NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 E 4.1815 8.4401 121.4633 55.7988 30.8290 175.2103 3 A 3.9133 8.2265 128.4805 49.1865 19.3680 174.9153 4 P 4.6627 0.0000 0.0000 62.6425 34.1415 173.1731 5 A 5.2854 9.5479 121.4574 50.1446 22.4377 175.0577 6 A 5.2134 9.3193 122.2727 50.1542 23.1105 175.0229 7 V 4.5737 8.7763 121.2344 61.2275 33.9204 174.7065 8 V 4.9015 8.5243 127.9042 61.2564 33.7669 174.6134 9 T 4.5751 8.7480 118.5981 61.1655 70.7665 174.8315 10 G 4.5308 8.9291 109.5779 47.0333 0.0000 173.6844 11 A 4.3999 8.2833 119.1861 51.5704 19.4075 179.8522 12 A 4.0623 7.9644 121.5354 54.8674 18.8715 177.6142 13 K 4.6155 7.6135 113.3326 55.9542 36.8507 177.3190 14 R 3.4456 8.3253 118.1897 57.2889 29.1667 179.3116 15 I 3.7927 8.4935 123.2929 65.4179 36.9494 177.8216 16 G 3.6427 8.0857 106.1225 47.8379 0.0000 175.4719 17 R 4.2378 8.4030 122.1781 58.6638 30.1010 178.4771 18 A 4.0503 7.9424 120.6197 55.0763 18.2520 179.7387 19 I 3.5547 8.0921 118.3225 64.5003 37.2132 178.3176 20 A 3.9532 8.0273 121.5768 55.3173 18.0826 179.8255 21 V 3.5259 8.2348 116.9655 66.0648 31.5963 178.2459 22 K 3.9684 8.0847 119.3953 59.3008 31.9798 178.6638 23 L 3.9410 8.1037 119.5875 58.0681 41.4595 178.9015 24 H 4.4825 8.2949 119.3124 59.0714 29.6294 177.4032 25 Q 4.0524 8.2471 118.3602 59.0696 28.5757 178.4918 26 T 4.1688 7.8910 115.6545 64.2727 68.6342 175.2142 27 G 3.9969 7.9881 107.9290 45.0358 0.0000 173.6923 28 Y 4.2592 8.4442 118.7230 57.7682 39.3387 175.3333 29 R 4.2405 8.6605 122.5324 55.8108 31.8091 175.9434 30 V 4.9616 8.4937 115.6086 59.6010 35.7329 174.7728 31 V 4.6279 9.0207 125.5331 61.9230 33.1186 175.0358 32 I 4.5104 9.2779 131.1355 60.3520 37.2477 174.5073 33 H 5.1566 9.1030 128.0742 56.2743 31.3738 173.4178 34 Y 4.7402 8.2038 121.5924 56.6973 41.4995 172.5553 35 H 4.7003 9.1742 115.4055 56.4159 32.9129 173.8497 36 N 4.6487 7.9329 119.0556 54.7903 40.4524 177.0070 37 S 4.4995 7.9618 116.6839 57.2549 59.5979 174.4833 38 A 2.9009 7.5025 127.6657 54.8613 18.8412 179.0378 39 E 3.7682 7.9447 117.1440 59.3193 29.8287 178.7318 40 A 3.9128 7.7933 120.1922 54.8178 18.5377 179.3116 41 A 3.8129 7.7282 119.3575 55.3507 18.3362 180.1275 42 V 3.5024 7.5427 116.8063 65.8192 31.5492 178.0110 43 S 4.0228 8.1226 113.1532 61.3063 62.1997 175.9202 44 L 3.8526 7.9525 122.4952 58.2100 41.7852 178.6818 45 A 4.0054 8.0127 120.5671 55.2979 18.3765 179.1628 46 D 4.3131 8.3347 117.5010 57.7419 41.0831 179.0273 47 E 3.9750 8.1083 118.8287 59.4377 29.3824 179.5138 48 L 3.9824 7.9356 119.0127 57.7356 41.3552 179.2687 49 N 5.1817 8.7463 118.3807 55.5474 38.2700 177.3150 50 K 4.1280 7.8464 118.6506 58.8203 32.8600 178.7479 51 E 4.1889 7.4582 119.4260 57.6547 30.1631 176.7451 52 R 4.6171 7.9957 117.9449 53.8547 33.6496 174.9717 53 S 4.5320 8.5968 117.0472 59.1962 63.4189 173.9948 54 N 4.4305 8.8708 119.1052 55.0989 35.7388 174.7131 55 T 4.6217 7.7422 103.6357 61.4365 70.6820 173.3311 56 A 5.4245 8.8963 124.0229 50.6377 22.1259 175.9005 57 V 4.6327 9.0005 114.2913 59.6892 36.0690 175.3203 58 V 4.9495 8.3749 115.3768 60.6036 33.9967 175.5388 59 C 4.5804 8.9656 123.3010 58.2810 34.6441 172.4815 60 Q 4.0923 8.5536 127.9196 55.1497 29.6979 174.6357 61 A 4.5611 8.0928 125.7469 50.9395 22.7823 175.4483 62 D 4.2023 8.7737 121.8791 54.1266 41.8893 175.9305 63 L 4.5891 8.2197 124.7841 54.6381 42.2048 176.5174 64 T 4.1222 7.8205 116.2514 63.7426 68.9826 173.7329 65 N 4.5469 8.6841 125.2066 54.2783 39.6467 173.9697 66 S 4.6152 8.2759 118.6790 57.7832 65.9573 175.2599 67 N 4.4247 9.0121 116.9866 55.5502 38.4709 176.5907 68 V 4.0638 7.5415 116.7923 61.9003 32.7592 177.6156 69 L 3.9058 7.8085 123.5274 58.1875 41.7527 176.8787 70 P 4.2296 0.0000 0.0000 65.5942 31.2147 178.3715 71 A 3.9732 7.9304 118.8521 55.3038 18.3993 179.5282 72 S 4.0674 8.1696 113.6892 62.1580 62.9224 176.9502 73 C 4.1517 8.2525 119.2731 62.5967 27.8379 175.5564 74 E 4.1728 8.1491 122.3511 58.8018 29.1283 178.6472 75 E 3.9585 8.4325 119.2619 59.1507 29.4382 178.7197 76 I 3.7256 7.5766 119.2597 64.4741 37.5513 178.1848 77 I 4.0151 7.7003 120.0732 64.5606 36.9221 178.0822 78 N 4.4693 8.4428 117.6732 56.5735 38.3829 177.5713 79 S 4.1403 8.4352 115.5546 61.2287 62.9545 176.2761 80 C 4.1151 8.0242 122.4232 62.5061 31.3663 175.5065 81 F 4.0987 8.2455 118.9464 60.4364 38.2866 177.5111 82 R 3.8699 8.2764 117.7612 59.3226 29.9863 178.2099 83 A 3.8453 7.6520 119.3108 54.2244 18.4976 178.1190 84 F 4.9144 8.1098 112.3634 56.6403 40.8963 176.5541 85 G 4.0561 9.7643 108.9960 45.0531 0.0000 173.0184 86 R 4.0264 7.0726 113.1613 55.6650 31.4803 174.3134 87 C 4.2752 7.6214 118.8287 58.5503 32.8472 172.6098 88 D 4.8486 9.3785 128.9780 55.7199 42.3235 177.1739 89 V 5.4680 7.8321 116.7512 59.7853 35.4496 173.9848 90 L 5.0108 8.0641 128.0834 53.1247 45.3352 174.7472 91 V 4.5133 8.7637 126.5717 61.3441 33.5420 174.3398 92 N 4.6528 9.2084 127.5096 52.5733 37.7262 174.5934 93 N 4.7239 9.0533 122.2964 54.4475 41.1508 175.2647 94 A 4.0956 7.2970 120.2496 52.8380 18.9458 176.8550 95 S 4.4413 8.2509 113.0456 57.4147 65.3417 174.4538 96 A 4.4273 8.8101 131.8204 51.7887 19.0816 176.9120 97 F 4.6454 8.5544 124.0832 57.5932 41.1796 172.9038 98 Y 4.3945 7.2664 124.5451 55.0027 40.1289 172.1229 99 P 3.4271 0.0000 0.0000 62.7053 32.0439 176.8026 100 T 4.5177 8.0729 110.3532 58.4349 68.4812 171.0561 101 P 4.2776 0.0000 0.0000 63.7441 32.2441 176.9594 102 L 4.1254 8.5223 122.0034 57.0461 42.3832 177.6516 103 V 4.2602 7.3571 116.0938 61.0012 31.2785 173.3655 *113 G 3.7660 7.4693 108.8424 45.1019 0.0000 170.6478 114 K 4.1817 8.2722 118.2089 55.8779 32.9231 177.9314 115 T 4.1053 8.2518 113.0541 61.6889 70.6395 175.8899 116 V 3.9713 8.5333 123.7891 64.3978 31.4717 178.2714 117 E 3.9502 8.1680 117.8925 59.5513 29.2901 179.2050 118 T 3.8885 8.0803 116.5989 66.4689 68.0033 176.6152 119 Q 4.4535 8.0677 121.2863 58.4188 28.6882 178.8826 120 V 3.5757 8.0704 119.1661 66.0652 31.4908 177.5999 121 A 4.0014 8.0785 120.2718 55.4554 18.2018 179.5718 122 E 3.9519 8.5188 116.9523 59.6403 29.2820 179.6258 123 L 4.0043 8.2523 119.3903 57.8059 41.6084 179.5610 124 I 4.0123 8.1521 120.0290 63.7098 37.2039 178.4944 125 G 3.6772 8.0468 106.4538 48.1700 0.0000 175.7082 126 T 3.9556 7.7421 111.6772 64.2884 69.0268 175.9384 127 N 4.5943 7.7665 116.2137 54.1300 39.0376 175.2519 128 A 4.5231 7.6377 120.6069 53.2714 21.4195 178.1047 129 I 3.7316 8.3017 116.3577 64.3861 37.0918 178.4239 130 A 3.9955 8.4761 121.8929 54.9910 18.2107 177.6316 131 P 4.3163 0.0000 0.0000 65.0224 31.3041 178.5658 132 F 4.1633 8.2601 119.0909 61.3704 39.2912 177.2578 133 L 3.6696 8.3920 119.0236 57.7273 41.4349 179.5491 134 L 3.9820 8.7091 119.6177 57.9151 41.4947 179.8027 135 T 3.8097 7.9932 115.8499 66.7441 68.3281 176.4165 136 M 3.8503 7.7249 120.5743 58.6041 31.8917 179.0181 137 S 4.0477 8.1827 115.1548 61.5395 62.8209 176.3947 138 F 4.1135 8.5365 122.0206 61.4981 39.4382 176.7831 139 A 4.1095 8.2763 120.1627 55.2492 17.9544 179.6303 140 Q 3.8915 8.0113 115.7641 59.1368 28.8625 179.0149 141 R 3.8242 7.7672 117.6462 57.8323 30.2332 176.9455 142 Q 4.2111 7.2160 117.8379 54.7621 29.9475 175.0766 *152 S 4.2734 8.1330 112.4012 58.6427 63.8772 173.6837 153 N 4.8975 8.3359 120.4202 51.6288 38.9044 171.5345 154 L 5.4670 8.2208 121.4142 52.9405 43.7779 175.6831 155 S 5.0719 8.5797 116.6593 57.3269 67.0337 172.6168 156 I 4.5636 8.6808 121.0556 59.3539 40.5447 174.8813 157 V 4.7211 8.5993 126.0338 61.1630 34.5334 173.6503 158 N 5.0925 8.9054 125.7565 51.4729 40.6633 174.1858 159 L 4.2993 8.7071 125.1213 54.9220 41.6863 176.1502 160 C 4.7894 8.7075 127.7017 59.1642 30.4912 173.3443 161 D 4.5898 8.2583 121.6147 54.2303 43.6955 177.3187 162 A 4.1031 9.0859 129.8336 54.7185 18.8974 177.6209 163 M 4.5504 8.6349 115.9080 55.3446 32.0551 178.7043 164 V 3.6509 7.3310 114.3939 64.0247 31.6360 176.8831 165 D 4.8311 7.9961 116.5722 54.4405 41.8830 176.3473 166 Q 4.6442 7.7846 117.4709 53.6430 29.0553 173.0834 167 P 4.6746 0.0000 0.0000 62.1810 32.8172 176.9341 168 C 4.3288 8.4797 117.2779 59.6377 28.5784 173.2724 169 M 4.0126 8.7795 123.6079 57.2864 32.3494 175.6428 170 A 3.8470 9.0241 126.4594 53.1313 16.3513 177.9971 171 F 4.9133 7.8556 116.7309 58.0384 40.0536 178.6107 172 S 4.1966 8.4467 117.7005 61.8896 62.6649 175.3057 173 L 3.9817 7.6849 122.7981 57.2906 41.3125 178.6689 174 Y 4.0883 8.0507 119.0277 60.9369 38.7514 177.6903 175 N 4.1530 8.6356 117.9431 56.8317 39.0152 176.6698 176 M 4.1220 8.6938 120.6840 58.2893 32.0429 178.9230 177 G 3.5342 8.1839 105.9367 47.8490 0.0000 175.9569 178 K 3.8794 7.8700 121.2074 59.1529 31.9622 179.2772 179 H 4.0036 8.3685 116.4970 58.7713 28.6438 177.5020 180 A 3.9734 8.0926 122.5969 55.2378 18.0618 179.4602 181 L 3.9346 7.8033 118.7318 58.0388 42.1328 179.2722 182 V 3.6310 7.7983 118.4626 66.0229 31.4268 178.2238 183 G 3.6215 8.1251 105.3320 47.6693 0.0000 175.3139 184 L 3.9850 8.3767 123.1942 58.1694 42.1436 178.9409 185 T 3.8382 8.1524 116.0088 66.9138 68.4102 176.5073 186 Q 3.9586 8.0894 119.4318 59.1154 28.8436 178.9045 187 S 4.0965 8.4310 116.2800 61.7099 62.8832 176.7897 188 A 4.0278 8.6506 123.5276 54.7769 18.1655 179.4382 189 A 3.9009 8.1028 119.4864 55.2250 18.2460 179.4532 190 L 3.8592 7.5801 117.3010 58.5676 42.2974 178.6093 191 E 4.1699 8.1350 117.4519 58.4250 29.9403 177.6346 192 L 4.4685 8.1788 117.3464 54.9124 42.0937 178.1664 193 A 4.0112 7.8530 121.8067 55.1588 18.0768 177.9589 194 P 4.1755 0.0000 0.0000 65.3987 30.9211 177.4152 195 Y 4.3495 8.3444 114.2122 57.4525 37.7573 176.7500 196 G 3.8764 8.1286 108.3662 45.8056 0.0000 173.2097 197 I 4.6085 7.2295 121.1430 59.9426 38.1704 175.7086 198 R 4.4943 8.6058 126.5985 55.1294 32.3606 175.9483 199 V 4.7131 8.6764 121.8002 61.5222 34.6772 174.0143 200 N 5.4071 9.2168 124.5982 51.6313 43.6713 173.2904 201 G 4.4811 9.0967 105.6458 44.6995 0.0000 171.8723 202 V 4.9190 8.4961 119.9635 60.8074 35.0483 174.3411 203 A 4.7839 8.9138 129.5615 49.2250 20.3472 173.6534 204 P 4.3654 0.0000 0.0000 63.8253 32.5733 176.1214 205 G 3.6131 8.9037 110.3454 45.0354 0.0000 173.9531 206 V 4.1172 7.9362 120.4059 60.6276 34.3003 173.6367 207 S 4.9439 7.7662 122.9110 56.7681 62.2454 175.4939 208 L 3.9472 8.5750 120.8918 54.6781 41.3286 176.9311 209 L 4.1763 8.2376 123.7114 53.4270 42.7168 175.3531 210 P 4.4378 0.0000 0.0000 62.8759 31.8548 178.4077 211 V 3.6746 8.3789 114.5269 64.2789 31.7378 177.8103 212 A 4.1047 7.9415 121.5714 54.5748 18.5330 177.2839 213 M 4.2582 7.6859 116.3646 55.1442 33.0472 176.9060 214 G 3.9361 8.4793 112.2784 43.9366 0.0000 173.9759 215 E 3.9704 8.7980 121.4854 59.3053 29.4739 178.9907 216 E 3.9016 8.1085 118.5466 59.4258 29.7326 178.3434 217 E 4.0332 8.2061 118.7963 59.0017 29.6597 178.6260 218 K 4.1124 8.2221 118.7737 59.7796 32.1056 179.0075 219 D 4.3892 8.4477 119.2508 56.9279 40.4380 178.4416 220 K 3.7169 7.7574 119.4982 59.5387 32.5261 178.4252 221 W 4.2151 7.8724 118.6910 59.8158 29.1593 178.5484 222 R 4.0268 8.4862 118.3857 59.6820 29.3829 179.3411 223 R 4.0699 8.0691 115.9399 58.5108 30.1026 178.5777 224 K 4.3181 7.7704 116.7425 56.7123 32.4796 176.9787 225 V 3.9765 7.4182 120.3109 61.1446 31.5322 174.4681 226 P 4.1625 0.0000 0.0000 65.5540 31.2512 177.2195 227 L 4.1767 7.7159 121.8096 53.8865 40.1993 176.3250 228 G 3.9127 8.2768 111.4539 43.6893 0.0000 170.9321 229 R 4.1133 7.6220 117.2533 56.4301 28.0661 175.8796 230 R 4.6759 7.5871 110.7421 54.7224 32.4178 174.0740 231 E 4.5448 8.4442 116.8409 55.4754 30.8481 176.0770 232 A 4.4335 8.6553 123.5077 51.8996 19.5194 177.6890 233 S 4.1968 9.1746 116.6201 58.0832 64.2160 175.5006 234 A 3.9538 8.6738 122.8584 55.1968 18.0479 179.5620 235 E 3.8824 8.2203 117.4726 59.7587 29.4217 179.0305 236 Q 4.1251 7.8450 116.8916 58.9519 28.8885 178.5194 237 I 3.8315 7.5787 120.7776 64.3260 37.1259 178.3232 238 A 3.9964 8.0500 121.6065 55.1895 18.1667 179.1681 239 D 4.3303 8.4197 117.4767 57.7678 41.0001 179.0922 240 A 4.1712 7.9009 120.9787 54.7295 18.5137 179.8184 241 V 3.5135 7.7533 116.4716 66.3422 31.4464 178.1724 242 I 3.6799 7.6953 118.1944 64.1510 37.3060 177.7384 243 F 4.3980 8.2771 121.5186 61.6411 39.0013 177.3539 244 L 3.6171 7.6057 116.5696 57.4503 41.4473 179.4167 245 V 3.9229 7.6851 112.3902 61.4597 32.1851 176.7397 246 S 4.4430 7.1803 113.5564 57.4013 63.6363 175.3135 247 G 3.7832 8.4260 109.1172 47.6449 0.0000 174.7752 248 S 4.3585 7.9020 114.9571 59.8951 63.2166 174.5329 249 A 4.5954 7.5934 123.1668 51.4506 19.1428 178.0418 250 Q 3.9730 8.2703 119.3155 60.2805 28.4869 176.6523 251 Y 4.4090 7.9324 116.7297 57.1978 39.2248 174.5673 252 I 4.2488 7.7798 121.0558 61.0262 37.8460 175.1132 253 T 4.5752 8.0918 118.9741 61.7990 70.1359 173.1455 254 G 3.8964 9.0255 115.7957 46.4060 0.0000 173.0773 255 S 4.8645 8.2760 115.3874 56.4488 65.5224 173.2752 256 I 4.8209 8.3194 124.0012 59.6730 39.5114 174.8649 257 I 4.3756 8.4777 128.7643 59.4115 38.6880 175.5431 258 K 4.4169 8.6857 127.4108 56.4024 32.7586 177.8017 259 V 4.4884 8.8515 124.5604 60.6892 31.3046 175.0294 260 D 4.7576 7.7741 118.2528 51.3634 41.3166 177.2186 261 G 4.0492 9.2063 107.2135 46.7804 0.0000 175.4254 262 G 3.9697 8.6789 107.2490 44.6250 0.0000 175.7722 263 L 3.9731 8.1596 123.0803 58.1259 42.0482 179.4031 264 S 4.2920 8.2538 111.1632 60.5906 62.8668 174.9183 265 L 4.2234 7.7099 119.7401 55.4199 41.8293 176.6597 266 V 3.9720 7.4543 120.0447 61.6072 32.0500 175.4846 267 H 4.5060 8.4261 122.4943 54.5173 29.5425 175.1086 268 A 4.1654 8.6981 121.8330 52.9636 18.0614 177.6289 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ 2 E 8.44 4.18 0.00 1.93 1.89 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 2.17 2.32 0.00 3 A 8.23 3.91 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 4 P 0.00 4.66 0.00 1.79 1.96 0.00 3.25 0.00 0.00 3.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.68 1.26 0.00 5 A 9.55 5.29 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 6 A 9.32 5.21 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 V 8.78 4.57 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 1.02 0.00 0.00 1.03 0.00 0.00 8 V 8.52 4.90 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 0.94 0.00 0.00 0.89 0.00 0.00 9 T 8.75 4.58 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 1.14 0.00 0.00 10 G 8.93 4.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 A 8.28 4.40 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 12 A 7.96 4.06 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 13 K 7.61 4.62 0.00 1.89 1.89 0.00 1.68 0.00 0.00 1.83 0.00 0.00 2.89 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.41 1.48 7.81 14 R 8.33 3.45 0.00 2.01 1.49 0.00 3.14 0.00 0.00 3.35 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.63 0.00 15 I 8.49 3.79 1.85 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.67 0.95 0.00 0.00 16 G 8.09 3.64 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 17 R 8.40 4.24 0.00 1.97 2.08 0.00 3.14 0.00 0.00 3.26 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.50 0.00 18 A 7.94 4.05 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 I 8.09 3.55 1.98 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.74 0.85 0.00 0.00 20 A 8.03 3.95 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 21 V 8.23 3.53 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 1.09 0.00 0.00 0.93 0.00 0.00 22 K 8.08 3.97 0.00 2.03 1.77 0.00 1.71 0.00 0.00 1.75 0.00 0.00 2.95 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.45 1.49 7.81 23 L 8.10 3.94 0.00 1.80 1.52 0.70 0.57 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 24 H 8.29 4.48 0.00 3.31 3.48 0.00 5.63 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 25 Q 8.25 4.05 0.00 2.08 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.76 0.00 0.00 0.00 0.00 0.00 2.44 2.65 0.00 26 T 7.89 4.17 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 1.33 0.00 0.00 27 G 7.99 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 28 Y 8.44 4.26 0.00 2.99 2.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 R 8.66 4.24 0.00 0.75 0.66 0.00 2.66 0.00 0.00 3.02 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 1.30 0.00 30 V 8.49 4.96 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 0.82 0.00 0.00 0.99 0.00 0.00 31 V 9.02 4.63 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 1.04 0.00 0.00 1.12 0.00 0.00 32 I 9.28 4.51 1.96 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 1.16 0.88 0.97 0.00 0.00 33 H 9.10 5.16 0.00 3.27 3.39 0.00 5.58 0.00 0.00 0.00 0.00 6.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 Y 8.20 4.74 0.00 3.09 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 35 H 9.17 4.70 0.00 3.20 3.24 0.00 5.73 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 N 7.93 4.65 0.00 2.75 2.85 0.00 0.00 6.89 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 S 7.96 4.50 0.00 3.90 3.78 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 38 A 7.50 2.90 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 39 E 7.94 3.77 0.00 1.99 1.89 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 2.33 2.32 0.00 40 A 7.79 3.91 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 41 A 7.73 3.81 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 V 7.54 3.50 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 1.03 0.00 0.00 0.86 0.00 0.00 43 S 8.12 4.02 0.00 4.05 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 L 7.95 3.85 0.00 1.78 1.79 0.90 1.03 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 45 A 8.01 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 46 D 8.33 4.31 0.00 2.92 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 47 E 8.11 3.97 0.00 2.20 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 2.32 2.49 0.00 48 L 7.94 3.98 0.00 1.61 1.31 0.87 0.58 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 49 N 8.75 5.18 0.00 2.82 2.89 0.00 0.00 6.40 8.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 K 7.85 4.13 0.00 1.95 1.94 0.00 1.60 0.00 0.00 1.63 0.00 0.00 2.97 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.61 1.65 7.81 51 E 7.46 4.19 0.00 2.18 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.39 2.45 0.00 52 R 8.00 4.62 0.00 1.88 1.76 0.00 3.15 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 1.54 1.56 0.00 53 S 8.60 4.53 0.00 4.03 4.02 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 54 N 8.87 4.43 0.00 2.97 3.07 0.00 0.00 6.83 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 55 T 7.74 4.62 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 1.23 0.00 0.00 56 A 8.90 5.42 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 57 V 9.00 4.63 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 0.73 0.00 0.00 0.89 0.00 0.00 58 V 8.37 4.95 2.38 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 0.70 0.00 0.00 1.06 0.00 0.00 59 C 8.97 4.58 0.00 3.01 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 60 Q 8.55 4.09 0.00 1.69 1.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.41 0.00 0.00 0.00 0.00 0.00 1.56 2.10 0.00 61 A 8.09 4.56 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 62 D 8.77 4.20 0.00 2.62 2.56 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 0.00 0.00 0.00 0.00 63 L 8.22 4.59 0.00 1.65 1.64 0.80 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 64 T 7.82 4.12 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 65 N 8.68 4.55 0.00 2.72 2.74 0.00 0.00 7.00 7.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 66 S 8.28 4.62 0.00 3.90 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 67 N 9.01 4.42 0.00 2.74 2.93 0.00 0.00 6.80 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 68 V 7.54 4.06 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 0.74 0.00 0.00 0.93 0.00 0.00 69 L 7.81 3.91 0.00 1.73 1.82 0.94 1.11 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 70 P 0.00 4.23 0.00 2.20 2.10 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 2.14 2.21 0.00 71 A 7.93 3.97 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 72 S 8.17 4.07 0.00 4.02 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 73 C 8.25 4.15 0.00 2.96 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 74 E 8.15 4.17 0.00 2.14 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 2.16 0.00 75 E 8.43 3.96 0.00 2.12 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 0.00 2.30 2.40 0.00 76 I 7.58 3.73 2.03 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.81 0.94 0.00 0.00 77 I 7.70 4.02 2.10 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.54 1.17 0.00 0.00 78 N 8.44 4.47 0.00 2.91 2.91 0.00 0.00 6.82 7.10 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 79 S 8.44 4.14 0.00 4.04 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 80 C 8.02 4.12 0.00 3.12 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 81 F 8.25 4.10 0.00 3.33 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 82 R 8.28 3.87 0.00 1.92 2.09 0.00 3.23 0.00 0.00 3.21 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.63 0.00 83 A 7.65 3.85 0.34 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 84 F 8.11 4.91 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 85 G 9.76 4.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 86 R 7.07 4.03 0.00 1.77 1.84 0.00 3.14 0.00 0.00 3.29 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.60 0.00 87 C 7.62 4.28 0.00 2.20 2.30 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 88 D 9.38 4.85 0.00 3.03 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 89 V 7.83 5.47 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 0.77 0.00 0.00 0.94 0.00 0.00 90 L 8.06 5.01 0.00 1.50 0.77 0.88 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 91 V 8.76 4.51 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 0.92 0.00 0.00 0.82 0.00 0.00 92 N 9.21 4.65 0.00 2.80 2.73 0.00 0.00 6.05 6.46 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 93 N 9.05 4.72 0.00 2.66 3.03 0.00 0.00 7.08 8.82 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 94 A 7.30 4.10 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 95 S 8.25 4.44 0.00 3.85 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 96 A 8.81 4.43 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 97 F 8.55 4.65 0.00 2.70 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 98 Y 7.27 4.39 0.00 2.96 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 99 P 0.00 3.43 0.00 1.83 1.18 0.00 3.57 0.00 0.00 3.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.72 0.00 100 T 8.07 4.52 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 0.00 101 P 0.00 4.28 0.00 2.04 2.03 0.00 3.62 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 1.99 2.07 0.00 102 L 8.52 4.13 0.00 1.64 1.73 0.94 0.84 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 0.00 103 V 7.36 4.26 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 0.82 0.00 0.00 0.94 0.00 0.00 *113 G 7.47 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 0.00 0.00 0.00 114 K 8.27 4.18 0.00 1.74 1.74 0.00 1.43 0.00 0.00 1.72 0.00 0.00 2.91 0.00 0.00 2.70 0.00 0.00 0.00 0.00 1.36 1.27 7.81 115 T 8.25 4.11 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 1.21 0.00 0.00 116 V 8.53 3.97 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 0.93 0.00 0.00 0.94 0.00 0.00 117 E 8.17 3.95 0.00 2.19 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 2.35 0.00 118 T 8.08 3.89 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 1.25 0.00 0.00 119 Q 8.07 4.45 0.00 2.34 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.77 0.00 0.00 0.00 0.00 0.00 2.67 2.49 0.00 120 V 8.07 3.58 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 1.09 0.00 0.00 1.00 0.00 0.00 121 A 8.08 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 0.00 122 E 8.52 3.95 0.00 2.19 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 0.00 2.41 2.67 0.00 123 L 8.25 4.00 0.00 1.71 1.67 0.54 0.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.00 0.00 0.00 0.00 0.00 0.00 124 I 8.15 4.01 1.95 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.95 0.88 0.00 0.00 125 G 8.05 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 126 T 7.74 3.96 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 1.32 0.00 0.00 127 N 7.77 4.59 0.00 2.91 2.83 0.00 0.00 6.78 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 0.00 128 A 7.64 4.52 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 0.00 129 I 8.30 3.73 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 1.41 0.77 1.07 0.00 0.00 130 A 8.48 4.00 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 0.00 131 P 0.00 4.32 0.00 2.31 2.13 0.00 4.01 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.02 0.00 132 F 8.26 4.16 0.00 3.11 3.31 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 0.00 133 L 8.39 3.67 0.00 1.83 1.66 0.99 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 134 L 8.71 3.98 0.00 1.80 1.70 0.93 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 135 T 7.99 3.81 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 1.15 0.00 0.00 136 M 7.72 3.85 0.00 1.83 1.98 0.00 0.00 0.00 0.00 0.00 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 2.08 0.00 137 S 8.18 4.05 0.00 3.86 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 0.00 138 F 8.54 4.11 0.00 3.02 3.25 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 0.00 139 A 8.28 4.11 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 0.00 140 Q 8.01 3.89 0.00 1.95 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.94 0.00 0.00 0.00 0.00 0.00 2.52 2.47 0.00 141 R 7.77 3.82 0.00 1.71 1.38 0.00 2.77 0.00 0.00 2.97 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.62 0.00 142 Q 7.22 4.21 0.00 2.15 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 6.42 0.00 0.00 0.00 0.00 0.00 2.20 2.20 0.00 *152 S 8.13 4.27 0.00 4.03 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 0.00 153 N 8.34 4.90 0.00 2.64 2.74 0.00 0.00 7.06 7.78 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 0.00 154 L 8.22 5.47 0.00 1.81 1.90 0.97 1.08 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 0.00 155 S 8.58 5.07 0.00 3.90 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 0.00 156 I 8.68 4.56 1.69 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 0.34 0.16 0.78 0.00 0.00 157 V 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3.27 0.00 0.00 3.25 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.56 0.00 199 V 8.68 4.71 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 1.02 0.00 0.00 0.92 0.00 0.00 200 N 9.22 5.41 0.00 2.57 2.75 0.00 0.00 6.20 7.10 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 0.00 201 G 9.10 4.48 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 0.00 202 V 8.50 4.92 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.00 0.00 0.96 0.00 0.00 203 A 8.91 4.78 1.22 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 0.00 0.00 204 P 0.00 4.37 0.00 1.99 1.91 0.00 3.94 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 1.89 0.00 205 G 8.90 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 0.00 206 V 7.94 4.12 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 1.00 0.00 0.00 0.62 0.00 0.00 207 S 7.77 4.94 0.00 3.78 3.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 208 L 8.58 3.95 0.00 1.64 1.61 0.91 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 209 L 8.24 4.18 0.00 1.63 1.60 0.75 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 210 P 0.00 4.44 0.00 2.24 2.09 0.00 3.60 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 2.26 2.21 0.00 211 V 8.38 3.67 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 0.69 0.00 0.00 0.96 0.00 0.00 212 A 7.94 4.10 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 0.00 213 M 7.69 4.26 0.00 2.16 2.04 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.86 2.58 0.00 214 G 8.48 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 0.00 215 E 8.80 3.97 0.00 2.11 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 2.40 2.47 0.00 216 E 8.11 3.90 0.00 2.09 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 2.38 2.37 0.00 217 E 8.21 4.03 0.00 2.15 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 2.65 2.51 0.00 218 K 8.22 4.11 0.00 2.13 1.91 0.00 1.75 0.00 0.00 1.68 0.00 0.00 2.96 0.00 0.00 3.20 0.00 0.00 0.00 0.00 1.53 1.76 7.81 219 D 8.45 4.39 0.00 2.85 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 0.00 220 K 7.76 3.72 0.00 1.69 1.80 0.00 1.67 0.00 0.00 1.59 0.00 0.00 2.74 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.03 1.31 7.81 221 W 7.87 4.22 0.00 3.59 3.26 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 0.00 222 R 8.49 4.03 0.00 2.05 2.21 0.00 3.35 0.00 0.00 3.20 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.91 0.00 223 R 8.07 4.07 0.00 1.94 1.97 0.00 3.13 0.00 0.00 3.21 7.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.81 0.00 224 K 7.77 4.32 0.00 1.93 1.86 0.00 1.49 0.00 0.00 1.37 0.00 0.00 2.19 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.30 1.47 7.81 225 V 7.42 3.98 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 1.08 0.00 0.00 1.10 0.00 0.00 226 P 0.00 4.16 0.00 2.08 2.11 0.00 3.92 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.08 0.00 227 L 7.72 4.18 0.00 1.66 1.66 0.92 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 228 G 8.28 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 0.00 0.00 0.00 229 R 7.62 4.11 0.00 2.00 2.02 0.00 3.44 0.00 0.00 3.47 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.69 0.00 230 R 7.59 4.68 0.00 1.88 1.96 0.00 3.03 0.00 0.00 3.28 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.62 0.00 231 E 8.44 4.54 0.00 2.13 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 2.26 2.33 0.00 232 A 8.66 4.43 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 0.00 233 S 9.17 4.20 0.00 3.91 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 0.00 234 A 8.67 3.95 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 0.00 235 E 8.22 3.88 0.00 2.04 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 2.38 2.41 0.00 236 Q 7.84 4.13 0.00 2.23 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.73 0.00 0.00 0.00 0.00 0.00 2.39 2.39 0.00 237 I 7.58 3.83 1.98 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.52 0.89 0.00 0.00 238 A 8.05 4.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 239 D 8.42 4.33 0.00 2.93 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 0.00 240 A 7.90 4.17 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 0.00 241 V 7.75 3.51 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 0.99 0.00 0.00 0.96 0.00 0.00 242 I 7.70 3.68 2.04 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.94 0.97 0.00 0.00 243 F 8.28 4.40 0.00 3.14 3.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 244 L 7.61 3.62 0.00 1.76 1.61 1.01 0.88 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 0.00 245 V 7.69 3.92 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 0.64 0.00 0.00 0.85 0.00 0.00 246 S 7.18 4.44 0.00 4.05 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 0.00 247 G 8.43 3.78 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 0.00 0.00 0.00 248 S 7.90 4.36 0.00 4.05 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 0.00 249 A 7.59 4.60 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 250 Q 8.27 3.97 0.00 2.21 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.86 0.00 0.00 0.00 0.00 0.00 2.47 2.44 0.00 251 Y 7.93 4.41 0.00 2.88 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 0.00 252 I 7.78 4.25 1.92 0.00 0.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.76 1.00 0.00 0.00 253 T 8.09 4.58 4.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.00 0.00 254 G 9.03 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 0.00 255 S 8.28 4.86 0.00 3.93 3.79 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 0.00 256 I 8.32 4.82 1.86 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.59 0.89 0.00 0.00 257 I 8.48 4.38 1.91 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.85 0.93 0.00 0.00 258 K 8.69 4.42 0.00 1.63 1.73 0.00 1.86 0.00 0.00 1.63 0.00 0.00 2.91 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.43 1.43 7.81 259 V 8.85 4.49 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 0.00 0.00 0.92 0.00 0.00 260 D 7.77 4.76 0.00 2.79 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 0.00 261 G 9.21 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 0.00 262 G 8.68 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 0.00 263 L 8.16 3.97 0.00 1.84 1.77 1.07 0.82 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 0.00 264 S 8.25 4.29 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 0.00 265 L 7.71 4.22 0.00 1.75 1.76 0.92 0.66 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 0.00 266 V 7.45 3.97 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 0.71 0.00 0.00 1.06 0.00 0.00 267 H 8.43 4.51 0.00 3.26 3.32 0.00 5.81 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 268 A 8.70 4.17 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.