NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 A 4.3525 8.2644 123.5836 52.1595 20.2284 176.2617 3 T 4.5430 8.4910 116.6601 59.9590 71.7301 171.5659 4 I 4.8397 8.4577 127.8854 59.4293 40.6869 174.3136 5 V 4.0733 8.4096 126.9735 61.2323 33.5059 174.0140 6 N 4.9393 8.3691 125.7251 51.7429 40.3131 173.6717 7 L 5.1601 8.9246 125.8797 53.1462 45.1615 174.4605 8 L 5.2697 9.2521 128.7515 53.8425 44.2293 175.9698 9 V 4.5937 8.3538 120.6197 59.1745 34.5690 176.1279 10 G 3.9646 8.5616 109.8274 46.3283 0.0000 174.2802 11 G 3.9023 7.9528 109.3287 43.4967 0.0000 172.4845 12 P 4.2253 0.0000 0.0000 62.8391 31.6675 177.7995 13 T 2.0000 8.2028 111.1953 63.6243 68.8254 176.0979 14 A 3.9627 7.6584 124.0291 54.4814 18.6852 177.5753 15 N 4.7178 7.8047 111.7615 53.6306 39.2593 174.9423 16 Y 4.8396 7.5024 117.2293 57.8632 38.3428 175.0892 17 P 4.4085 0.0000 0.0000 64.7750 31.9857 175.3039 18 A 4.2963 7.3622 119.6367 51.4272 21.7105 174.7492 19 D 4.4242 8.2117 118.7232 54.4203 41.7453 177.0214 20 L 3.7672 8.5814 126.9886 58.0308 41.6845 178.9976 21 T 4.0591 7.7856 106.1356 63.4084 68.8518 174.9371 22 T 4.1878 7.8408 118.5966 64.4214 69.0737 174.6028 23 I 4.2768 7.4944 123.1925 59.0054 37.6948 174.0628 24 P 4.3026 0.0000 0.0000 63.4744 31.8691 176.2217 25 G 4.0021 8.6899 109.0205 43.2792 0.0000 171.8220 26 P 4.4445 0.0000 0.0000 62.5159 32.7326 175.0823 27 W 5.1856 8.7696 121.4699 55.1248 32.1220 174.9561 28 V 4.7786 9.1064 122.5815 61.0814 34.8209 174.4216 29 G 4.5401 8.7097 112.4460 44.3080 0.0000 170.9562 30 A 5.3995 8.7033 125.5324 49.9621 21.9020 175.7093 31 D 4.2514 9.8294 123.2430 55.0306 41.0757 176.9057 32 R 4.1051 9.0206 127.3242 60.5892 29.4692 177.6915 33 G 3.7034 8.2960 105.3271 47.7132 0.0000 175.5040 34 A 3.8919 8.0955 123.0471 54.8869 18.3051 179.6930 35 L 3.8506 7.8178 116.9820 58.1151 41.6321 179.9144 36 R 3.9189 8.1571 117.8392 58.7971 29.8531 179.2313 37 L 3.6568 7.7599 119.1314 57.6610 41.6207 179.5184 38 V 3.4616 7.5055 118.0976 65.9483 31.2262 177.9664 39 K 4.0344 7.9824 118.1529 59.1027 32.0590 177.9783 40 R 4.2767 7.3835 115.8509 55.7205 30.2222 177.2184 41 G 3.8357 8.0828 107.5348 45.6010 0.0000 173.4853 42 I 3.9342 7.5007 120.8878 59.9734 37.7857 175.3704 43 Q 4.1933 8.4711 126.9283 54.6227 28.9191 173.3620 44 P 4.7140 0.0000 0.0000 62.3255 32.4604 176.6038 45 V 4.0086 8.7926 116.1577 61.9361 32.8097 175.5399 *47 V 4.2262 7.6088 121.0479 62.7576 33.0566 174.1096 48 V 4.8048 10.3135 127.8236 60.9963 33.7198 175.8719 49 G 3.1867 7.7184 116.0003 44.2144 0.0000 170.6478 50 D 4.5187 7.3008 121.3676 52.6025 41.3620 175.8567 51 F 5.0278 7.8515 129.5634 56.4110 41.2657 175.4429 *62 V 4.0720 8.2939 119.6781 64.0673 32.5885 178.6721 63 K 4.1365 7.7376 117.5946 58.5315 32.0311 178.9076 64 D 4.1690 8.0187 119.3471 57.0617 40.8427 178.1771 65 A 4.0636 8.0664 121.5768 54.7605 18.2627 179.0430 66 L 4.1064 7.1409 114.9403 56.0821 41.8126 179.2689 67 V 3.8548 7.2351 118.3090 65.5042 31.8077 177.2811 68 G 4.0469 7.4247 104.8769 45.0116 0.0000 173.1798 69 A 4.7649 7.4908 120.0751 50.0575 22.2614 176.8202 70 I 3.9474 8.3989 122.9395 61.3197 37.8379 175.7818 71 V 4.4826 8.4213 126.8882 61.2229 33.1794 174.7379 72 V 4.4037 8.7486 128.5239 61.0292 33.5003 175.0089 73 K 4.7866 8.6402 127.2086 54.4647 33.1380 175.0749 74 P 4.3460 0.0000 0.0000 63.4631 31.9734 175.7540 75 D 4.7166 8.5728 122.4409 53.2709 42.9823 176.0150 76 Q 4.2042 8.6916 121.3624 58.2003 29.3143 176.0760 77 D 4.9101 8.5474 114.4396 52.9969 39.6245 175.4347 78 H 5.2149 7.9014 115.4450 53.8769 32.4401 174.0036 79 T 4.2476 8.8899 114.0772 61.5355 70.3216 175.6516 80 D 4.3965 8.5264 120.8234 57.4600 40.8146 179.2321 81 T 3.9611 7.8015 116.3003 66.5029 68.4757 176.6929 82 Q 3.7023 7.9526 119.8717 58.7441 28.7645 178.3344 83 L 3.9539 8.1954 121.2567 58.1678 42.0679 178.8129 84 A 3.9498 8.0601 120.3832 55.3016 18.3902 179.3859 85 I 3.5245 7.7968 118.1434 64.5793 37.2506 178.5343 86 K 3.7004 8.5837 120.3382 59.6756 32.0515 179.0139 87 S 4.1122 8.5639 115.7886 61.4528 62.6181 176.7253 88 I 3.4916 8.0113 122.8401 64.4765 36.7267 178.5624 89 F 3.9891 7.4833 118.4180 60.4651 38.3190 177.6281 90 E 4.1274 8.1197 117.3147 58.8301 29.4715 178.4694 91 Q 4.2884 8.3366 117.1099 57.5175 29.5505 176.8635 92 L 4.1993 7.9951 118.2174 54.5187 43.0508 176.5620 93 Q 3.6259 8.1656 115.9643 54.9471 26.0436 171.4026 94 P 4.6440 0.0000 0.0000 61.9760 33.2400 176.5000 95 D 4.6908 8.3356 119.1294 57.2050 41.2414 176.7732 96 E 5.1104 8.0221 115.4865 54.6551 34.7657 174.6255 97 V 4.5716 9.0126 121.7521 61.4779 34.6563 173.8600 98 H 5.1932 8.9319 125.5221 54.0420 30.9352 173.3141 99 L 4.8003 8.8931 127.3730 54.3868 43.2940 175.2159 100 Y 4.9717 9.4725 123.9324 56.3757 41.9669 176.0759 101 G 3.9574 8.9193 106.4946 46.9391 0.0000 174.9280 102 A 4.4309 8.0072 121.1258 52.0571 19.3617 177.4108 103 T 4.4371 7.4429 105.0365 59.7691 71.7380 174.2341 104 G 3.8921 8.9634 111.7534 45.3343 0.0000 175.5787 105 G 3.7649 8.1378 108.2789 47.0249 0.0000 177.0206 106 R 4.0858 8.4288 125.1240 55.5601 31.1540 176.9501 107 L 4.0263 8.5102 124.0874 57.5371 41.8695 179.2091 108 D 4.3138 7.9378 118.9618 56.4453 39.3522 178.3314 109 H 4.2802 7.9621 117.3052 58.5009 28.6728 177.0316 110 L 4.1252 7.3346 121.7886 57.7383 41.9748 178.9104 111 L 3.2939 7.4993 116.9594 57.1950 41.2769 179.0354 112 A 4.1353 7.5533 120.5308 54.8234 18.0013 178.8068 113 N 4.4284 7.8307 113.2085 53.6387 39.2628 176.0434 *115 W 4.9918 7.8071 118.2571 56.2059 30.9142 176.9781 116 L 3.8715 7.6128 122.3780 58.3047 41.7920 179.0475 117 V 3.9213 7.3851 109.2777 62.1900 31.7893 177.8253 118 L 4.0361 7.7370 120.6433 57.2021 41.9167 177.4070 119 D 4.4586 7.8200 119.1739 53.6889 41.4615 174.8787 120 P 4.2354 0.0000 0.0000 66.1881 31.0968 178.5825 121 V 3.4983 7.5974 114.5366 64.9344 31.6596 177.1447 122 F 4.6176 8.4976 116.7571 58.1655 39.7528 177.6744 123 R 4.4588 7.7384 120.7117 58.6786 29.5356 178.1223 124 Q 3.9338 7.6851 114.9115 57.7785 28.8530 176.5865 125 W 4.5164 7.9930 117.7505 56.2339 29.9501 177.5757 126 A 4.0563 8.1062 123.1850 54.9856 17.8372 178.3959 127 P 4.3876 0.0000 0.0000 64.5558 31.6484 176.9943 128 Q 4.6682 8.4166 115.9173 55.6244 30.0565 174.9099 129 I 5.1044 7.7436 120.9965 59.4043 39.4589 175.0467 130 K 4.7664 9.0353 127.8143 54.5838 35.4657 174.6541 131 L 4.9289 8.5633 127.1782 53.7258 43.6604 175.7518 132 I 5.0664 8.1717 123.4571 59.7490 40.7735 174.3624 133 D 4.9152 8.8678 125.3829 51.3102 42.7360 174.8862 134 K 4.0210 9.1163 120.1502 59.2675 32.1577 177.2616 135 Q 4.6429 8.2012 114.3705 55.6354 30.2934 174.2106 136 N 5.7684 9.5074 116.5225 51.4314 43.8742 173.4793 137 S 4.9555 8.7003 114.3733 56.7193 66.5277 172.9613 138 V 4.7084 8.9293 124.2266 60.9652 34.4254 174.4000 139 R 4.7372 8.3664 125.2058 54.2623 34.4022 174.1621 140 F 5.5074 8.2661 118.8599 55.8912 42.8591 174.2968 141 F 5.0266 9.4149 119.6363 55.9226 43.2043 174.2679 142 L 5.1715 8.8015 121.1893 52.5407 43.8615 174.4732 143 P 2.9700 0.0000 0.0000 62.1435 31.8159 177.2944 144 G 3.5726 6.2519 108.9960 45.8791 0.0000 169.7156 145 D 5.0226 7.3772 119.3228 52.6617 43.9578 175.0419 146 Y 4.7299 8.4347 120.0651 56.0780 42.9936 174.0303 147 Q 4.9373 8.5833 120.8679 54.4875 31.8466 174.0016 148 I 4.9241 9.1749 119.5666 59.5307 41.3900 174.2351 149 T 4.8689 8.3761 119.1949 61.3377 70.5633 174.4910 150 K 3.1231 7.5976 126.9786 56.1803 33.2046 175.9964 151 E 4.2585 9.4276 126.0924 55.0099 30.3807 177.0566 152 A 3.8995 8.8138 127.9484 55.3927 18.3244 177.9223 153 D 4.5768 7.9600 111.3495 53.9025 40.2358 176.2556 154 K 4.5764 8.0175 120.1585 55.3118 33.8736 176.0700 155 R 4.2996 8.3131 119.4718 56.7364 32.4568 175.9310 156 Y 5.1244 8.0034 115.7242 56.1285 41.1930 174.8849 157 L 5.2011 9.1136 123.4313 53.3474 45.5297 175.1085 158 A 5.1546 8.6899 126.7311 49.1704 23.1833 174.3904 159 F 4.6495 8.9619 119.9596 55.8461 41.6656 175.0810 160 V 4.9636 9.3369 124.6423 58.8177 32.3615 170.9408 161 P 4.5435 0.0000 0.0000 62.3814 32.2049 176.6454 162 L 4.3990 8.6476 124.3198 54.8475 42.0180 175.0182 *164 P 4.8560 0.0000 0.0000 62.7979 33.0328 175.9976 *166 H 4.8194 8.4592 118.4817 55.9576 30.4729 171.7123 167 L 5.1504 9.1433 126.5566 53.5751 44.6681 175.1484 168 T 4.8490 8.8531 122.3375 61.9561 71.6303 173.0249 169 L 4.4095 8.5547 128.2063 52.2085 42.2669 175.5730 170 P 4.3129 0.0000 0.0000 64.6751 32.1120 176.8107 171 D 4.8605 7.7604 117.6774 53.0637 39.4029 173.9029 172 E 4.7043 7.9707 119.2534 55.4410 33.4191 177.3520 173 K 3.8399 8.2126 121.6179 57.5114 31.5129 175.4294 174 Y 4.7733 7.7445 115.3535 55.8962 40.0990 175.1742 175 Q 4.8144 8.4297 122.3539 54.4450 32.0371 174.6667 176 L 4.5266 8.3662 118.8713 53.4292 46.6426 175.2125 177 D 4.7769 8.3837 121.4106 52.1690 43.1323 174.6280 178 A 3.8094 8.8234 130.6698 52.7411 17.1813 176.9156 179 A 4.2769 7.9248 121.1579 53.6294 19.6386 177.0469 180 Y 5.0261 8.7069 123.1924 55.7238 41.2415 174.3664 181 N 4.6176 7.6561 122.1408 50.8572 40.0812 174.4878 182 A 4.0735 7.4974 124.2675 51.9046 19.5374 175.2877 183 Y 4.6478 6.0860 112.6325 55.2428 40.7048 172.3643 184 P 4.5345 0.0000 0.0000 63.4015 31.8754 176.0170 185 I 4.4641 8.4463 122.8149 59.5272 42.0226 173.6353 186 S 4.6540 8.3748 123.3917 56.3496 62.9728 173.7827 187 W 4.5711 8.6602 129.5987 55.7630 27.2908 176.0474 188 A 4.1270 8.0130 124.8614 51.2885 19.6957 176.8699 189 S 3.7138 8.4034 111.5057 60.0076 60.1849 171.4130 190 N 5.3695 8.4324 122.0497 53.6796 41.9837 173.5324 191 E 5.1561 9.7779 116.2902 55.2518 34.4518 171.5165 192 F 4.4260 9.1090 119.6137 58.1118 39.9984 176.0401 193 S 4.5849 8.9068 117.2030 56.1976 62.0045 174.4483 194 G 4.1353 8.2632 115.6710 44.0316 0.0000 171.9908 195 N 4.4655 9.0951 119.5962 54.1145 38.0489 174.4091 196 T 5.1329 7.6716 106.3386 59.6110 72.2501 172.9691 197 G 4.5364 9.1971 106.7467 45.5669 0.0000 171.8600 198 H 5.9605 9.3251 118.6493 52.8977 32.4661 173.1735 199 F 5.0223 7.7966 111.9477 56.7876 40.2816 172.7949 200 S 5.4533 8.6359 114.3629 57.3175 66.8117 172.6866 201 F 5.9641 9.2985 115.5265 55.9245 41.2804 174.1644 202 D 4.9334 8.8613 118.2108 53.2336 40.1736 175.2650 203 A 4.4312 8.5384 120.3345 52.6235 22.4887 177.8514 204 G 3.8759 8.8708 106.9151 46.2953 0.0000 173.6225 205 V 4.8706 8.2027 120.4367 61.2017 35.2329 174.5748 206 L 4.8091 8.8589 129.6944 53.3008 44.1090 174.5671 207 A 5.0639 8.8034 128.1428 50.3466 21.6067 175.5707 208 V 4.3141 8.6818 122.3341 60.9366 34.3519 174.2531 209 I 4.8770 8.4675 128.8887 59.5874 40.2933 174.3807 210 Q 5.1914 8.6630 126.3264 54.2613 31.0280 175.0735 211 S 6.0123 9.1935 117.8980 55.8660 67.4088 172.4071 212 R 5.2418 8.3570 115.2382 55.3875 32.4109 174.1194 213 D 4.8033 8.8978 121.9923 54.2024 42.2763 177.3653 214 D 4.5870 8.3817 117.9796 53.5410 40.8299 175.4287 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 A 8.26 4.35 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 3 T 8.49 4.54 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 1.18 0.00 0.00 4 I 8.46 4.84 1.69 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 1.07 0.70 0.43 0.00 0.00 5 V 8.41 4.07 1.80 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 0.84 0.00 0.00 0.76 0.00 0.00 6 N 8.37 4.94 0.00 1.44 1.42 0.00 0.00 6.02 6.44 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 7 L 8.92 5.16 0.00 1.67 1.49 0.97 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 8 L 9.25 5.27 0.00 2.01 1.58 0.78 0.90 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 9 V 8.35 4.59 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 0.74 0.00 0.00 1.08 0.00 0.00 10 G 8.56 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 0.00 0.00 0.00 11 G 7.95 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 12 P 0.00 4.23 0.00 2.15 2.16 0.00 3.88 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 1.98 0.00 13 T 8.20 2.00 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 0.99 0.00 0.00 14 A 7.66 3.96 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 15 N 7.80 4.72 0.00 3.00 2.93 0.00 0.00 6.82 7.30 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 16 Y 7.50 4.84 0.00 3.02 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 17 P 0.00 4.41 0.00 2.32 2.48 0.00 4.05 0.00 0.00 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 2.38 0.00 18 A 7.36 4.30 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 19 D 8.21 4.42 0.00 2.77 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 20 L 8.58 3.77 0.00 1.26 0.75 0.10 0.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 21 T 7.79 4.06 4.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 22 T 7.84 4.19 4.47 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 1.23 0.00 0.00 23 I 7.49 4.28 2.24 0.00 0.00 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.55 0.82 0.00 0.00 24 P 0.00 4.30 0.00 2.02 1.97 0.00 3.66 0.00 0.00 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.09 0.00 25 G 8.69 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 26 P 0.00 4.44 0.00 2.06 2.14 0.00 3.71 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 1.93 1.91 0.00 27 W 8.77 5.19 0.00 3.22 3.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 V 9.11 4.78 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 1.06 0.00 0.00 0.89 0.00 0.00 29 G 8.71 4.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 A 8.70 5.40 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 31 D 9.83 4.25 0.00 2.88 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 0.00 0.00 0.00 32 R 9.02 4.11 0.00 1.93 2.00 0.00 3.21 0.00 0.00 3.37 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.75 0.00 33 G 8.30 3.70 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 0.00 34 A 8.10 3.89 0.98 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 35 L 7.82 3.85 0.00 1.86 1.73 0.94 1.23 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 36 R 8.16 3.92 0.00 1.99 1.99 0.00 3.20 0.00 0.00 3.27 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.80 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0.00 0.00 73 K 8.64 4.79 0.00 1.70 1.72 0.00 2.08 0.00 0.00 1.57 0.00 0.00 2.91 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.47 1.27 7.81 74 P 0.00 4.35 0.00 1.90 2.00 0.00 3.62 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 2.04 0.00 75 D 8.57 4.72 0.00 2.73 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 76 Q 8.69 4.20 0.00 2.05 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.09 7.11 0.00 0.00 0.00 0.00 0.00 2.31 2.41 0.00 77 D 8.55 4.91 0.00 2.67 2.69 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 78 H 7.90 5.21 0.00 3.23 3.30 0.00 5.90 0.00 0.00 0.00 0.00 6.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 T 8.89 4.25 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 1.23 0.00 0.00 80 D 8.53 4.40 0.00 2.93 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 81 T 7.80 3.96 4.19 0.00 0.00 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0.00 0.00 0.00 0.00 0.00 1.66 1.66 0.00 124 Q 7.69 3.93 0.00 1.69 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.49 6.63 0.00 0.00 0.00 0.00 0.00 1.88 1.86 0.00 125 W 7.99 4.52 0.00 3.57 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 0.00 126 A 8.11 4.06 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 0.00 127 P 0.00 4.39 0.00 2.08 2.13 0.00 3.80 0.00 0.00 4.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.11 0.00 128 Q 8.42 4.67 0.00 2.23 2.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.77 0.00 0.00 0.00 0.00 0.00 2.38 2.37 0.00 129 I 7.74 5.10 2.10 0.00 0.00 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.09 1.09 0.00 0.00 130 K 9.04 4.77 0.00 1.72 1.44 0.00 1.50 0.00 0.00 1.38 0.00 0.00 2.72 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.14 1.43 7.81 131 L 8.56 4.93 0.00 1.60 1.52 0.99 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 132 I 8.17 5.07 1.14 0.00 0.00 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.23 0.91 0.00 0.00 133 D 8.87 4.92 0.00 2.92 2.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 134 K 9.12 4.02 0.00 1.93 1.95 0.00 1.79 0.00 0.00 1.74 0.00 0.00 2.83 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.50 1.49 7.81 135 Q 8.20 4.64 0.00 2.16 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.12 6.57 0.00 0.00 0.00 0.00 0.00 2.39 2.37 0.00 136 N 9.51 5.77 0.00 2.61 2.62 0.00 0.00 6.40 7.45 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 0.00 137 S 8.70 4.96 0.00 3.80 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 0.00 138 V 8.93 4.71 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 0.46 0.00 0.00 0.84 0.00 0.00 139 R 8.37 4.74 0.00 1.73 1.44 0.00 3.11 0.00 0.00 3.23 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.46 0.00 140 F 8.27 5.51 0.00 3.08 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 0.00 141 F 9.41 5.03 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 0.00 142 L 8.80 5.17 0.00 1.70 1.70 1.00 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 143 P 0.00 2.97 0.00 1.82 1.71 0.00 3.88 0.00 0.00 4.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.09 0.00 144 G 6.25 3.57 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 0.00 0.00 0.00 145 D 7.38 5.02 0.00 2.24 2.35 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 0.00 146 Y 8.43 4.73 0.00 1.43 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 0.00 147 Q 8.58 4.94 0.00 1.82 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.43 6.79 0.00 0.00 0.00 0.00 0.00 2.22 2.28 0.00 148 I 9.17 4.92 2.17 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 1.69 1.29 1.31 0.00 0.00 149 T 8.38 4.87 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 1.17 0.00 0.00 150 K 7.60 3.12 0.00 0.79 1.15 0.00 1.66 0.00 0.00 1.51 0.00 0.00 2.99 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.16 1.06 7.81 151 E 9.43 4.26 0.00 2.11 1.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 2.23 0.00 152 A 8.81 3.90 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 0.00 153 D 7.96 4.58 0.00 2.80 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 0.00 154 K 8.02 4.58 0.00 1.81 1.90 0.00 1.59 0.00 0.00 1.72 0.00 0.00 3.18 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.45 1.60 7.81 155 R 8.31 4.30 0.00 1.04 0.68 0.00 3.05 0.00 0.00 3.03 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 1.43 0.00 156 Y 8.00 5.12 0.00 2.95 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 0.00 157 L 9.11 5.20 0.00 1.59 1.26 0.19 0.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.69 0.00 0.00 0.00 0.00 0.00 0.00 158 A 8.69 5.15 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 0.00 159 F 8.96 4.65 0.00 3.02 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 0.00 160 V 9.34 4.96 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.94 0.00 0.00 161 P 0.00 4.54 0.00 2.28 2.16 0.00 4.17 0.00 0.00 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 2.14 0.00 162 L 8.65 4.40 0.00 1.69 1.67 1.21 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 *164 P 0.00 4.86 0.00 1.98 1.91 0.00 3.74 0.00 0.00 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 1.84 0.00 *166 H 8.46 4.82 0.00 3.40 3.39 0.00 5.78 0.00 0.00 0.00 0.00 6.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 167 L 9.14 5.15 0.00 1.71 1.46 0.93 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 0.00 0.00 0.00 0.00 168 T 8.85 4.85 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 1.21 0.00 0.00 169 L 8.55 4.41 0.00 1.35 1.48 0.32 -0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 170 P 0.00 4.31 0.00 2.14 2.14 0.00 3.89 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.94 0.00 171 D 7.76 4.86 0.00 2.75 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 0.00 172 E 7.97 4.70 0.00 2.01 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 0.00 2.21 2.27 0.00 173 K 8.21 3.84 0.00 1.79 1.77 0.00 1.76 0.00 0.00 1.70 0.00 0.00 2.89 0.00 0.00 2.69 0.00 0.00 0.00 0.00 1.41 1.33 7.81 174 Y 7.74 4.77 0.00 2.92 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 0.00 175 Q 8.43 4.81 0.00 1.86 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.73 6.70 0.00 0.00 0.00 0.00 0.00 2.28 2.40 0.00 176 L 8.37 4.53 0.00 1.36 1.39 0.15 0.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.69 0.00 0.00 0.00 0.00 0.00 0.00 177 D 8.38 4.78 0.00 2.57 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 0.00 178 A 8.82 3.81 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 0.00 179 A 7.92 4.28 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 0.00 180 Y 8.71 5.03 0.00 2.90 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 0.00 181 N 7.66 4.62 0.00 2.54 2.72 0.00 0.00 6.05 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 0.00 182 A 7.50 4.07 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 0.00 183 Y 6.09 4.65 0.00 2.84 2.89 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 0.00 184 P 0.00 4.53 0.00 1.92 1.94 0.00 3.71 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 2.09 0.00 185 I 8.45 4.46 1.72 0.00 0.00 0.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.92 0.80 0.00 0.00 186 S 8.37 4.65 0.00 3.88 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 0.00 187 W 8.66 4.57 0.00 3.61 3.16 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 0.00 188 A 8.01 4.13 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 0.00 189 S 8.40 3.71 0.00 4.08 4.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 190 N 8.43 5.37 0.00 2.96 3.01 0.00 0.00 7.18 8.42 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 0.00 191 E 9.78 5.16 0.00 1.49 1.73 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 2.15 2.15 0.00 192 F 9.11 4.43 0.00 2.87 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 0.00 193 S 8.91 4.58 0.00 3.82 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 0.00 194 G 8.26 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 0.00 195 N 9.10 4.47 0.00 2.88 3.04 0.00 0.00 5.48 7.22 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 0.00 196 T 7.67 5.13 4.33 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 1.24 0.00 0.00 197 G 9.20 4.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 198 H 9.33 5.96 0.00 3.00 3.16 0.00 5.67 0.00 0.00 0.00 0.00 6.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 199 F 7.80 5.02 0.00 2.94 2.91 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 0.00 200 S 8.64 5.45 0.00 4.11 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 0.00 201 F 9.30 5.96 0.00 3.22 3.17 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 0.00 202 D 8.86 4.93 0.00 2.74 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 0.00 203 A 8.54 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 0.00 204 G 8.87 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 0.00 205 V 8.20 4.87 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 1.04 0.00 0.00 206 L 8.86 4.81 0.00 0.67 0.92 0.81 0.37 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 0.00 207 A 8.80 5.06 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 0.00 208 V 8.68 4.31 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 0.46 0.00 0.00 0.51 0.00 0.00 209 I 8.47 4.88 1.79 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 1.11 0.45 0.88 0.00 0.00 210 Q 8.66 5.19 0.00 2.05 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.58 0.00 0.00 0.00 0.00 0.00 2.43 2.34 0.00 211 S 9.19 6.01 0.00 4.03 4.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 212 R 8.36 5.24 0.00 1.82 1.94 0.00 3.05 0.00 0.00 3.38 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.72 0.00 213 D 8.90 4.80 0.00 2.78 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 0.00 214 D 8.38 4.59 0.00 2.64 2.36 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 * Residues marked with a * may have inaccurate shift predictions.