44.8572 0.0000 172.0306 27 I 4.6417 8.1300 118.7230 59.4968 39.2915 175.1172 28 D 4.6870 8.7584 126.3426 52.5052 40.8121 176.4448 29 I 3.7003 8.5170 128.4936 64.1218 37.0357 176.0919 30 P 4.4181 0.0000 0.0000 66.3877 30.6757 178.5121 31 T 3.9224 8.1956 115.6332 66.3465 68.3245 176.9633 32 V 3.6058 7.6428 119.7254 66.2023 31.6363 177.9635 33 Q 4.1530 8.5653 117.9181 58.8303 28.1834 178.6055 34 A 4.0337 7.7698 121.9972 55.2917 18.4385 179.8023 35 I 3.7826 7.6965 117.8262 64.2913 37.1502 178.5194 36 A 3.9981 8.4111 122.1947 54.9518 18.3287 179.5979 37 K 2.6119 8.1974 118.6253 58.9954 32.1805 178.7830 38 E 3.8766 7.5756 118.4067 59.2342 29.5728 178.8256 39 I 3.6991 7.8088 119.6840 64.2130 36.9088 178.1398 40 A 4.0156 8.0300 121.1532 55.2224 18.5898 178.9901 41 E 4.0182 7.9108 117.3346 59.4619 29.6578 179.2733 42 V 3.6269 7.7743 118.1694 66.1268 31.6984 177.4036 43 H 4.0913 8.7259 118.3915 59.0177 29.3560 177.2574 44 V 3.7174 7.4529 118.9954 65.4381 31.3856 177.6847 45 S 4.4038 8.0160 113.4794 59.7747 62.9683 175.1037 46 G 3.9703 7.7317 109.3950 44.6682 0.0000 173.5278 47 V 3.8653 7.0560 120.2033 62.4244 32.3110 175.8547 48 Q 4.3232 8.9005 127.4982 56.0769 29.8165 175.2670 49 I 5.2244 8.4217 122.7524 59.5507 41.6770 174.1477 50 A 4.9027 8.6858 125.5469 50.2826 22.8486 175.0034 51 L 5.2800 8.8120 120.6073 53.0029 45.7543 176.2290 52 V 4.6768 8.6863 120.8589 61.7402 34.3850 174.0370 53 I 4.9222 8.5521 128.6168 59.6791 39.6085 176.0168 54 G 3.9369 8.7547 113.1343 44.9083 0.0000 174.0915 55 G 4.4868 8.3439 105.6501 45.0371 0.0000 175.5357 56 G 4.0262 8.5754 111.5805 47.3253 0.0000 176.2402 57 N 4.4615 8.2492 116.6450 54.4863 37.6445 176.1732 58 L 4.6432 7.0569 117.2818 54.6948 43.8667 176.4853 59 W 4.8341 8.3705 126.8560 56.3114 32.7181 173.0775 60 R 4.5946 7.5141 123.8320 53.8004 32.7527 176.9827 61 G 3.7406 8.4630 108.7562 47.4939 0.0000 174.9777 62 E 3.8073 8.1971 121.1220 59.4236 29.3652 177.2615 63 P 4.1888 0.0000 0.0000 65.3889 31.1451 178.2858 64 A 3.8273 6.7830 118.9686 55.0371 18.5983 179.1065 65 A 4.0784 8.2790 119.7444 55.4046 18.2119 179.5963 66 D 4.2833 7.9741 116.2770 57.3905 40.9890 178.5054 67 A 4.3907 8.0709 120.0592 52.1949 18.7027 175.5564 68 G 3.4712 7.5887 108.1897 45.8960 0.0000 172.8298 *70 D 4.3354 8.1959 123.9649 53.2026 42.8248 175.1944 71 R 3.8040 8.5516 126.6642 59.6194 30.0778 178.5477 72 V 3.1700 7.6824 117.1132 66.1264 31.6892 177.7550 73 Q 4.0990 8.5542 117.5996 58.9761 28.6169 178.8186 74 A 4.1345 8.4569 122.1589 55.3788 18.2293 179.4658 75 D 4.3342 7.9385 116.4564 57.6515 40.8943 178.2918 76 Y 4.4559 7.4886 116.4232 61.3228 38.0047 178.1675 77 T 3.8608 7.8930 116.8267 66.3048 68.4437 177.9164 78 G 3.8098 7.4150 106.8165 44.6425 0.0000 175.5870 *80 L 4.2617 8.0380 122.3237 54.3340 43.6336 179.7853 81 G 3.7558 7.5724 106.2834 48.7408 0.0000 174.9343 82 T 4.0388 7.9091 116.6748 66.6215 68.6708 176.8957 83 V 3.6538 7.5868 121.4533 63.0357 30.7161 177.5698 *85 N 4.6063 8.3531 117.1533 52.9119 40.5814 176.9497 86 A 3.8672 7.9724 120.0902 55.2506 18.9198 178.6769 87 L 4.1160 8.3093 116.2056 58.1501 41.9362 180.4276 88 V 3.5401 7.3331 115.9082 63.2538 31.1673 177.4692 *90 A 4.2469 8.1420 122.8422 51.7450 20.6620 179.4121 91 D 4.5952 8.0733 116.1012 57.2159 41.0291 178.6516 92 S 4.0902 7.8728 114.4266 61.5900 63.0704 176.4242 93 L 4.3223 7.9143 121.2812 57.9298 40.9486 179.3721 94 Q 4.4544 7.9809 119.0443 58.5798 28.3590 178.2878 95 H 4.0662 7.8967 116.1663 57.8133 28.6634 175.4830 96 Y 4.5665 7.6385 117.9458 57.5110 38.3101 175.5612 97 G 3.9227 7.9600 105.4870 46.7709 0.0000 174.4702 98 V 4.1662 7.6272 118.6329 60.4749 33.5036 173.6197 99 D 4.8456 8.6261 127.4977 54.2149 41.7005 174.8690 100 T 5.1414 8.3976 115.8364 60.0829 72.0896 173.8250 101 R 4.5723 8.7032 120.6752 54.6735 34.5543 174.2310 102 V 4.6625 8.4313 123.5738 61.5078 33.3423 174.7767 103 Q 5.6509 9.3718 126.5903 53.4736 32.0614 174.3527 104 T 5.0630 8.5562 114.0740 59.9228 70.8153 175.6523 105 A 4.1464 9.0398 126.6646 54.2014 19.2523 177.4994 106 I 4.1960 7.6287 116.2431 58.6597 37.8000 173.6506 107 P 4.2891 0.0000 0.0000 62.9036 31.3744 175.8672 *109 Q 4.2675 8.1305 117.9883 56.3799 30.6209 175.7531 110 N 4.4159 8.0470 115.6325 56.7090 39.5515 176.4155 111 V 3.7008 7.8214 116.0567 65.7243 31.7967 175.5444 112 A 4.6608 7.3729 117.1642 50.2804 22.1308 175.7249 113 E 4.1333 8.8077 121.5898 55.7853 30.6709 174.8116 114 P 4.7962 0.0000 0.0000 62.7034 32.7019 175.1173 115 Y 4.6679 8.4265 123.3231 57.6203 39.4565 175.2304 116 I 3.9413 7.9852 126.3757 58.5259 40.8456 175.5687 117 R 3.8977 8.3379 126.2571 59.5363 29.6983 178.0621 118 G 3.7086 8.0039 104.6054 48.0685 0.0000 175.5220 119 R 3.7453 7.8202 120.0983 58.6254 30.2793 178.5255 120 A 4.1133 8.1876 120.8735 55.4449 18.3576 179.4740 121 L 3.9572 8.3974 117.3711 58.3506 41.5751 180.0757 122 R 4.7893 7.5991 117.5517 59.0038 30.2373 178.6556 123 H 4.4288 8.6136 116.3898 59.0488 28.7539 177.8004 124 L 4.2235 7.9152 120.5100 57.9583 41.4424 179.4896 125 E 4.0916 8.3767 118.2157 58.4879 29.0256 178.3170 126 K 4.2471 7.7156 117.1670 55.3463 32.4595 176.0015 127 N 4.2820 8.1041 115.1091 54.6611 36.4680 174.2466 128 R 4.8104 7.9529 114.8461 54.6895 33.0056 175.9442 129 I 4.4143 8.0511 122.2850 60.2752 39.1535 174.8513 130 V 4.4840 8.0389 126.7379 61.0504 33.7419 174.3421 131 V 4.4880 8.5080 128.3095 61.1099 33.4110 174.3973 132 F 5.2206 8.6574 127.6735 57.0201 39.9297 175.5044 133 G 4.1819 8.8632 108.7867 44.7791 0.0000 172.4260 134 A 4.0807 8.9695 120.0748 52.3130 17.3938 180.4444 135 G 3.8915 8.1641 112.3428 49.1925 0.0000 175.0481 136 I 4.1841 8.4748 116.4338 59.8288 37.8232 176.7775 137 G 3.9812 8.5272 107.5527 46.1982 0.0000 173.8632 138 S 4.8193 7.4999 112.9446 55.3981 64.9350 171.9558 139 P 4.3290 0.0000 0.0000 63.1065 32.1501 176.6433 140 Y 3.5429 8.3745 114.1326 58.3298 36.4364 169.8994 141 F 4.6958 7.6248 117.5841 55.9631 41.4407 175.6533 142 S 4.7746 8.2333 117.5353 57.3045 66.4495 175.1879 143 T 4.0093 8.2521 117.3604 66.4001 68.0550 176.8931 144 D 4.3503 8.0347 120.9065 57.6499 40.9524 178.5087 145 T 3.9600 7.6327 115.0141 66.8684 68.4680 176.8337 146 T 3.6995 7.7418 116.8911 66.5515 68.4919 176.5993 147 A 4.0472 8.1133 122.4476 54.9610 18.4060 179.5930 148 A 3.8560 8.4212 119.6212 55.1555 18.5244 179.4664 149 L 3.7986 8.1223 119.2101 58.5298 42.1693 179.4711 150 R 3.6784 7.9095 117.6592 59.0452 29.8154 178.9248 151 A 4.0130 8.1507 120.4522 55.1281 17.9301 179.5965 152 A 3.9842 8.1033 119.3096 55.1711 18.1899 179.8174 153 E 4.0029 7.9149 116.8069 59.1361 29.7222 178.6212 154 I 4.1689 7.7498 109.8270 59.8083 39.4176 175.4146 155 E 3.6853 7.4457 118.5582 57.5530 26.9403 174.0273 156 A 4.6105 8.3569 121.4513 51.3180 20.8618 177.8420 157 D 4.7337 9.4167 121.0690 57.0518 42.3131 176.3265 158 A 4.8298 7.5638 117.5792 50.5355 23.3471 175.2962 159 I 4.3880 8.5465 120.2017 59.9166 39.7040 175.5032 160 L 4.8217 8.0418 130.6720 53.9571 44.9737 175.9930 *162 A 3.3672 8.4953 120.7127 52.2924 18.8893 176.9338 163 K 3.9872 8.0441 120.1108 56.8546 33.4160 178.3404 164 N 4.5585 9.4317 123.0068 50.3183 36.7623 172.9286 165 G 4.0468 7.0638 114.7071 45.3018 0.0000 171.5357 166 V 3.6624 7.2590 120.1266 62.7078 32.2178 176.3837 167 D 5.1522 9.8179 123.9455 51.6198 39.7872 176.3590 168 G 3.9239 7.1643 106.5438 46.0958 0.0000 171.1684 169 V 4.4832 7.9533 119.5056 61.3333 32.7367 175.2114 170 Y 4.8742 8.6581 124.1644 56.0956 40.4221 175.9064 171 N 4.6975 8.4817 117.5550 53.7281 37.8463 174.7243 172 A 4.3354 7.1441 119.6123 51.2663 22.6003 175.6934 173 D 4.3132 8.4052 119.4641 53.6836 40.6028 175.3175 174 P 4.1853 0.0000 0.0000 64.8750 31.0483 177.2494 175 K 4.3100 7.6606 116.9173 56.5939 32.6584 177.0073 176 K 4.3099 7.6927 116.2700 57.4064 34.6477 175.9755 177 D 4.5660 8.6520 119.4495 52.8060 41.7359 176.7724 178 A 4.0173 8.7793 129.9892 54.8456 18.5790 177.4685 179 N 4.8715 8.8454 112.5788 52.9652 39.1993 174.9077 180 A 4.5217 7.6453 121.5863 51.7000 19.1685 178.3027 181 V 4.5207 9.4197 123.5068 59.7285 34.0457 175.3467 182 K 3.8502 8.0552 123.2418 55.6975 33.8095 176.3179 183 F 4.4550 8.4933 122.3810 57.4480 39.9903 175.5531 184 D 4.6735 8.8555 124.9170 56.5504 42.2373 176.3862 185 E 5.1472 8.0862 116.0715 54.7220 33.0729 175.0676 186 L 5.1190 9.1713 123.8285 53.1276 46.5690 175.4023 187 T 5.5235 7.9483 108.9660 59.7775 70.9517 175.0584 188 H 4.1358 9.0740 121.1810 59.4106 28.6539 178.1124 189 G 3.6054 8.0252 106.4769 47.8629 0.0000 175.0532 190 E 3.8758 7.9223 122.0878 59.0511 29.6040 179.1204 191 V 3.7297 8.0224 118.3756 65.8441 31.4798 178.1709 192 I 3.8185 7.3220 118.4663 64.0103 36.8376 177.9416 193 K 4.3634 7.9919 115.6102 57.5135 31.7204 177.5289 194 R 4.5383 7.0983 116.2809 54.5564 32.6562 175.0592 195 G 4.0911 8.2612 106.6416 46.3115 0.0000 176.1537 196 L 3.8360 7.8688 120.4810 55.6460 42.3921 178.0700 197 K 3.8024 7.1839 113.4533 57.6832 29.4888 175.0757 198 I 3.7737 7.3377 117.2844 63.2580 38.2833 176.7767 *200 D 4.3997 7.7865 118.8783 53.4848 43.1444 175.4226 201 A 4.0145 8.3739 125.5854 55.7019 18.4595 180.4056 202 T 3.8205 8.3959 113.8369 66.7809 68.5153 176.7990 203 A 4.0147 8.0331 122.1669 55.3029 18.1761 179.6273 204 S 4.0651 7.9574 112.6041 62.0054 62.9848 176.7827 205 T 3.9934 7.4317 117.0568 66.6010 68.5590 176.1910 206 L 4.1732 7.7628 120.6745 58.0257 41.6945 180.0670 207 S 4.0132 7.9817 110.6231 60.0794 62.2096 175.6848 *209 D 4.5438 7.9156 123.0438 54.3249 42.3574 176.1033 210 N 4.6593 8.2166 113.4923 52.1741 38.8790 174.6197 211 D 4.3063 7.8175 115.8012 55.4981 39.4988 173.6879 212 I 4.4849 8.0739 118.8254 59.5400 38.9720 177.4550 213 D 4.8341 8.8139 127.4713 54.4550 42.3206 175.3453 214 L 5.1101 9.1626 121.1881 52.9558 45.0345 175.6635 215 V 4.8234 8.6407 123.5318 61.1572 34.0288 174.6080 216 V 4.5288 8.8404 128.9333 61.2888 33.3925 174.5464 217 F 5.2557 8.0602 121.2826 55.9369 41.5072 172.7450 218 N 5.2297 8.7055 118.1630 51.9756 40.7839 175.0114 *220 N 4.5214 8.6156 116.6469 52.3947 40.6748 174.2546 221 E 4.3169 7.6683 120.5615 54.3024 30.5887 175.2369 222 A 4.1704 8.7456 129.1548 53.8975 18.4520 177.1700 223 G 3.9655 9.0327 109.3954 46.4282 0.0000 175.1339 224 N 4.1506 8.2848 118.8944 56.6453 38.9858 176.5146 225 I 3.2003 7.9674 119.5043 64.2779 37.9270 177.1661 226 Q 3.8428 7.6121 119.6943 59.2811 28.9909 178.5302 227 R 4.1445 7.8830 119.0066 59.2983 30.0989 179.0513 228 V 3.4300 7.5002 117.4111 66.1362 31.3526 178.0859 229 V 3.6486 7.6027 117.7126 65.4684 31.0126 176.9134 230 F 4.8470 7.5764 114.8721 57.2973 39.0939 176.5321 231 G 3.8138 8.0995 108.7399 45.0534 0.0000 173.2207 232 E 3.7899 7.6009 118.1794 56.7699 29.0338 176.1383 233 H 4.1316 8.7130 122.1247 56.4457 28.1700 174.5747 234 I 4.4453 8.3852 124.1408 61.1029 40.9575 176.2183 235 G 4.3801 7.6685 105.2809 46.8347 0.0000 175.2925 236 T 5.0389 9.4692 123.2439 61.8506 71.6373 172.1069 237 T 4.9724 8.9438 123.6553 61.8478 71.1424 173.5649 238 V 4.8507 8.9788 127.7136 61.2831 34.0079 174.7092 239 S 4.5972 8.6455 121.2523 57.0043 66.8021 174.6020 240 N 4.5827 8.2879 117.2546 52.5102 37.3599 175.5656 241 K 4.1873 7.7748 122.9262 56.8798 33.0229 175.1781 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 4 E 8.43 4.42 0.00 2.12 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 2.19 2.25 0.00 5 P 0.00 4.40 0.00 2.43 1.94 0.00 3.82 0.00 0.00 4.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.04 0.00 6 K 9.61 3.90 0.00 1.51 1.67 0.00 1.49 0.00 0.00 1.34 0.00 0.00 2.54 0.00 0.00 2.73 0.00 0.00 0.00 0.00 0.30 0.97 7.81 7 Y 7.00 4.89 0.00 2.94 2.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8 Q 9.38 4.44 0.00 2.21 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.71 0.00 0.00 0.00 0.00 0.00 2.34 2.36 0.00 9 R 8.11 5.11 0.00 1.87 1.77 0.00 3.39 0.00 0.00 3.52 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.66 0.00 10 I 8.71 4.97 1.77 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 1.06 0.49 0.75 0.00 0.00 11 L 8.36 5.02 0.00 1.78 1.55 1.07 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 12 I 8.91 4.47 1.89 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.78 0.95 0.00 0.00 13 K 8.71 5.01 0.00 1.77 1.69 0.00 1.74 0.00 0.00 1.69 0.00 0.00 2.93 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.36 1.40 7.81 14 L 8.88 4.96 0.00 1.59 1.50 0.92 0.88 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 15 S 8.49 4.75 0.00 3.88 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 16 G 8.07 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 0.00 0.00 0.00 17 E 7.69 3.96 0.00 1.99 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 2.33 2.49 0.00 18 A 7.68 4.12 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 19 L 8.16 4.54 0.00 1.72 1.68 0.93 0.56 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 20 A 7.73 4.55 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 G 7.88 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 E 8.40 3.62 0.00 1.96 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.33 0.00 23 K 7.27 3.69 0.00 1.74 1.81 0.00 1.75 0.00 0.00 1.71 0.00 0.00 3.05 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.46 1.44 7.81 24 G 7.01 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 25 V 7.15 4.50 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 0.76 0.00 0.00 0.94 0.00 0.00 26 G 9.28 3.87 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 0.00 0.00 0.00 27 I 8.13 4.64 1.88 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 1.42 0.74 0.92 0.00 0.00 28 D 8.76 4.69 0.00 2.87 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 29 I 8.52 3.70 1.87 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 1.69 0.55 0.89 0.00 0.00 30 P 0.00 4.42 0.00 2.27 2.34 0.00 3.58 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.47 2.08 0.00 31 T 8.20 3.92 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 1.24 0.00 0.00 32 V 7.64 3.61 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 1.16 0.00 0.00 1.00 0.00 0.00 33 Q 8.57 4.15 0.00 2.21 2.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.58 0.00 0.00 0.00 0.00 0.00 2.40 2.66 0.00 34 A 7.77 4.03 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 I 7.70 3.78 1.98 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 1.46 1.13 0.91 0.00 0.00 36 A 8.41 4.00 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 37 K 8.20 2.61 0.00 1.05 1.67 0.00 1.65 0.00 0.00 1.50 0.00 0.00 2.86 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.15 0.84 7.81 38 E 7.58 3.88 0.00 2.08 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 2.31 2.34 0.00 39 I 7.81 3.70 1.84 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 1.46 0.61 0.90 0.00 0.00 40 A 8.03 4.02 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 41 E 7.91 4.02 0.00 2.05 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.34 0.00 42 V 7.77 3.63 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 0.89 0.00 0.00 0.99 0.00 0.00 43 H 8.73 4.09 0.00 3.29 3.52 0.00 5.64 0.00 0.00 0.00 0.00 6.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 V 7.45 3.72 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.00 0.00 1.07 0.00 0.00 45 S 8.02 4.40 0.00 4.27 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 46 G 7.73 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 V 7.06 3.87 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 0.79 0.00 0.00 0.87 0.00 0.00 48 Q 8.90 4.32 0.00 2.25 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.43 6.52 0.00 0.00 0.00 0.00 0.00 2.59 2.36 0.00 49 I 8.42 5.22 1.88 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 1.28 1.57 0.91 0.00 0.00 50 A 8.69 4.90 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 51 L 8.81 5.28 0.00 1.52 1.54 0.90 0.70 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 52 V 8.69 4.68 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 1.09 0.00 0.00 1.08 0.00 0.00 53 I 8.55 4.92 1.89 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.77 0.92 0.00 0.00 54 G 8.75 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 0.00 0.00 0.00 55 G 8.34 4.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 G 8.58 4.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 N 8.25 4.46 0.00 3.05 3.22 0.00 0.00 6.07 6.67 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 58 L 7.06 4.64 0.00 1.77 1.81 1.05 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 59 W 8.37 4.83 0.00 3.36 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 60 R 7.51 4.59 0.00 1.59 1.57 0.00 3.09 0.00 0.00 3.27 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.47 0.00 61 G 8.46 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 62 E 8.20 3.81 0.00 2.00 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 2.33 2.39 0.00 63 P 0.00 4.19 0.00 2.12 2.15 0.00 3.43 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.78 0.00 64 A 6.78 3.83 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 65 A 8.28 4.08 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 66 D 7.97 4.28 0.00 2.77 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 67 A 8.07 4.39 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 68 G 7.59 3.47 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 *70 D 8.20 4.34 0.00 2.77 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 71 R 8.55 3.80 0.00 1.91 1.85 0.00 3.13 0.00 0.00 3.16 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.16 0.00 72 V 7.68 3.17 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 0.89 0.00 0.00 0.91 0.00 0.00 73 Q 8.55 4.10 0.00 2.25 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.58 0.00 0.00 0.00 0.00 0.00 2.43 2.56 0.00 74 A 8.46 4.13 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 0.00 0.00 0.00 0.00 0.00 75 D 7.94 4.33 0.00 2.45 2.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 Y 7.49 4.46 0.00 3.06 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 77 T 7.89 3.86 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 -0.04 0.00 0.00 78 G 7.41 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 0.00 0.00 0.00 *80 L 8.04 4.26 0.00 1.87 1.71 0.83 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 81 G 7.57 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 T 7.91 4.04 4.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 83 V 7.59 3.65 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 1.05 0.00 0.00 0.95 0.00 0.00 *85 N 8.35 4.61 0.00 2.99 2.90 0.00 0.00 6.88 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 86 A 7.97 3.87 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 87 L 8.31 4.12 0.00 1.71 1.73 0.92 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 88 V 7.33 3.54 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 0.93 0.00 0.00 0.93 0.00 0.00 *90 A 8.14 4.25 1.38 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 0.00 0.00 0.00 91 D 8.07 4.60 0.00 2.74 2.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 92 S 7.87 4.09 0.00 3.94 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 93 L 7.91 4.32 0.00 1.90 1.74 0.90 0.96 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 94 Q 7.98 4.45 0.00 2.30 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.77 0.00 0.00 0.00 0.00 0.00 2.53 2.60 0.00 95 H 7.90 4.07 0.00 3.10 2.70 0.00 5.81 0.00 0.00 0.00 0.00 7.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 96 Y 7.64 4.57 0.00 3.00 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 97 G 7.96 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 98 V 7.63 4.17 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 0.82 0.00 0.00 1.02 0.00 0.00 99 D 8.63 4.85 0.00 2.85 2.55 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 0.00 100 T 8.40 5.14 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 1.24 0.00 0.00 101 R 8.70 4.57 0.00 1.48 1.66 0.00 3.19 0.00 0.00 3.01 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 1.10 0.00 102 V 8.43 4.66 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 0.81 0.00 0.00 0.91 0.00 0.00 103 Q 9.37 5.65 0.00 2.34 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.56 0.00 0.00 0.00 0.00 0.00 2.35 2.16 0.00 104 T 8.56 5.06 4.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 105 A 9.04 4.15 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 I 7.63 4.20 1.87 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 1.46 0.71 0.85 0.00 0.00 107 P 0.00 4.29 0.00 2.18 2.11 0.00 3.80 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.97 0.00 *109 Q 8.13 4.27 0.00 2.04 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.66 7.11 0.00 0.00 0.00 0.00 0.00 2.24 2.42 0.00 110 N 8.05 4.42 0.00 2.72 2.82 0.00 0.00 6.89 7.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 V 7.82 3.70 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 0.83 0.00 0.00 0.92 0.00 0.00 112 A 7.37 4.66 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 E 8.81 4.13 0.00 2.09 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 0.00 2.43 2.35 0.00 114 P 0.00 4.80 0.00 2.14 2.06 0.00 3.84 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.97 0.00 115 Y 8.43 4.67 0.00 3.13 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 0.00 116 I 7.99 3.94 1.72 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.69 0.78 0.00 0.00 117 R 8.34 3.90 0.00 1.84 1.85 0.00 3.25 0.00 0.00 3.35 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.78 0.00 118 G 8.00 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 0.00 119 R 7.82 3.75 0.00 1.92 1.93 0.00 3.21 0.00 0.00 3.29 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.58 0.00 120 A 8.19 4.11 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 0.00 0.00 121 L 8.40 3.96 0.00 1.83 1.76 0.94 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 122 R 7.60 4.79 0.00 1.88 1.98 0.00 3.11 0.00 0.00 3.06 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.70 0.00 123 H 8.61 4.43 0.00 3.44 3.31 0.00 5.64 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 124 L 7.92 4.22 0.00 1.92 1.76 1.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 125 E 8.38 4.09 0.00 2.20 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 2.35 2.67 0.00 126 K 7.72 4.25 0.00 1.94 1.84 0.00 1.89 0.00 0.00 1.73 0.00 0.00 3.03 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.44 1.74 7.81 127 N 8.10 4.28 0.00 2.91 2.94 0.00 0.00 6.77 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 0.00 128 R 7.95 4.81 0.00 1.76 1.89 0.00 3.20 0.00 0.00 3.17 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.81 0.00 129 I 8.05 4.41 1.78 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.47 0.88 0.00 0.00 130 V 8.04 4.48 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 0.38 0.00 0.00 0.87 0.00 0.00 131 V 8.51 4.49 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 0.98 0.00 0.00 0.85 0.00 0.00 132 F 8.66 5.22 0.00 2.95 2.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 133 G 8.86 4.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 134 A 8.97 4.08 1.45 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 0.00 0.00 0.00 0.00 0.00 0.00 135 G 8.16 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 0.00 136 I 8.47 4.18 1.68 0.00 0.00 0.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.92 0.70 0.00 0.00 137 G 8.53 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 0.00 138 S 7.50 4.82 0.00 3.98 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 139 P 0.00 4.33 0.00 1.75 1.58 0.00 3.97 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 1.85 0.00 140 Y 8.37 3.54 0.00 2.87 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 0.00 141 F 7.62 4.70 0.00 3.07 2.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 142 S 8.23 4.77 0.00 4.07 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 0.00 143 T 8.25 4.01 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 1.22 0.00 0.00 144 D 8.03 4.35 0.00 2.74 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 0.00 145 T 7.63 3.96 4.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 146 T 7.74 3.70 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 1.11 0.00 0.00 147 A 8.11 4.05 1.38 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 0.00 0.00 0.00 148 A 8.42 3.86 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 0.00 149 L 8.12 3.80 0.00 1.66 1.56 0.82 0.71 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 0.00 150 R 7.91 3.68 0.00 1.68 1.41 0.00 2.21 0.00 0.00 2.25 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 1.10 0.00 151 A 8.15 4.01 1.38 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 0.00 0.00 0.00 152 A 8.10 3.98 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 153 E 7.91 4.00 0.00 2.12 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.36 2.49 0.00 154 I 7.75 4.17 2.00 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 1.88 0.62 1.21 0.00 0.00 155 E 7.45 3.69 0.00 2.16 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 2.27 2.42 0.00 156 A 8.36 4.61 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 157 D 9.42 4.73 0.00 2.80 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 0.00 158 A 7.56 4.83 0.15 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 0.00 159 I 8.55 4.39 1.85 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 1.21 0.93 0.95 0.00 0.00 160 L 8.04 4.82 0.00 1.74 2.23 0.85 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 *162 A 8.50 3.37 1.11 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 0.00 163 K 8.04 3.99 0.00 1.78 1.73 0.00 1.47 0.00 0.00 1.53 0.00 0.00 2.95 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.43 1.36 7.81 164 N 9.43 4.56 0.00 2.64 2.72 0.00 0.00 7.01 7.98 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 0.00 165 G 7.06 4.05 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 0.00 0.00 0.00 166 V 7.26 3.66 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 1.10 0.00 0.00 0.93 0.00 0.00 167 D 9.82 5.15 0.00 2.90 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 0.00 168 G 7.16 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 0.00 169 V 7.95 4.48 2.27 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 1.22 0.00 0.00 1.01 0.00 0.00 170 Y 8.66 4.87 0.00 3.12 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 0.00 171 N 8.48 4.70 0.00 2.88 2.48 0.00 0.00 6.73 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 0.00 172 A 7.14 4.34 1.17 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 0.00 173 D 8.41 4.31 0.00 2.75 2.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 174 P 0.00 4.19 0.00 1.70 1.01 0.00 3.59 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 1.63 1.04 0.00 175 K 7.66 4.31 0.00 1.77 1.83 0.00 1.58 0.00 0.00 1.66 0.00 0.00 2.95 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.35 1.29 7.81 176 K 7.69 4.31 0.00 1.66 1.77 0.00 1.79 0.00 0.00 1.62 0.00 0.00 2.95 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.30 1.47 7.81 177 D 8.65 4.57 0.00 2.61 2.52 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 0.00 178 A 8.78 4.02 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 0.00 179 N 8.85 4.87 0.00 2.65 2.82 0.00 0.00 7.02 7.99 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 0.00 180 A 7.65 4.52 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 0.00 181 V 9.42 4.52 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 0.62 0.00 0.00 0.75 0.00 0.00 182 K 8.06 3.85 0.00 0.79 0.74 0.00 1.46 0.00 0.00 1.49 0.00 0.00 2.62 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.05 1.17 7.81 183 F 8.49 4.46 0.00 2.98 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 0.00 184 D 8.86 4.67 0.00 2.62 2.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 185 E 8.09 5.15 0.00 1.81 1.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.25 2.38 0.00 186 L 9.17 5.12 0.00 1.42 1.35 0.42 0.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 187 T 7.95 5.52 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 1.28 0.00 0.00 188 H 9.07 4.14 0.00 3.19 3.40 0.00 5.62 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 189 G 8.03 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 190 E 7.92 3.88 0.00 1.96 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 2.18 2.27 0.00 191 V 8.02 3.73 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 0.92 0.00 0.00 0.91 0.00 0.00 192 I 7.32 3.82 2.00 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 1.52 0.70 0.91 0.00 0.00 193 K 7.99 4.36 0.00 1.82 1.84 0.00 1.64 0.00 0.00 1.70 0.00 0.00 3.02 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.47 1.63 7.81 194 R 7.10 4.54 0.00 1.85 1.87 0.00 3.18 0.00 0.00 2.96 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.72 0.00 195 G 8.26 4.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 196 L 7.87 3.84 0.00 1.64 1.74 0.53 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 197 K 7.18 3.80 0.00 1.92 1.81 0.00 1.71 0.00 0.00 1.71 0.00 0.00 2.97 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.40 1.56 7.81 198 I 7.34 3.77 1.88 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 1.32 0.46 0.93 0.00 0.00 *200 D 7.79 4.40 0.00 2.87 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 0.00 201 A 8.37 4.01 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 0.00 202 T 8.40 3.82 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 1.32 0.00 0.00 203 A 8.03 4.01 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 0.00 204 S 7.96 4.07 0.00 4.04 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 0.00 205 T 7.43 3.99 4.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 206 L 7.76 4.17 0.00 1.89 1.70 0.88 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 207 S 7.98 4.01 0.00 3.94 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 *209 D 7.92 4.54 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 0.00 210 N 8.22 4.66 0.00 2.80 2.82 0.00 0.00 7.12 7.34 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 0.00 211 D 7.82 4.31 0.00 2.74 2.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 212 I 8.07 4.48 1.87 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 1.23 0.90 0.89 0.00 0.00 213 D 8.81 4.83 0.00 2.74 2.62 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 0.00 214 L 9.16 5.11 0.00 1.55 1.54 1.01 0.83 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 0.00 215 V 8.64 4.82 2.19 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 0.85 0.00 0.00 0.93 0.00 0.00 216 V 8.84 4.53 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 0.96 0.00 0.00 0.97 0.00 0.00 217 F 8.06 5.26 0.00 3.22 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 0.00 218 N 8.71 5.23 0.00 3.06 2.83 0.00 0.00 7.66 6.71 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 *220 N 8.62 4.52 0.00 2.90 2.91 0.00 0.00 6.78 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 0.00 221 E 7.67 4.32 0.00 1.97 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 2.33 0.00 222 A 8.75 4.17 1.27 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 0.00 223 G 9.03 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 0.00 0.00 0.00 224 N 8.28 4.15 0.00 3.18 2.99 0.00 0.00 6.80 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 0.00 225 I 7.97 3.20 2.10 0.00 0.00 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 1.47 1.18 1.00 0.00 0.00 226 Q 7.61 3.84 0.00 2.08 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.57 0.00 0.00 0.00 0.00 0.00 2.73 2.50 0.00 227 R 7.88 4.14 0.00 2.11 1.97 0.00 3.21 0.00 0.00 3.12 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 1.81 0.00 228 V 7.50 3.43 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 0.80 0.00 0.00 0.02 0.00 0.00 229 V 7.60 3.65 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 0.67 0.00 0.00 0.85 0.00 0.00 230 F 7.58 4.85 0.00 3.11 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 0.00 231 G 8.10 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 0.00 0.00 0.00 232 E 7.60 3.79 0.00 2.10 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 2.37 2.37 0.00 233 H 8.71 4.13 0.00 3.15 3.34 0.00 5.64 0.00 0.00 0.00 0.00 6.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 234 I 8.39 4.45 1.88 0.00 0.00 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 1.54 0.85 0.89 0.00 0.00 235 G 7.67 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 0.00 0.00 0.00 0.00 236 T 9.47 5.04 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 1.32 0.00 0.00 237 T 8.94 4.97 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 1.30 0.00 0.00 238 V 8.98 4.85 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 0.70 0.00 0.00 0.90 0.00 0.00 239 S 8.65 4.60 0.00 4.11 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 240 N 8.29 4.58 0.00 2.89 2.88 0.00 0.00 6.87 7.61 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 0.00 241 K 7.77 4.19 0.00 1.90 1.84 0.00 1.83 0.00 0.00 1.75 0.00 0.00 3.02 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.30 1.37 7.81 * Residues marked with a * may have inaccurate shift predictions.