NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 K 4.5681 8.1727 122.0639 56.4168 33.9470 173.9528 3 R 5.1026 8.8981 127.2483 52.7105 33.4445 172.5427 4 I 5.0230 9.1087 119.0618 59.1112 41.9432 173.5360 5 V 4.7636 8.5366 123.8889 61.3326 33.8104 174.3478 6 V 4.6914 8.7613 128.2202 61.0659 33.7724 173.9164 7 K 5.1394 9.6161 130.4922 54.5271 34.5805 174.7953 8 V 4.6686 8.6563 127.4001 59.7929 33.9073 176.0191 9 G 3.8069 8.4027 112.4660 45.3524 0.0000 174.6031 10 S 4.2210 9.1194 114.5982 61.4933 62.6802 175.9012 11 H 4.2787 8.3126 116.2492 59.0726 28.5336 176.8746 12 V 2.9789 7.3723 117.0973 64.6197 31.5789 176.4349 13 I 4.2567 7.6409 110.5905 60.2326 38.0555 174.7023 14 S 4.9715 7.6555 116.3511 57.0751 65.5801 173.4059 15 E 4.9797 8.3751 122.4327 54.8323 32.1294 175.1513 16 E 4.0822 8.9458 119.2622 59.9283 29.7457 178.7216 17 N 5.1261 8.0496 112.8135 52.6879 39.8862 173.8273 18 T 4.7978 7.4849 107.6188 59.8535 72.0780 172.8356 19 L 4.2070 8.1762 121.6187 54.5518 42.3255 178.5731 20 S 4.3845 8.4286 117.4112 57.0772 61.0401 174.6876 21 F 3.9636 8.3135 126.9017 59.8456 38.9075 176.3499 22 E 3.9662 8.2672 118.4346 59.6940 29.4707 179.1596 23 R 3.9632 7.8873 117.3869 58.7715 29.9930 179.1631 24 L 3.9127 7.8600 119.2622 57.5149 41.6087 179.1848 25 K 3.9871 8.3100 119.7997 59.7328 32.1284 178.4489 26 N 4.4002 8.3537 116.6678 56.1999 38.3724 177.0884 27 L 4.0927 8.1507 121.8296 58.3691 42.1771 179.2441 28 V 3.6477 8.4150 118.3721 65.9191 31.1871 177.7846 29 A 3.7535 8.2769 120.6475 54.9851 18.2608 179.3578 30 F 4.4571 8.3410 119.1687 61.6580 39.2835 177.3954 31 L 3.7226 8.0531 117.4307 57.6220 41.4395 179.0389 32 A 3.8886 7.7538 120.0960 54.8540 17.3885 179.5386 33 K 4.1070 7.6542 116.8790 59.0634 32.3667 180.5350 34 L 4.3468 7.7292 120.5463 54.5657 41.4696 179.1475 *36 E 4.3849 8.2031 119.8470 55.6204 31.5093 176.7813 37 K 4.1724 7.2250 118.5193 56.8803 33.7064 175.9251 38 Y 5.1326 8.2650 115.5415 55.7541 42.3935 175.1293 39 E 4.2859 9.1598 121.2242 56.2777 30.7014 176.1971 40 V 4.8501 8.4359 124.0607 61.0389 34.3863 174.4226 41 I 4.5356 8.6259 127.9956 59.3871 40.4065 174.0192 42 L 4.9265 8.6563 129.1365 53.4994 44.1722 175.0012 43 V 4.7943 8.8108 126.6852 61.5379 33.3914 174.0720 44 T 4.8437 8.8533 123.1900 60.7679 69.7515 173.8112 45 S 4.8984 8.1891 123.4674 57.1527 65.9537 174.7061 46 A 3.8086 8.8335 125.0198 53.3036 15.9524 180.0733 47 A 4.0509 7.9371 121.2002 55.9516 18.3244 180.5997 48 I 3.6955 7.6976 117.9326 64.5703 37.1545 178.5721 49 S 4.1313 8.0906 115.2930 61.5901 62.5201 176.3499 50 A 4.2709 8.1170 122.4051 55.3782 18.3598 179.6773 51 G 3.6851 8.4656 104.3365 48.1355 0.0000 175.4906 52 H 4.5096 8.4506 121.7385 58.6663 29.5969 177.3546 53 T 4.0275 7.6418 116.9637 65.7583 68.2541 174.8996 54 K 4.2783 7.9593 118.5577 56.3453 33.9674 176.2943 55 L 4.5028 7.3898 121.0628 53.5326 44.5605 174.9524 56 D 4.6562 8.4978 127.7147 52.3151 39.6161 174.5074 57 I 4.5908 7.3047 115.6082 57.7140 41.3477 175.4760 58 D 4.4682 8.4003 120.2585 54.0936 41.0518 176.8942 59 R 4.1632 8.5446 125.4611 57.7703 30.3951 177.6705 60 K 4.1739 7.7272 116.7701 58.2955 32.8201 177.6797 61 N 4.5051 7.5792 117.3182 52.8684 40.3030 175.2724 62 L 3.9565 8.5150 129.2465 58.5633 42.3833 179.2753 63 I 4.0498 7.7341 120.5071 63.6989 36.9901 177.8627 64 N 4.3345 8.4515 117.5854 56.3828 38.2972 177.4692 65 K 3.9862 8.0374 119.7046 59.5603 32.2387 179.3534 66 Q 3.9928 8.0493 118.2333 58.9934 28.6818 179.1945 67 V 3.7115 7.8513 119.1954 66.0204 31.5508 178.1390 68 L 4.0375 8.3560 118.9355 57.6802 41.3866 179.3474 69 A 4.0418 8.4482 120.9554 55.0601 18.0748 179.5337 70 A 4.0022 7.8290 118.5037 55.2980 17.6514 179.6890 71 I 4.0106 7.7811 118.0000 64.4039 37.2922 178.9165 72 G 3.9470 8.5703 107.0958 47.5592 0.0000 175.2812 73 Q 4.0515 8.5508 122.7470 58.8385 29.0534 177.2210 74 P 4.3526 0.0000 0.0000 65.7038 31.3562 178.1052 75 F 4.2651 7.9027 120.9930 61.0060 39.3601 176.7731 76 L 3.6505 8.6648 120.3621 58.2378 41.8034 179.1104 77 I 3.9522 7.9606 119.9113 64.4294 36.9724 178.5689 78 S 4.2059 8.0838 115.1690 61.3094 62.6675 176.8813 79 V 3.4462 7.4916 121.8833 65.8748 31.2608 177.4160 80 Y 4.1580 7.7886 116.4627 61.3373 37.7839 178.5382 81 N 4.3843 8.6479 117.5011 56.5589 38.4707 177.2007 82 E 4.0075 8.2600 118.8342 59.5677 29.6633 179.2489 83 L 4.2194 8.0825 118.9444 57.7587 41.7126 179.5131 84 L 4.2597 8.7388 119.0946 57.5323 41.5367 179.1901 85 A 4.0125 8.2371 120.9843 54.9386 17.9472 179.3059 86 K 3.6572 7.5361 117.5922 58.9050 32.0359 177.9334 87 F 4.7577 7.6410 114.6501 55.9105 40.0845 175.0723 88 N 4.2162 8.0035 114.2685 54.7952 36.5391 173.9652 89 K 4.8434 8.1956 114.7298 54.6510 35.7299 176.7867 90 L 4.8735 8.4705 120.8795 53.0209 45.3868 175.7093 91 G 4.4149 9.1322 109.1755 44.5006 0.0000 173.0502 92 G 4.3100 8.7842 109.3199 43.9129 0.0000 171.8238 93 Q 4.6927 8.7156 125.7890 55.6986 30.1832 174.8917 94 I 4.5601 8.8586 127.2534 59.4645 40.4285 174.2225 95 L 5.2507 8.5945 126.7478 53.0935 43.6011 175.7599 96 L 5.1708 8.8550 122.6878 53.1559 46.3706 175.2406 97 T 4.8097 8.5714 109.8825 59.6111 71.6607 174.3530 98 G 3.7361 8.7942 110.7329 48.7435 0.0000 176.1603 99 K 3.9522 8.0189 119.1292 59.2331 32.7728 178.6955 100 D 4.2682 8.1672 118.8609 57.4812 40.7679 178.8858 101 F 4.1638 7.4082 115.6000 59.0806 39.0105 176.0077 102 D 4.3989 7.7445 119.5284 55.9020 41.5404 176.5026 103 S 4.4570 7.6707 114.2931 57.2577 63.5319 174.7554 104 R 3.9027 8.5294 128.6156 59.1128 29.9468 178.9681 105 K 3.8498 7.9252 118.7625 59.3577 32.3736 178.6573 106 A 3.9939 7.8764 121.0123 55.5133 17.9209 179.7416 107 T 3.8343 7.7552 114.2718 66.4853 68.4034 176.7099 108 K 3.9869 8.1079 121.4662 60.0111 32.1676 178.3815 109 H 4.1778 8.1251 116.0870 58.8854 28.5818 177.6707 110 A 3.9000 8.1588 122.3968 55.0297 18.2793 179.6244 111 K 3.5948 8.6142 118.5886 59.4866 32.0669 178.4827 112 N 4.2330 8.2148 115.8745 56.4697 38.6057 176.8819 113 A 4.0874 7.4664 119.9827 55.1720 18.5769 179.3883 114 I 3.7000 7.3921 116.9970 64.0215 38.8200 177.7399 115 D 4.5809 8.2168 120.9497 54.6970 36.7349 176.7585 *118 I 4.0440 7.4048 123.5552 61.2807 39.7763 177.8354 119 N 4.2292 8.1549 117.2411 56.7512 38.6258 175.7587 120 L 4.1004 7.7802 114.8915 55.7673 42.0968 177.7107 121 G 3.9472 8.0527 106.9196 45.0374 0.0000 173.1312 122 I 4.3100 7.2849 119.5667 60.0592 38.5807 175.2961 123 L 4.2341 8.6037 129.0863 53.7543 43.0890 174.1335 124 P 4.6985 0.0000 0.0000 62.5830 32.7610 175.4765 125 I 4.7488 8.7921 125.4655 59.7375 39.8364 174.4701 126 I 4.9581 8.8835 128.9421 59.9762 39.5261 174.7149 127 N 5.3071 8.8084 123.2034 51.6732 43.2223 172.8712 128 E 4.5417 8.6804 122.8979 56.1292 30.7890 176.5193 129 N 4.5348 9.2847 125.6383 53.4608 37.6203 174.8768 130 D 5.3052 8.6698 122.7214 54.2489 41.5845 177.9199 131 A 4.1380 8.1878 123.1489 54.8520 18.4550 178.8231 132 T 4.4153 7.9087 102.0066 61.6187 70.4295 174.1652 133 A 4.7026 8.0059 125.1243 50.9182 22.4639 176.3204 134 I 4.5489 8.1432 111.7647 59.7507 39.2876 176.8220 135 E 3.9248 8.4347 122.6261 60.1015 29.4596 178.5220 136 E 3.9783 9.0062 118.4027 59.0380 29.2245 179.4336 137 I 3.7299 7.3766 118.5553 64.2408 36.9261 177.7859 138 V 3.7327 7.9801 119.4653 65.3436 31.6041 175.8211 139 F 5.5301 7.7340 121.5271 59.8651 41.6838 172.0923 140 G 3.1370 9.9507 119.9867 44.1409 0.0000 172.7576 141 D 3.9953 8.4471 118.3309 55.4408 40.2495 173.8101 142 N 4.5015 8.8872 112.1555 53.7955 37.1828 176.2942 143 D 4.2840 7.9816 119.9533 57.6504 40.8465 178.7668 144 S 3.9823 7.8257 112.7889 61.2860 62.4590 175.5347 145 L 3.9004 7.9042 122.8750 58.3341 41.7701 179.2029 146 S 4.1345 8.2835 113.8972 61.1794 62.9874 176.3321 147 A 3.9507 7.9454 124.4481 55.2158 18.0977 179.2573 148 Y 3.2525 7.9821 115.0267 60.6628 37.7641 178.3986 149 A 3.6502 7.8064 121.8001 55.4025 18.4508 179.7589 150 T 3.8233 7.8356 114.0341 67.0261 68.6663 176.3926 151 H 3.9739 7.9696 119.8441 59.4117 29.7727 177.3407 152 F 4.1818 7.9579 117.6993 59.3986 38.9618 176.3280 153 F 5.1260 7.8811 118.1573 56.8445 39.1951 175.4507 154 D 4.2935 7.7273 117.4165 55.4304 38.2825 173.4931 155 A 4.7735 8.0380 120.4782 51.1298 21.3776 177.2893 156 D 4.7318 8.8100 119.4952 55.5717 42.8565 176.6753 157 L 5.1465 7.6604 119.5166 53.2796 45.8951 174.3760 158 L 4.9969 8.7120 128.3894 53.5113 43.6628 175.4706 159 V 4.5199 9.2063 127.5330 61.6623 33.3405 174.3864 160 I 4.6975 8.4745 129.8994 60.0707 38.4810 174.7177 161 L 5.1950 9.0405 128.1749 53.3962 43.6547 175.8412 162 S 4.5696 8.8141 116.7968 56.7553 66.3625 174.3371 163 D 4.4933 9.2418 122.1799 57.3376 40.6052 177.6249 164 I 4.1882 7.5389 117.5613 60.0751 38.9890 175.1391 165 D 4.6517 8.6936 124.4092 53.3498 39.9837 175.7020 166 G 4.1353 7.3021 106.5473 46.5746 0.0000 171.5540 167 F 5.2462 8.5215 122.6786 57.2358 39.6406 174.2916 168 Y 4.8850 7.9447 121.8532 55.6724 41.6225 176.3038 169 D 4.0058 9.1077 120.8834 55.2944 39.7140 176.0053 170 K 4.2640 7.0491 117.2214 55.4705 35.7201 174.3204 171 N 4.2897 8.8311 117.8693 53.4780 38.5909 173.4904 172 P 4.2702 0.0000 0.0000 65.1176 31.5795 178.0875 173 S 4.1392 8.1425 114.8447 60.8732 62.7891 175.2975 174 E 4.1622 7.7038 119.0283 55.4543 30.0855 176.1706 175 F 4.9117 7.2371 117.3937 55.5213 42.1522 176.0202 176 S 4.1688 9.0009 122.0026 60.8112 62.9402 174.6393 177 D 4.7413 8.0374 117.4952 52.6601 39.4912 176.0186 178 A 4.2145 7.5943 122.3632 53.0096 19.0019 177.6134 179 K 4.5746 9.9734 122.7070 54.5776 34.6704 175.6364 180 R 3.4466 8.2073 125.2866 55.2736 30.9142 175.6876 181 L 4.1942 8.0477 127.6522 53.7008 41.7476 176.5075 182 E 4.1472 8.5835 124.8254 58.5428 30.6943 177.4135 183 K 5.0888 7.7978 116.6293 54.5785 36.3406 176.1638 184 I 4.6890 8.7249 124.3698 60.1413 40.2462 176.2694 185 T 4.8571 8.9128 121.5129 63.3696 70.2332 174.1478 186 H 4.8028 8.0046 119.3027 54.5420 32.8388 172.5795 187 I 4.2615 7.8872 127.1823 59.4219 37.0189 175.8212 188 K 3.5763 6.3209 126.0292 55.8515 32.3736 178.2033 189 E 3.9116 8.6795 124.9133 58.7587 29.7609 178.3514 190 E 4.1730 7.8315 115.3761 58.3807 30.0318 177.9117 191 W 4.6231 8.0208 118.9118 58.3571 29.3730 175.8715 192 L 4.5874 7.5311 118.9376 53.3601 42.6281 175.4691 *202 H 4.7845 8.8809 123.3432 56.4157 32.0895 173.0657 203 G 3.9799 7.7523 104.7053 44.4040 0.0000 173.7844 204 T 3.8359 8.2513 108.3695 62.6075 69.0373 174.5430 205 G 3.0520 8.6590 110.8715 44.4782 0.0000 175.1224 206 G 3.9939 8.0551 108.2393 45.5295 0.0000 173.5911 207 I 3.9092 8.2087 117.0285 63.6264 37.9702 179.4785 208 V 3.6598 7.2908 118.5207 65.0322 31.0994 178.5605 209 T 3.9592 7.3710 110.3395 64.1084 68.5050 176.7881 210 K 3.8407 7.8035 121.1625 59.2499 32.0725 179.0793 211 L 3.7498 7.8346 119.2995 57.3412 41.5398 179.5975 212 K 3.9570 8.4866 118.8728 59.2753 31.9600 179.1676 213 A 3.9497 7.8840 120.7919 55.1284 18.2993 179.5914 214 A 3.7044 7.6555 119.2564 54.8798 18.3164 179.6805 215 K 3.7999 8.1194 118.3076 59.5579 32.0902 178.5731 216 F 4.0169 8.2489 120.7876 61.4849 39.3043 177.1831 217 L 3.8211 7.9745 118.4133 57.5724 41.4359 179.3768 218 L 3.9566 8.3118 119.3605 57.9927 41.4098 179.5109 219 E 3.9586 7.9545 116.7626 58.4951 29.2635 177.9868 220 H 4.5263 7.0613 115.2578 54.7696 30.1095 173.8250 221 N 4.1385 7.8585 115.2661 54.4729 36.5206 173.9725 222 K 4.6997 8.3399 115.6549 54.5820 36.1126 174.6293 223 K 5.4430 8.0888 118.1941 53.9168 36.2002 174.6387 *225 F 5.0715 8.4550 122.4007 58.9503 40.8587 174.4881 226 L 4.9237 8.4709 128.9047 53.8490 43.7361 175.2172 227 A 4.7759 8.3919 126.6042 50.3551 23.5134 174.6707 228 S 4.6972 8.6101 114.4392 58.6425 62.6345 174.2265 229 G 3.8835 9.3087 113.8013 47.1546 0.0000 174.7447 230 F 4.2685 8.5489 118.7090 58.7415 39.6375 175.0529 231 D 4.8189 8.1039 120.2820 52.3157 42.0357 175.9340 232 L 4.2222 8.3106 126.2396 55.2828 41.7855 178.6942 233 S 4.0624 7.9289 117.1630 61.7154 62.8469 176.7051 234 V 3.6568 7.8100 119.8378 66.0212 31.4015 177.7557 235 A 4.4412 8.0388 119.9521 55.1819 18.3247 179.4097 236 K 4.0749 8.3577 117.3503 60.1759 32.1633 179.6516 237 T 3.8891 8.1747 115.9129 66.6369 68.2259 176.5138 238 F 4.3038 8.4877 123.8782 60.5285 39.1694 176.8062 239 L 4.2490 8.1507 116.8979 56.2398 42.1262 178.1335 240 L 4.6182 8.7048 117.3369 54.8941 42.4265 177.0905 241 E 4.4416 7.7961 116.3475 56.3062 30.8106 177.1526 242 D 4.1524 7.8702 114.7252 53.9317 37.5044 173.3257 243 K 4.2194 7.0479 122.3947 55.3928 35.6428 173.7030 244 Q 4.7122 8.8759 128.2856 55.1607 29.1577 174.6329 245 I 4.3988 8.1046 117.8477 59.9070 38.1468 174.9234 246 G 3.7688 8.1131 108.4496 46.5703 0.0000 173.6621 247 G 3.9907 8.7186 109.4788 44.5618 0.0000 172.5262 248 T 4.6433 7.8007 114.1486 61.4548 71.8312 173.2454 249 L 5.0181 8.6586 128.4973 53.5543 44.3570 174.8086 250 F 5.3677 8.8832 125.0543 55.8399 41.4542 175.4681 251 E 4.4286 9.0178 121.7094 56.8945 29.5853 175.1339 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 K 8.17 4.57 0.00 1.95 1.97 0.00 1.74 0.00 0.00 1.90 0.00 0.00 2.86 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.63 1.70 7.81 3 R 8.90 5.10 0.00 2.07 1.73 0.00 3.40 0.00 0.00 3.27 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.79 0.00 4 I 9.11 5.02 1.70 0.00 0.00 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.60 0.38 0.00 0.00 5 V 8.54 4.76 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 0.95 0.00 0.00 1.02 0.00 0.00 6 V 8.76 4.69 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 0.97 0.00 0.00 0.83 0.00 0.00 7 K 9.62 5.14 0.00 1.78 1.62 0.00 1.62 0.00 0.00 1.69 0.00 0.00 2.87 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.47 1.48 7.81 8 V 8.66 4.67 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 0.80 0.00 0.00 0.94 0.00 0.00 9 G 8.40 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 10 S 9.12 4.22 0.00 3.97 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 11 H 8.31 4.28 0.00 3.30 3.69 0.00 5.78 0.00 0.00 0.00 0.00 6.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 12 V 7.37 2.98 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.56 0.00 0.00 0.94 0.00 0.00 13 I 7.64 4.26 1.71 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 1.55 0.98 0.84 0.00 0.00 14 S 7.66 4.97 0.00 3.89 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 15 E 8.38 4.98 0.00 1.92 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 2.38 0.00 16 E 8.95 4.08 0.00 1.95 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 2.31 2.30 0.00 17 N 8.05 5.13 0.00 2.74 2.80 0.00 0.00 6.65 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 18 T 7.48 4.80 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 1.29 0.00 0.00 19 L 8.18 4.21 0.00 0.77 0.90 0.68 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 20 S 8.43 4.38 0.00 3.77 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 21 F 8.31 3.96 0.00 3.23 3.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 E 8.27 3.97 0.00 2.08 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 2.40 2.45 0.00 23 R 7.89 3.96 0.00 1.79 1.80 0.00 2.78 0.00 0.00 2.98 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.59 0.00 24 L 7.86 3.91 0.00 1.80 1.55 0.41 0.31 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 25 K 8.31 3.99 0.00 1.99 2.05 0.00 1.69 0.00 0.00 1.70 0.00 0.00 2.98 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.53 1.58 7.81 26 N 8.35 4.40 0.00 2.97 2.88 0.00 0.00 6.70 6.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27 L 8.15 4.09 0.00 1.90 2.00 1.06 1.25 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 28 V 8.41 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0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 A 8.83 3.81 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 47 A 7.94 4.05 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 48 I 7.70 3.70 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 1.82 0.64 0.93 0.00 0.00 49 S 8.09 4.13 0.00 3.98 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 50 A 8.12 4.27 1.61 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 51 G 8.47 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 52 H 8.45 4.51 0.00 3.34 3.34 0.00 5.65 0.00 0.00 0.00 0.00 6.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53 T 7.64 4.03 4.44 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 1.12 0.00 0.00 54 K 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0.00 0.00 0.00 0.00 0.00 0.00 0.00 71 I 7.78 4.01 1.89 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 0.83 0.90 0.00 0.00 72 G 8.57 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 0.00 0.00 0.00 73 Q 8.55 4.05 0.00 2.25 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.74 0.00 0.00 0.00 0.00 0.00 2.39 2.61 0.00 74 P 0.00 4.35 0.00 2.37 2.34 0.00 3.80 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 2.07 0.00 75 F 7.90 4.27 0.00 3.34 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 76 L 8.66 3.65 0.00 1.82 1.95 0.64 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 77 I 7.96 3.95 2.04 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 1.87 0.78 0.95 0.00 0.00 78 S 8.08 4.21 0.00 4.09 4.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 V 7.49 3.45 1.79 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 0.89 0.00 0.00 0.45 0.00 0.00 80 Y 7.79 4.16 0.00 3.33 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 81 N 8.65 4.38 0.00 2.88 2.91 0.00 0.00 7.09 7.24 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 82 E 8.26 4.01 0.00 2.05 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 2.67 0.00 83 L 8.08 4.22 0.00 1.98 1.84 0.91 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 84 L 8.74 4.26 0.00 1.87 1.87 0.97 0.79 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 85 A 8.24 4.01 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 86 K 7.54 3.66 0.00 1.52 1.34 0.00 1.58 0.00 0.00 1.28 0.00 0.00 2.99 0.00 0.00 2.64 0.00 0.00 0.00 0.00 0.60 1.16 7.81 87 F 7.64 4.76 0.00 3.09 3.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 88 N 8.00 4.22 0.00 2.89 2.89 0.00 0.00 6.69 6.93 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 89 K 8.20 4.84 0.00 1.79 1.73 0.00 1.68 0.00 0.00 1.75 0.00 0.00 2.98 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.59 1.59 7.81 90 L 8.47 4.87 0.00 1.56 1.52 0.93 0.78 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 91 G 9.13 4.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 92 G 8.78 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 93 Q 8.72 4.69 0.00 2.08 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.70 6.63 0.00 0.00 0.00 0.00 0.00 2.34 2.39 0.00 94 I 8.86 4.56 1.86 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 1.17 0.78 0.89 0.00 0.00 95 L 8.59 5.25 0.00 1.49 1.57 0.93 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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104 R 8.53 3.90 0.00 1.88 1.97 0.00 3.20 0.00 0.00 3.29 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.69 0.00 105 K 7.93 3.85 0.00 1.80 1.78 0.00 1.73 0.00 0.00 1.83 0.00 0.00 2.99 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.54 1.48 7.81 106 A 7.88 3.99 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 0.00 107 T 7.76 3.83 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 1.31 0.00 0.00 108 K 8.11 3.99 0.00 1.98 1.94 0.00 1.56 0.00 0.00 1.66 0.00 0.00 3.04 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.37 1.49 7.81 109 H 8.13 4.18 0.00 3.37 3.30 0.00 5.67 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 0.00 110 A 8.16 3.90 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 0.00 111 K 8.61 3.59 0.00 2.22 1.93 0.00 2.12 0.00 0.00 1.79 0.00 0.00 3.11 0.00 0.00 3.25 0.00 0.00 0.00 0.00 1.71 1.68 7.81 112 N 8.21 4.23 0.00 2.92 2.89 0.00 0.00 7.04 8.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 A 7.47 4.09 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 0.00 114 I 7.39 3.70 1.50 0.00 0.00 -0.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.34 0.70 0.00 0.00 115 D 8.22 4.58 0.00 2.70 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 *118 I 7.40 4.04 1.99 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 1.28 0.98 0.91 0.00 0.00 119 N 8.15 4.23 0.00 2.66 2.86 0.00 0.00 7.34 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 0.00 120 L 7.78 4.10 0.00 1.67 1.70 0.91 0.96 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 0.00 121 G 8.05 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 0.00 0.00 0.00 122 I 7.28 4.31 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 1.22 0.60 0.93 0.00 0.00 123 L 8.60 4.23 0.00 1.74 1.51 0.85 0.70 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 0.00 124 P 0.00 4.70 0.00 2.05 1.87 0.00 3.69 0.00 0.00 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.05 0.00 125 I 8.79 4.75 1.74 0.00 0.00 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 0.88 0.61 0.00 0.00 126 I 8.88 4.96 1.94 0.00 0.00 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.80 1.03 0.00 0.00 127 N 8.81 5.31 0.00 2.75 2.61 0.00 0.00 6.74 7.69 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 0.00 128 E 8.68 4.54 0.00 2.16 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 2.34 2.31 0.00 129 N 9.28 4.53 0.00 2.69 2.70 0.00 0.00 7.10 8.48 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 0.00 130 D 8.67 5.31 0.00 2.72 2.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 131 A 8.19 4.14 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 0.00 132 T 7.91 4.42 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 1.20 0.00 0.00 133 A 8.01 4.70 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 0.00 134 I 8.14 4.55 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 1.31 0.81 0.92 0.00 0.00 135 E 8.43 3.92 0.00 2.04 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 2.38 2.44 0.00 136 E 9.01 3.98 0.00 2.20 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 2.44 2.59 0.00 137 I 7.38 3.73 2.08 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 0.79 0.93 0.00 0.00 138 V 7.98 3.73 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 1.01 0.00 0.00 1.03 0.00 0.00 139 F 7.73 5.53 0.00 2.78 2.85 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 0.00 140 G 9.95 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 0.00 0.00 0.00 141 D 8.45 4.00 0.00 2.70 2.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 142 N 8.89 4.50 0.00 2.94 2.98 0.00 0.00 7.07 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 143 D 7.98 4.28 0.00 2.58 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 0.00 144 S 7.83 3.98 0.00 3.80 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 0.00 145 L 7.90 3.90 0.00 1.97 1.67 1.13 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 146 S 8.28 4.13 0.00 4.11 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 0.00 147 A 7.95 3.95 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 Y 7.98 3.25 0.00 2.35 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 149 A 7.81 3.65 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 0.00 150 T 7.84 3.82 4.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 151 H 7.97 3.97 0.00 2.95 2.93 0.00 5.78 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 0.00 152 F 7.96 4.18 0.00 2.89 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 0.00 153 F 7.88 5.13 0.00 3.23 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 0.00 154 D 7.73 4.29 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 0.00 155 A 8.04 4.77 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 0.00 156 D 8.81 4.73 0.00 2.59 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 0.00 157 L 7.66 5.15 0.00 1.73 1.40 1.08 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 158 L 8.71 5.00 0.00 1.67 1.55 0.96 0.78 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 0.00 159 V 9.21 4.52 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 1.15 0.00 0.00 1.06 0.00 0.00 160 I 8.47 4.70 1.84 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 1.20 0.57 0.88 0.00 0.00 161 L 9.04 5.19 0.00 1.59 1.63 1.10 0.72 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 0.00 162 S 8.81 4.57 0.00 3.90 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 0.00 163 D 9.24 4.49 0.00 2.76 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 0.00 164 I 7.54 4.19 1.89 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 1.47 0.97 1.01 0.00 0.00 165 D 8.69 4.65 0.00 2.89 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 0.00 166 G 7.30 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 0.00 167 F 8.52 5.25 0.00 3.09 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 0.00 168 Y 7.94 4.88 0.00 2.82 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 0.00 169 D 9.11 4.01 0.00 2.62 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 0.00 170 K 7.05 4.26 0.00 1.83 1.62 0.00 0.61 0.00 0.00 1.18 0.00 0.00 2.70 0.00 0.00 2.73 0.00 0.00 0.00 0.00 1.18 1.25 7.81 171 N 8.83 4.29 0.00 2.84 2.89 0.00 0.00 6.63 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 0.00 172 P 0.00 4.27 0.00 1.63 0.79 0.00 3.70 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 1.65 1.30 0.00 173 S 8.14 4.14 0.00 3.91 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 0.00 174 E 7.70 4.16 0.00 1.56 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.16 0.00 175 F 7.24 4.91 0.00 3.07 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 0.00 176 S 9.00 4.17 0.00 3.89 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 0.00 177 D 8.04 4.74 0.00 2.78 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 0.00 178 A 7.59 4.21 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 0.00 179 K 9.97 4.57 0.00 1.87 1.64 0.00 1.62 0.00 0.00 1.53 0.00 0.00 2.78 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.36 1.34 7.81 180 R 8.21 3.45 0.00 0.91 1.43 0.00 2.98 0.00 0.00 2.96 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.58 0.00 181 L 8.05 4.19 0.00 1.32 1.45 0.39 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 0.00 0.00 0.00 0.00 182 E 8.58 4.15 0.00 1.88 1.97 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 2.33 2.24 0.00 183 K 7.80 5.09 0.00 1.53 1.64 0.00 1.58 0.00 0.00 1.71 0.00 0.00 3.02 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.35 1.51 7.81 184 I 8.72 4.69 1.39 0.00 0.00 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 1.03 0.89 1.35 0.00 0.00 185 T 8.91 4.86 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 1.25 0.00 0.00 186 H 8.00 4.80 0.00 3.04 3.10 0.00 5.72 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 0.00 187 I 7.89 4.26 1.82 0.00 0.00 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.07 1.04 0.00 0.00 188 K 6.32 3.58 0.00 0.79 0.88 0.00 0.98 0.00 0.00 1.06 0.00 0.00 2.88 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.09 1.13 7.81 189 E 8.68 3.91 0.00 1.98 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.37 2.36 0.00 190 E 7.83 4.17 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 2.08 2.46 0.00 191 W 8.02 4.62 0.00 3.58 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 0.00 192 L 7.53 4.59 0.00 1.83 1.66 1.00 1.07 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 *202 H 8.88 4.78 0.00 3.13 3.71 0.00 5.72 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 0.00 203 G 7.75 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 0.00 204 T 8.25 3.84 4.13 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 1.04 0.00 0.00 205 G 8.66 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 0.00 0.00 0.00 206 G 8.06 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 207 I 8.21 3.91 1.94 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 1.07 0.98 0.00 0.00 208 V 7.29 3.66 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 1.14 0.00 0.00 1.02 0.00 0.00 209 T 7.37 3.96 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 0.71 0.00 0.00 210 K 7.80 3.84 0.00 1.89 1.71 0.00 1.78 0.00 0.00 1.78 0.00 0.00 2.93 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.43 1.61 7.81 211 L 7.83 3.75 0.00 1.79 1.71 0.75 0.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 212 K 8.49 3.96 0.00 1.74 1.87 0.00 1.71 0.00 0.00 1.70 0.00 0.00 3.02 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.50 1.65 7.81 213 A 7.88 3.95 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 0.00 214 A 7.66 3.70 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 215 K 8.12 3.80 0.00 1.90 2.01 0.00 1.64 0.00 0.00 1.59 0.00 0.00 2.93 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.49 1.42 7.81 216 F 8.25 4.02 0.00 3.11 3.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 217 L 7.97 3.82 0.00 1.83 1.65 0.96 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 218 L 8.31 3.96 0.00 1.61 1.71 1.10 0.98 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 0.00 219 E 7.95 3.96 0.00 1.95 1.68 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 2.23 2.25 0.00 220 H 7.06 4.53 0.00 2.46 2.75 0.00 6.00 0.00 0.00 0.00 0.00 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 221 N 7.86 4.14 0.00 2.82 2.84 0.00 0.00 6.63 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 222 K 8.34 4.70 0.00 1.67 1.67 0.00 1.56 0.00 0.00 1.75 0.00 0.00 3.09 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.32 1.49 7.81 223 K 8.09 5.44 0.00 1.76 1.90 0.00 1.75 0.00 0.00 1.75 0.00 0.00 2.95 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.39 1.21 7.81 *225 F 8.46 5.07 0.00 2.91 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 0.00 226 L 8.47 4.92 0.00 1.88 1.54 0.94 0.73 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 0.00 227 A 8.39 4.78 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 228 S 8.61 4.70 0.00 3.94 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 229 G 9.31 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 230 F 8.55 4.27 0.00 3.00 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 0.00 231 D 8.10 4.82 0.00 2.65 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 0.00 232 L 8.31 4.22 0.00 1.49 1.13 0.84 0.93 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 0.00 233 S 7.93 4.06 0.00 3.82 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 0.00 234 V 7.81 3.66 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 1.24 0.00 0.00 0.99 0.00 0.00 235 A 8.04 4.44 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 0.00 236 K 8.36 4.07 0.00 1.87 1.87 0.00 1.47 0.00 0.00 1.54 0.00 0.00 2.63 0.00 0.00 2.66 0.00 0.00 0.00 0.00 1.05 0.59 7.81 237 T 8.17 3.89 4.35 0.00 0.00 0.00 0.00 0.00 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 0.00 238 F 8.49 4.30 0.00 3.11 3.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 239 L 8.15 4.25 0.00 2.04 1.96 1.14 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 240 L 8.70 4.62 0.00 1.76 1.78 1.11 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 241 E 7.80 4.44 0.00 2.08 1.90 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 2.23 2.28 0.00 242 D 7.87 4.15 0.00 2.65 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 0.00 243 K 7.05 4.22 0.00 1.82 1.61 0.00 1.71 0.00 0.00 1.77 0.00 0.00 3.10 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.44 1.41 7.81 244 Q 8.88 4.71 0.00 2.31 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.86 0.00 0.00 0.00 0.00 0.00 2.43 2.58 0.00 245 I 8.10 4.40 1.92 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 1.44 0.91 0.96 0.00 0.00 246 G 8.11 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 0.00 247 G 8.72 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 248 T 7.80 4.64 4.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.60 0.00 0.00 249 L 8.66 5.02 0.00 1.81 1.55 1.04 0.87 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 0.00 250 F 8.88 5.37 0.00 3.06 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 0.00 251 E 9.02 4.43 0.00 2.08 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 0.00 2.27 2.31 0.00 * Residues marked with a * may have inaccurate shift predictions.