NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 L 4.2531 8.1844 122.5077 54.3094 43.4320 176.5157 2 N 4.1513 8.8520 123.1684 52.6526 39.5454 173.1023 3 Y 4.3469 9.2542 129.6541 60.9259 38.3294 178.3077 4 I 3.2304 6.1395 121.5970 63.7037 37.1175 177.8573 5 E 3.9382 8.5298 119.8695 58.9174 29.2274 178.0340 6 D 4.4054 8.2175 117.8062 58.0165 41.6441 177.8202 7 I 3.7340 8.7017 120.9795 64.5263 36.8992 178.1336 8 K 3.8590 8.0446 119.5208 59.6951 32.1843 177.8635 9 N 4.6955 8.1047 112.6465 53.0667 39.2019 174.7635 10 Y 4.0097 7.9590 121.7816 57.6369 39.2626 174.8585 11 I 4.1433 7.1870 128.0142 58.8865 37.5418 173.8889 12 P 4.4294 0.0000 0.0000 63.1315 31.7235 176.4130 13 F 4.4078 9.3821 125.2234 60.0761 40.0668 174.5363 14 N 4.8180 7.6035 115.3785 50.6632 40.2147 174.1595 15 E 3.9182 8.9023 116.6066 59.9690 29.3937 179.2167 16 Q 4.0339 8.1280 117.1144 59.5337 28.3711 178.4934 17 E 4.0246 8.6360 120.3603 58.8614 29.3549 179.0775 18 E 3.9563 8.0339 118.7772 59.5144 29.6861 179.6051 19 R 4.1008 8.3080 118.3067 59.5021 30.1965 178.8635 20 D 4.4986 8.4648 119.0617 57.3039 40.7785 178.8231 21 K 3.7564 8.4074 120.4515 59.5016 32.1957 178.6857 22 E 4.0231 8.0784 118.7636 59.3795 29.4433 179.1444 23 L 4.0992 8.0104 120.2448 57.8970 42.1502 179.0353 24 F 4.1029 8.5752 117.9520 60.5642 38.8577 177.5023 25 L 4.0652 8.2392 118.5482 57.9792 41.4160 179.4630 26 R 3.8493 8.0938 118.4969 59.8433 29.8093 178.3457 27 C 4.0895 8.0384 116.1956 62.6528 27.9166 175.9690 28 L 4.0803 7.8125 119.7674 57.8319 41.2574 179.1639 29 N 4.4477 8.1272 115.4883 56.6317 38.7113 177.0469 30 D 4.3019 8.1435 118.8664 55.0322 41.3911 176.6556 31 F 4.9408 7.5162 118.4096 55.5628 40.7375 175.2022 32 H 4.3385 8.3540 121.3272 58.2504 28.1999 174.7448 33 D 4.8648 7.8387 117.8628 52.1389 44.1735 174.2995 34 I 4.5778 8.3504 115.7226 60.5746 38.5638 176.6838 35 L 3.8356 8.7552 122.4223 55.8552 42.3953 176.1651 36 T 4.8229 7.4262 107.1607 59.4533 71.6422 174.5058 37 R 4.0771 8.2400 118.1267 56.9207 29.9158 177.8022 38 D 4.2646 8.0910 119.8409 56.4547 40.9255 175.9181 39 N 4.5183 7.7133 117.8532 52.3779 38.1462 174.7355 40 T 4.0803 8.2388 115.9323 63.0393 69.8874 175.6124 41 I 4.2092 7.6963 123.0409 63.1578 38.5321 175.3681 42 A 5.4378 7.9926 120.6096 51.5708 22.4314 175.0069 43 H 4.8558 8.2213 114.0795 53.9828 32.1674 172.7400 44 L 4.6517 9.2894 124.0202 55.9631 43.1593 175.9326 45 T 5.0356 8.7155 114.5228 60.3288 72.9616 172.3930 46 S 5.2514 8.8213 116.3094 56.8282 66.3207 172.7882 47 S 4.8532 9.1529 120.7510 56.4524 67.2986 172.4811 48 A 5.0455 8.3798 122.1388 50.4319 21.0975 177.1049 49 F 4.8803 9.4169 127.7221 57.0578 38.4591 172.7594 50 A 4.4694 8.1488 122.5700 51.3544 19.5369 176.7980 51 V 5.0385 8.6741 116.1953 59.9459 35.2131 175.9620 52 N 5.1147 8.3874 120.6408 51.4143 38.5377 176.1936 53 K 3.8219 8.3604 118.0180 59.6808 32.0296 178.3240 54 E 4.0221 7.8535 114.8986 56.2967 30.0694 176.2612 55 R 3.8058 7.6016 117.6181 57.4043 28.1692 176.0227 56 N 4.2551 8.6282 112.2559 51.5567 39.5684 175.1581 57 K 4.9948 7.6680 118.5837 54.4646 36.7470 174.7898 58 F 5.4813 9.6812 126.3467 56.3600 41.3142 174.3795 59 L 3.6979 8.7411 130.1123 54.7114 42.5545 176.2929 *61 I 4.2500 8.2199 118.3342 61.0904 39.3951 173.7028 62 H 3.8001 7.8679 124.5751 55.4808 30.6740 173.9291 63 H 4.6313 8.4495 123.3732 53.9330 30.0481 175.8061 64 N 4.4033 8.8095 120.4660 54.7308 39.5657 176.4851 65 I 4.0720 6.8244 124.0608 60.5616 37.3027 177.5938 66 Y 4.4223 8.0629 111.7669 59.4971 37.1746 175.1242 67 N 4.1074 7.7586 114.7780 55.0527 37.8816 172.1567 68 S 5.0499 7.2540 113.2334 56.3704 67.0258 173.0044 69 W 5.2341 8.6783 123.2558 55.0455 31.2321 174.9715 70 A 4.7662 9.1130 125.1752 49.9578 22.4531 175.3934 71 W 4.6763 8.3447 117.4895 56.7688 29.4637 175.9647 72 T 4.5024 8.6501 110.3748 60.6637 70.4863 174.3764 73 G 3.8591 8.0454 111.0763 46.2198 0.0000 171.2519 74 G 3.9288 7.3319 107.0493 45.3365 0.0000 172.5145 75 H 4.5642 8.1156 116.1143 55.4418 29.4641 177.4307 76 S 4.0713 8.6468 119.0054 60.3231 63.3454 174.5018 77 D 4.1186 8.1276 116.6485 55.3007 38.2843 174.0946 78 N 4.3535 8.4781 115.7600 53.4643 39.4513 173.2956 79 E 4.2072 8.2017 118.7629 56.3545 30.0019 176.3041 80 K 3.8187 8.4752 124.7181 58.2075 33.0207 175.7137 81 D 4.7403 8.4835 119.0617 53.5195 41.1378 176.6697 82 Q 3.9250 8.5501 127.5629 58.4583 28.7981 178.2399 83 L 2.7914 7.3441 121.8555 57.3732 41.9305 178.8556 84 K 3.8727 7.8948 119.3673 59.0906 32.0821 178.9297 85 V 3.4466 7.2980 118.5000 65.8560 31.4367 177.7891 86 A 3.9116 7.9186 120.6320 55.2974 18.2422 179.6311 87 I 3.5911 7.9444 118.6164 64.2692 37.1484 178.4197 88 K 3.8471 8.1305 120.4477 59.7185 31.9972 178.4625 89 E 3.9352 8.3561 118.8972 59.3564 29.3663 179.2298 90 L 3.9196 8.1961 120.4602 58.0651 42.1829 179.1147 91 K 3.9174 8.0424 118.2398 59.5763 31.8090 178.8985 92 E 3.9163 7.9512 117.1062 59.8455 29.5578 179.2721 93 E 4.1265 8.3818 117.5505 58.5807 29.6104 178.4854 94 T 4.5164 8.0103 107.4077 60.3858 70.2764 175.3075 95 G 3.8585 8.4123 109.4485 45.8280 0.0000 173.6612 96 V 3.7565 7.2474 119.1380 62.4693 31.9506 176.2695 97 K 4.1523 9.5391 128.4291 59.2057 32.4754 177.7304 98 N 5.0256 8.3122 115.5135 50.5385 38.5469 172.4853 99 P 4.6173 0.0000 0.0000 63.0002 33.1542 177.3750 100 T 4.6545 8.8543 118.6250 60.8906 71.3993 171.7505 101 P 4.7102 0.0000 0.0000 63.1014 31.4868 176.5213 102 L 4.4377 8.7864 121.9580 55.3453 42.6311 176.8726 103 L 4.8983 7.6330 116.5161 53.1459 45.2246 175.3797 104 D 4.9113 8.7884 119.9178 53.7080 41.2318 175.6342 105 K 4.8364 7.7780 114.8345 54.5095 35.7060 175.3488 106 A 3.1626 8.6007 122.3080 53.1036 18.4472 177.4709 107 F 4.8618 8.7358 123.2763 59.0465 40.7644 175.3696 108 A 4.8573 7.2124 117.8891 51.4692 22.5296 174.6669 109 L 4.8315 8.2504 121.1155 53.3033 45.0112 175.7552 110 D 5.0075 9.2772 124.9075 53.1254 45.9960 174.3519 111 V 4.8202 9.4025 124.1529 61.8164 32.2764 174.9519 112 L 5.0307 9.2189 128.7607 53.2232 44.7387 176.0435 113 T 4.5775 8.3563 111.4278 60.6941 71.2964 174.6993 114 V 4.1885 8.4394 122.3627 61.0542 34.1913 174.2967 115 N 4.6640 8.9294 125.7079 53.0936 39.1848 175.5279 116 G 3.9622 8.8891 109.3148 46.7742 0.0000 171.9729 117 H 4.8878 7.9422 117.1338 54.6651 32.6383 172.1584 118 I 4.6991 8.2949 119.9077 59.7645 38.4458 175.5817 119 K 4.2843 9.2907 128.7033 55.0695 33.4690 176.0815 120 R 3.9478 9.7487 128.4323 57.2770 27.6026 175.9858 121 G 4.2641 8.3957 106.0005 45.3487 0.0000 174.1462 122 K 4.3580 7.6151 118.4026 55.9295 33.7987 175.8474 123 Y 4.7399 8.5599 124.8441 56.6438 40.9196 174.1002 124 V 4.2541 7.8340 126.6226 60.7752 33.4003 175.1300 125 S 4.6773 8.6008 124.1366 58.5938 63.5764 174.7302 126 S 4.5867 8.6414 118.4749 59.9972 63.4729 173.3400 127 H 4.8026 8.8734 117.7236 55.1442 32.2848 171.7590 128 L 5.1566 8.8588 117.5973 53.4746 45.0581 175.5487 129 H 5.1989 9.6343 120.0659 54.3496 31.4166 173.9991 130 L 4.4267 8.5844 124.6536 53.5188 41.1873 173.8837 131 N 5.2934 9.6258 122.8119 52.3945 40.9341 173.1465 132 L 5.0303 8.7251 125.8525 53.3041 44.6245 175.4036 133 T 4.9407 8.5625 120.3470 61.9883 71.4682 172.9493 134 Y 4.8037 8.6212 122.6800 55.9479 41.3654 174.8579 135 L 4.5795 8.5979 125.8635 54.6633 43.2037 175.2086 136 I 4.8987 8.3065 127.3867 59.4050 40.9333 174.3008 137 E 5.0655 9.0616 127.8659 55.1718 31.4765 174.4699 138 C 5.3779 9.1268 123.4525 57.8271 32.8384 173.6493 139 S 4.3539 8.6966 117.3577 57.9460 63.5285 174.9321 140 E 4.1292 8.3678 122.7384 58.1036 29.3475 177.5298 141 D 4.5143 7.3507 118.9141 55.9367 41.2748 176.8518 142 E 4.0977 7.9680 119.7487 56.3608 29.8717 176.8291 143 T 4.0715 8.5220 120.7181 63.5055 68.9656 174.0186 144 L 4.8250 8.2645 125.8929 52.7019 44.8674 175.7333 *146 L 4.2227 7.8812 118.1173 56.5186 41.1638 175.6947 147 K 4.3050 8.0913 115.3956 56.8553 34.7294 176.2870 148 E 4.1183 8.6281 125.4646 55.1902 27.7654 175.6646 *153 G 3.6901 7.8163 110.1118 45.1016 0.0000 169.8892 154 V 4.6239 8.1046 121.1222 60.4184 34.2784 174.5517 *156 W 4.4793 8.1537 120.9962 56.4730 30.2755 175.1133 157 I 4.3159 8.4334 124.7731 58.5197 39.6544 173.4109 158 P 4.6370 0.0000 0.0000 62.7500 31.6325 177.5072 159 F 4.6338 9.0142 123.0859 61.0670 39.0529 177.1470 160 N 4.7651 8.3384 114.9568 54.3372 37.5728 175.0182 161 E 4.7513 8.5115 117.7417 56.0682 31.2206 177.5054 162 I 3.8207 7.8623 121.7612 64.5256 37.2485 178.6249 163 S 4.1938 8.1349 113.1663 60.8385 62.8341 175.2581 164 K 4.1455 8.0483 119.3041 57.7169 32.2357 177.0197 165 Y 4.4678 8.0625 116.2429 58.5224 39.3413 175.0762 166 C 4.6300 8.1921 120.4973 58.7626 31.9413 173.0096 167 S 4.4852 8.6499 121.4062 58.4571 63.4262 174.0654 168 E 4.4117 7.8862 121.2807 54.3771 28.8854 173.5361 169 P 4.3875 0.0000 0.0000 65.9291 31.6399 178.4064 170 H 4.4422 7.8881 113.3859 55.5009 28.2261 176.5211 *172 I 4.2443 7.8729 121.4942 62.1707 39.2039 176.9028 173 P 4.5405 0.0000 0.0000 64.6699 30.9543 178.8791 174 I 3.5406 7.2638 118.5041 64.5813 37.1341 177.7008 175 Y 4.3201 7.1299 116.8984 61.3079 37.2025 178.5773 176 E 4.0006 8.3461 119.4666 59.0473 29.4149 179.1594 177 K 3.9112 8.0270 119.6976 59.4916 32.2158 178.3836 178 L 3.8095 7.7652 119.0967 58.2685 41.5319 179.9908 179 I 3.6146 7.5453 118.9081 64.0799 36.9213 178.3734 180 N 4.4421 8.0345 117.6328 55.9364 38.3421 177.3299 181 K 3.5063 7.6498 120.1839 59.1619 32.1911 178.1366 182 L 4.3644 8.1368 119.6951 58.3995 42.1279 178.6994 183 K 4.1527 7.8771 116.9722 59.1321 32.0620 177.5571 184 T 4.3885 7.6751 113.0604 61.9022 69.1807 174.3680 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ 1 L 8.18 4.25 0.00 1.82 2.00 0.97 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 2 N 8.85 4.15 0.00 2.93 2.76 0.00 0.00 6.90 6.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3 Y 9.25 4.35 0.00 3.50 3.41 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 4 I 6.14 3.23 1.49 0.00 0.00 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.85 -0.36 0.76 0.00 0.00 5 E 8.53 3.94 0.00 2.11 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 2.32 2.31 0.00 6 D 8.22 4.41 0.00 2.99 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 7 I 8.70 3.73 2.09 0.00 0.00 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 1.28 1.08 0.00 0.00 8 K 8.04 3.86 0.00 1.84 1.91 0.00 1.67 0.00 0.00 1.70 0.00 0.00 3.00 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.50 1.57 7.81 9 N 8.10 4.70 0.00 2.87 2.86 0.00 0.00 7.01 7.08 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 10 Y 7.96 4.01 0.00 3.13 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 11 I 7.19 4.14 1.55 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.66 0.76 0.00 0.00 12 P 0.00 4.43 0.00 2.12 2.11 0.00 3.55 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.13 0.00 13 F 9.38 4.41 0.00 2.84 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 14 N 7.60 4.82 0.00 2.88 2.76 0.00 0.00 6.28 7.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 15 E 8.90 3.92 0.00 1.98 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 2.38 2.29 0.00 16 Q 8.13 4.03 0.00 2.34 2.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.92 0.00 0.00 0.00 0.00 0.00 2.43 2.85 0.00 17 E 8.64 4.02 0.00 2.30 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.67 0.00 18 E 8.03 3.96 0.00 2.23 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.47 2.47 0.00 19 R 8.31 4.10 0.00 1.82 2.00 0.00 3.30 0.00 0.00 3.18 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.83 0.00 20 D 8.46 4.50 0.00 2.86 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 21 K 8.41 3.76 0.00 1.86 1.97 0.00 1.81 0.00 0.00 1.67 0.00 0.00 2.97 0.00 0.00 3.24 0.00 0.00 0.00 0.00 1.46 1.45 7.81 22 E 8.08 4.02 0.00 2.25 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.61 0.00 23 L 8.01 4.10 0.00 1.85 2.00 0.98 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 24 F 8.58 4.10 0.00 3.32 3.18 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 25 L 8.24 4.07 0.00 1.90 1.76 0.95 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 26 R 8.09 3.85 0.00 2.08 2.12 0.00 3.12 0.00 0.00 3.13 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.79 0.00 27 C 8.04 4.09 0.00 3.34 3.21 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 0.00 28 L 7.81 4.08 0.00 1.86 1.77 0.99 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 29 N 8.13 4.45 0.00 2.81 2.82 0.00 0.00 7.12 8.32 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 30 D 8.14 4.30 0.00 1.94 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 31 F 7.52 4.94 0.00 3.18 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 32 H 8.35 4.34 0.00 3.29 3.53 0.00 5.71 0.00 0.00 0.00 0.00 6.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 D 7.84 4.86 0.00 2.64 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 34 I 8.35 4.58 1.87 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.86 1.03 0.00 0.00 35 L 8.76 3.84 0.00 1.79 1.60 0.82 0.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 36 T 7.43 4.82 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 1.25 0.00 0.00 37 R 8.24 4.08 0.00 1.71 1.88 0.00 3.04 0.00 0.00 2.96 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 1.61 0.00 38 D 8.09 4.26 0.00 2.59 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 39 N 7.71 4.52 0.00 2.73 2.72 0.00 0.00 7.23 7.25 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 40 T 8.24 4.08 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 1.16 0.00 0.00 41 I 7.70 4.21 1.55 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 1.30 0.67 1.06 0.00 0.00 42 A 7.99 5.44 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 0.00 0.00 0.00 0.00 0.00 43 H 8.22 4.86 0.00 3.24 3.36 0.00 5.66 0.00 0.00 0.00 0.00 6.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 L 9.29 4.65 0.00 1.83 1.49 0.96 0.34 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 45 T 8.72 5.04 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 0.82 0.00 0.00 46 S 8.82 5.25 0.00 3.92 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 47 S 9.15 4.85 0.00 2.72 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 48 A 8.38 5.05 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 49 F 9.42 4.88 0.00 3.08 2.95 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 50 A 8.15 4.47 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 51 V 8.67 5.04 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 -0.49 0.00 0.00 0.73 0.00 0.00 52 N 8.39 5.11 0.00 2.03 1.64 0.00 0.00 6.88 6.56 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 53 K 8.36 3.82 0.00 1.62 1.83 0.00 1.63 0.00 0.00 1.63 0.00 0.00 2.92 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.52 1.33 7.81 54 E 7.85 4.02 0.00 1.74 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 2.29 0.00 55 R 7.60 3.81 0.00 1.95 2.04 0.00 3.08 0.00 0.00 3.27 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.66 0.00 56 N 8.63 4.26 0.00 2.46 2.75 0.00 0.00 6.82 6.54 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 57 K 7.67 4.99 0.00 1.70 2.00 0.00 1.37 0.00 0.00 1.63 0.00 0.00 2.67 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.33 1.17 7.81 58 F 9.68 5.48 0.00 3.61 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 59 L 8.74 3.70 0.00 0.27 1.14 -0.19 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 *61 I 8.22 4.25 1.74 0.00 0.00 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.88 0.91 0.00 0.00 62 H 7.87 3.80 0.00 1.40 2.45 0.00 5.93 0.00 0.00 0.00 0.00 6.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 H 8.45 4.63 0.00 2.89 3.03 0.00 5.68 0.00 0.00 0.00 0.00 6.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 N 8.81 4.40 0.00 2.61 2.80 0.00 0.00 7.11 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 65 I 6.82 4.07 1.63 0.00 0.00 0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 -0.36 0.83 0.00 0.00 66 Y 8.06 4.42 0.00 3.07 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 67 N 7.76 4.11 0.00 2.82 2.86 0.00 0.00 6.97 7.63 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 68 S 7.25 5.05 0.00 3.99 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 69 W 8.68 5.23 0.00 3.13 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 70 A 9.11 4.77 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 71 W 8.34 4.68 0.00 3.68 3.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 T 8.65 4.50 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 1.25 0.00 0.00 73 G 8.05 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 G 7.33 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 0.00 0.00 0.00 75 H 8.12 4.56 0.00 3.34 3.20 0.00 5.82 0.00 0.00 0.00 0.00 6.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 S 8.65 4.07 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 77 D 8.13 4.12 0.00 2.66 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 78 N 8.48 4.35 0.00 2.75 2.94 0.00 0.00 6.97 7.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 E 8.20 4.21 0.00 1.94 1.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 2.36 0.00 80 K 8.48 3.82 0.00 1.90 1.96 0.00 1.76 0.00 0.00 1.81 0.00 0.00 3.12 0.00 0.00 3.23 0.00 0.00 0.00 0.00 1.39 1.38 7.81 81 D 8.48 4.74 0.00 2.72 2.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 Q 8.55 3.93 0.00 2.29 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.12 6.68 0.00 0.00 0.00 0.00 0.00 2.57 2.51 0.00 83 L 7.34 2.79 0.00 1.14 1.57 0.75 0.50 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 84 K 7.89 3.87 0.00 1.78 1.90 0.00 1.74 0.00 0.00 1.70 0.00 0.00 2.85 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.45 1.43 7.81 85 V 7.30 3.45 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 0.98 0.00 0.00 0.91 0.00 0.00 86 A 7.92 3.91 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 87 I 7.94 3.59 1.84 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 1.55 1.11 0.88 0.00 0.00 88 K 8.13 3.85 0.00 1.84 1.98 0.00 1.61 0.00 0.00 1.61 0.00 0.00 3.00 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.41 1.46 7.81 89 E 8.36 3.94 0.00 2.18 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 2.30 2.52 0.00 90 L 8.20 3.92 0.00 1.83 1.82 0.90 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 91 K 8.04 3.92 0.00 2.01 1.83 0.00 1.72 0.00 0.00 1.64 0.00 0.00 2.94 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.57 1.64 7.81 92 E 7.95 3.92 0.00 2.15 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.39 0.00 93 E 8.38 4.13 0.00 2.00 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 2.34 2.47 0.00 94 T 8.01 4.52 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 1.15 0.00 0.00 95 G 8.41 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 96 V 7.25 3.76 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 0.87 0.00 0.00 0.95 0.00 0.00 97 K 9.54 4.15 0.00 1.84 1.85 0.00 1.72 0.00 0.00 1.71 0.00 0.00 2.97 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.59 1.56 7.81 98 N 8.31 5.03 0.00 2.66 2.72 0.00 0.00 7.19 8.58 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 99 P 0.00 4.62 0.00 2.07 2.06 0.00 3.80 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.99 0.00 100 T 8.85 4.65 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 1.21 0.00 0.00 101 P 0.00 4.71 0.00 2.24 2.07 0.00 3.75 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.00 0.00 102 L 8.79 4.44 0.00 1.58 1.73 0.80 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 103 L 7.63 4.90 0.00 1.70 1.65 1.01 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 104 D 8.79 4.91 0.00 2.68 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 0.00 105 K 7.78 4.84 0.00 2.12 1.83 0.00 1.74 0.00 0.00 1.78 0.00 0.00 3.09 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.41 1.55 7.81 106 A 8.60 3.16 1.05 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 0.00 107 F 8.74 4.86 0.00 2.96 3.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 108 A 7.21 4.86 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 0.00 109 L 8.25 4.83 0.00 0.58 0.96 0.25 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.33 0.00 0.00 0.00 0.00 0.00 0.00 110 D 9.28 5.01 0.00 2.76 2.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 V 9.40 4.82 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.81 0.00 0.00 1.25 0.00 0.00 112 L 9.22 5.03 0.00 1.66 1.61 1.26 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 113 T 8.36 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 1.18 0.00 0.00 114 V 8.44 4.19 1.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.90 0.00 0.00 0.46 0.00 0.00 115 N 8.93 4.66 0.00 2.67 2.78 0.00 0.00 7.12 7.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 116 G 8.89 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 0.00 117 H 7.94 4.89 0.00 3.22 3.36 0.00 5.45 0.00 0.00 0.00 0.00 6.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 I 8.29 4.70 1.93 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.78 1.00 0.00 0.00 119 K 9.29 4.28 0.00 1.74 1.64 0.00 1.79 0.00 0.00 1.62 0.00 0.00 2.85 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.30 1.36 7.81 120 R 9.75 3.95 0.00 1.95 1.94 0.00 3.25 0.00 0.00 3.22 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.59 0.00 121 G 8.40 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 0.00 0.00 0.00 0.00 122 K 7.62 4.36 0.00 1.81 1.73 0.00 1.69 0.00 0.00 1.59 0.00 0.00 2.82 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.45 1.52 7.81 123 Y 8.56 4.74 0.00 3.08 2.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 124 V 7.83 4.25 1.48 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 0.79 0.00 0.00 0.77 0.00 0.00 125 S 8.60 4.68 0.00 3.81 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 0.00 126 S 8.64 4.59 0.00 3.79 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 127 H 8.87 4.80 0.00 3.20 3.50 0.00 5.21 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 0.00 128 L 8.86 5.16 0.00 1.54 1.56 0.95 1.18 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 0.00 129 H 9.63 5.20 0.00 2.94 3.18 0.00 5.62 0.00 0.00 0.00 0.00 6.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 130 L 8.58 4.43 0.00 1.21 0.13 0.61 -0.21 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 0.00 131 N 9.63 5.29 0.00 2.86 2.94 0.00 0.00 6.96 6.23 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 0.00 132 L 8.73 5.03 0.00 1.78 1.39 1.10 0.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 133 T 8.56 4.94 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 1.41 0.00 0.00 134 Y 8.62 4.80 0.00 2.93 2.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 135 L 8.60 4.58 0.00 1.01 1.38 0.36 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 136 I 8.31 4.90 1.87 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.73 0.88 0.00 0.00 137 E 9.06 5.07 0.00 1.98 1.88 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 2.23 2.37 0.00 138 C 9.13 5.38 0.00 3.31 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 0.00 139 S 8.70 4.35 0.00 3.98 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 0.00 140 E 8.37 4.13 0.00 1.69 1.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.72 0.00 141 D 7.35 4.51 0.00 2.84 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 0.00 142 E 7.97 4.10 0.00 2.17 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 2.41 2.60 0.00 143 T 8.52 4.07 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 1.23 0.00 0.00 144 L 8.26 4.83 0.00 1.65 1.59 1.03 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 *146 L 7.88 4.22 0.00 1.76 1.79 1.00 0.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 147 K 8.09 4.30 0.00 1.82 1.78 0.00 1.72 0.00 0.00 2.03 0.00 0.00 2.93 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.27 1.40 7.81 148 E 8.63 4.12 0.00 1.95 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.34 0.00 *153 G 7.82 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 0.00 154 V 8.10 4.62 2.11 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 0.80 0.00 0.00 0.99 0.00 0.00 *156 W 8.15 4.48 0.00 3.18 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 0.00 157 I 8.43 4.32 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 0.00 0.18 0.43 0.66 0.00 0.00 158 P 0.00 4.64 0.00 2.14 1.99 0.00 3.64 0.00 0.00 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.11 0.00 159 F 9.01 4.63 0.00 3.14 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 0.00 160 N 8.34 4.77 0.00 2.90 3.03 0.00 0.00 5.80 7.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 161 E 8.51 4.75 0.00 2.17 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 2.23 2.29 0.00 162 I 7.86 3.82 1.98 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 1.39 1.08 0.85 0.00 0.00 163 S 8.13 4.19 0.00 4.01 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 0.00 164 K 8.05 4.15 0.00 1.63 1.66 0.00 1.62 0.00 0.00 1.62 0.00 0.00 2.96 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.41 1.38 7.81 165 Y 8.06 4.47 0.00 3.06 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 0.00 166 C 8.19 4.63 0.00 3.07 2.95 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 0.00 167 S 8.65 4.49 0.00 4.10 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 0.00 168 E 7.89 4.41 0.00 1.89 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 2.32 2.36 0.00 169 P 0.00 4.39 0.00 2.04 2.14 0.00 3.71 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 2.11 0.00 170 H 7.89 4.44 0.00 3.22 3.33 0.00 5.56 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 *172 I 7.87 4.24 2.01 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 1.44 0.82 0.96 0.00 0.00 173 P 0.00 4.54 0.00 2.09 2.07 0.00 3.89 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.01 0.00 174 I 7.26 3.54 0.95 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 1.42 0.43 0.68 0.00 0.00 175 Y 7.13 4.32 0.00 3.08 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 0.00 176 E 8.35 4.00 0.00 2.17 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.38 2.65 0.00 177 K 8.03 3.91 0.00 1.90 2.00 0.00 1.81 0.00 0.00 1.80 0.00 0.00 2.91 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.21 1.49 7.81 178 L 7.77 3.81 0.00 1.09 0.36 0.92 0.78 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 0.00 179 I 7.55 3.61 1.87 0.00 0.00 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.47 0.94 0.79 0.00 0.00 180 N 8.03 4.44 0.00 3.03 3.07 0.00 0.00 6.50 6.42 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 0.00 181 K 7.65 3.51 0.00 0.79 1.48 0.00 0.91 0.00 0.00 0.61 0.00 0.00 2.57 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.07 0.77 7.81 182 L 8.14 4.36 0.00 2.09 2.05 0.91 1.10 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 0.00 183 K 7.88 4.15 0.00 2.05 1.96 0.00 1.84 0.00 0.00 1.85 0.00 0.00 3.25 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.62 1.94 7.81 184 T 7.68 4.39 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 1.32 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.