NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 5 R 3.8215 8.2393 120.9132 55.0555 30.5191 173.6624 6 Q 4.2825 7.3391 116.9517 53.6393 31.4152 169.4544 7 V 4.0914 9.0932 120.5162 63.0481 33.0332 176.4518 8 L 4.8347 8.9193 127.6052 53.1494 44.6046 175.4281 9 K 5.1734 8.5001 119.5629 55.0219 35.3302 175.5960 10 T 4.7120 8.8720 113.6313 59.3984 71.9342 173.2381 11 D 4.5506 8.8724 120.2690 57.4208 40.5678 178.3258 12 R 4.5791 8.4960 113.8145 55.6160 32.0030 175.6658 13 L 5.0761 7.7348 117.4892 52.7634 46.1516 175.4624 14 V 4.5611 8.4153 122.1033 61.5177 33.5632 174.4706 15 L 5.2657 9.0654 128.9711 53.3592 43.5017 174.9677 16 E 4.9959 9.1852 125.9977 53.3637 32.2402 173.3035 17 P 3.9499 0.0000 0.0000 63.0273 31.8014 176.0982 18 Q 3.3759 8.5844 124.5627 55.0737 29.1385 173.7934 19 S 4.4643 8.5667 119.6221 58.2000 65.6258 175.6122 *21 A 4.3623 9.0124 119.1095 52.0409 19.8783 178.5918 22 R 4.5425 7.5239 113.5518 56.2540 30.6767 178.4815 23 F 4.4993 8.5797 122.4016 62.1527 39.3839 176.5310 24 D 4.0293 8.3820 117.6359 57.2543 40.3962 178.6061 25 Q 3.9217 7.9426 118.8903 58.9719 29.3252 177.5047 26 W 4.3197 8.3239 128.4767 60.3645 31.1018 177.3667 27 F 4.1225 9.1650 121.4549 60.9138 38.4965 177.6485 28 A 3.6905 7.7051 118.5136 52.3543 18.1078 179.0575 *30 E 4.0345 8.1770 122.2248 58.0392 31.3786 178.8539 31 R 3.8651 7.5759 116.2315 58.7263 30.1133 177.4538 32 Q 4.1221 7.4446 114.7035 55.8082 28.9217 175.6628 33 R 4.2101 7.4173 119.7578 54.9280 29.4867 176.0984 34 D 4.6208 8.3036 126.6854 52.6401 39.6687 173.8229 35 E 4.5684 8.0519 120.8579 53.9863 32.8841 174.2460 36 A 4.0912 8.7218 128.5238 54.4240 18.5259 177.6585 37 G 4.0320 10.1234 111.8727 45.6440 0.0000 172.9659 38 H 4.6808 7.7881 114.5820 57.0937 31.3279 175.7433 39 R 4.0848 8.2591 116.0981 58.5998 29.2574 177.1442 40 D 4.8730 7.8444 115.1530 52.5982 39.7753 176.1162 41 L 4.3297 7.5712 120.3353 55.2707 42.2361 177.8573 42 T 4.4032 8.6675 113.8630 61.0975 71.0232 175.6210 43 E 3.1871 8.7025 121.7014 59.3363 29.6682 178.3638 44 D 4.3364 8.0481 117.6181 57.3494 41.3639 178.1225 45 Q 4.0647 8.2120 118.4101 58.7432 28.7337 178.4112 46 A 4.3116 8.2693 121.9061 55.1292 18.4674 179.3232 47 W 3.9987 8.6743 127.2109 60.8430 30.7609 178.1756 48 L 4.0950 8.3592 118.6030 57.2495 40.9957 179.5381 49 R 3.8778 8.1421 119.1498 59.3310 30.1236 178.2122 50 L 3.4228 7.9283 120.1413 58.1089 41.9614 178.4843 51 C 3.6787 7.9442 116.8220 62.8870 27.7979 176.1483 52 A 3.9861 7.5129 120.9381 54.9968 17.9854 179.5592 53 R 3.9393 7.5180 116.0354 59.5046 30.4401 178.7729 54 Q 4.3936 8.1112 119.5107 58.6686 28.9585 178.7326 55 G 3.6960 8.0070 105.6223 44.6682 0.0000 175.4799 *57 W 4.8439 7.9798 121.8916 56.5310 31.1873 177.2304 58 D 4.2984 8.3190 116.0018 57.3504 40.6523 177.5351 59 A 3.8244 7.7998 120.3065 54.1625 18.3756 177.5594 60 Y 4.4468 7.1429 109.0883 56.2728 39.9158 175.1887 61 A 4.1766 8.2524 121.4094 52.5545 16.7410 176.6830 62 C 4.4094 7.2132 117.0453 59.3965 35.3811 174.0722 63 G 3.4726 6.8021 112.3771 46.8843 0.0000 171.5445 64 F 5.1855 8.0510 119.2462 56.6810 41.5011 174.7068 65 Y 5.1845 9.0917 119.7860 56.4023 41.3768 174.7894 66 Y 4.9759 9.2408 120.8147 57.9996 39.6726 174.7363 67 L 5.0514 8.9241 123.9766 53.5548 42.9135 175.8540 68 L 4.9775 8.9709 124.9013 52.4574 44.9389 175.8373 69 D 4.6089 9.3136 123.4379 54.0304 41.7205 175.0838 70 P 4.1892 0.0000 0.0000 65.9275 31.7284 178.0291 71 V 3.7153 7.9827 115.9947 65.8177 31.8624 177.0273 72 S 4.3413 9.1588 113.9169 58.1098 63.6115 176.0195 73 G 3.9974 8.1149 108.2103 45.4280 0.0000 176.0636 74 E 4.2753 7.2310 121.8872 55.7090 29.1328 178.6114 *76 R 4.2596 8.6461 115.9081 54.7242 32.2695 176.0590 77 G 4.2471 6.9086 105.3439 45.5109 0.0000 171.3929 78 E 5.1314 8.3110 116.4337 55.5958 32.7743 173.6858 79 A 4.3315 7.8979 121.1792 51.6297 23.5546 174.8382 80 G 3.6178 6.1159 108.3042 44.5972 0.0000 173.5229 81 F 5.5191 8.9364 123.7925 55.6275 42.6724 174.0602 82 Q 4.9164 9.2442 119.5063 54.6362 32.9046 173.6858 83 F 4.6226 8.6440 117.0544 55.7889 41.5702 174.8692 84 R 4.6919 8.4687 121.6343 53.8456 34.5121 175.3046 85 R 5.1019 7.8984 117.1196 55.1780 30.2429 176.3123 86 R 3.7354 7.4378 115.9631 57.3521 30.8357 178.1983 87 G 3.9075 8.4577 106.4465 45.7488 0.0000 173.4410 88 F 4.8036 7.8675 116.1706 57.1568 39.1938 177.2577 89 G 4.1142 8.2192 108.3246 44.2326 0.0000 173.4169 90 P 4.3516 0.0000 0.0000 65.0836 31.2456 177.5081 91 G 4.0055 8.1637 105.8843 46.0018 0.0000 173.3223 92 F 4.5804 8.2093 119.9887 59.7018 41.5581 174.7060 93 D 4.7083 8.3929 118.8621 55.4756 41.0235 175.2395 94 N 4.2244 8.4867 118.5477 55.1045 38.1062 173.4213 95 H 4.9450 7.2450 109.6263 52.4357 32.0505 172.6246 96 P 3.1919 0.0000 0.0000 63.1596 32.4940 174.6075 97 E 4.8796 8.5504 126.5817 54.0513 31.6332 174.7865 98 A 4.8087 9.0159 129.9874 51.9631 19.4348 176.2401 99 A 4.3562 9.0330 122.9628 50.5729 23.4102 174.8266 100 W 5.4586 7.8677 113.7420 55.9114 31.0621 174.1907 101 A 4.6223 9.2837 123.3003 51.3198 22.3988 175.2751 102 V 4.6073 8.5707 123.1033 61.0994 33.2481 175.4356 103 A 4.0513 8.5183 129.0179 52.7506 18.9142 178.5298 104 S 3.9983 9.0516 117.1265 61.8813 62.9621 176.2267 105 A 4.1181 7.9283 119.7674 54.0964 18.2751 177.3596 106 H 4.9351 8.0719 111.7236 55.3310 29.6149 174.2663 107 Q 4.1341 8.0092 118.4378 57.0531 29.0832 176.0764 108 G 3.8995 8.7709 107.1870 46.7290 0.0000 174.3144 109 R 4.3863 8.0333 115.2775 55.1432 30.7046 176.5850 110 G 3.9360 8.1750 105.3852 46.7231 0.0000 176.1414 111 L 3.9495 7.9085 121.9421 57.3888 41.3224 179.1009 112 A 3.8449 7.8475 119.1029 54.9562 18.4494 179.1101 113 A 3.8005 7.6174 117.6397 55.1937 18.9567 178.9655 114 E 3.9839 8.1370 117.6390 59.2158 29.6817 178.6957 115 A 4.0390 7.8702 116.8434 53.3011 17.9403 178.7824 *117 Q 4.0950 7.9424 119.3598 56.8739 30.9590 177.6126 118 A 4.0001 7.6970 118.9071 55.1707 18.2441 179.7423 119 L 3.9965 7.9383 117.4979 57.8552 41.6388 179.7203 120 L 4.2527 7.9691 118.3472 57.7635 41.2885 179.2100 121 A 4.0210 8.1175 120.8443 55.2386 18.4306 179.0884 122 H 4.1140 8.3538 116.7446 59.9073 29.8158 176.9187 123 H 4.0367 8.5715 118.8474 59.3784 29.6088 176.4784 124 D 4.5057 8.2250 120.4307 57.4516 40.6956 178.7276 125 R 4.0050 7.4698 117.0433 59.3853 30.2781 178.7987 126 S 3.9878 7.6029 113.9011 60.6287 63.2680 174.9893 *130 Q 4.0214 7.4396 120.2987 55.2851 29.7435 174.2912 131 R 4.2069 8.4541 125.0236 56.4724 30.8869 175.5447 132 V 4.6629 8.4155 125.3331 61.2417 34.8816 174.5614 133 V 5.2893 8.3268 118.4785 60.0517 35.6799 174.0089 134 A 4.7817 9.0937 121.7865 51.0928 23.1087 175.1539 135 L 5.1154 8.4473 121.0480 53.4952 44.2526 175.7589 136 I 4.7348 8.3883 126.2938 59.0984 41.7279 174.8776 137 A 3.9909 8.4333 127.6798 51.5518 18.8276 178.5746 138 R 3.7581 8.7208 123.4976 59.1256 30.2157 177.5983 139 S 4.4143 7.8073 109.6139 58.8986 64.2222 174.3662 140 N 4.6534 7.8946 122.7670 51.9609 37.4046 174.6902 141 L 4.0066 8.0726 123.5187 57.4300 42.2651 177.3217 142 P 4.3220 0.0000 0.0000 65.5678 31.3077 178.8080 143 S 4.4149 8.1253 114.1342 61.7323 62.7007 176.7482 144 L 4.0680 8.1960 121.6372 57.8934 41.2909 179.8777 145 R 3.9453 8.0660 117.9782 59.0890 29.9411 178.8972 146 L 3.8643 8.1525 119.8976 58.0153 42.1434 178.5457 147 A 4.1739 8.3546 120.9168 55.6409 18.3090 179.5235 148 E 4.6170 8.4603 118.2418 59.2301 29.3066 179.6719 149 R 3.9747 8.0533 117.3043 59.3139 30.2673 178.5075 150 L 4.2637 8.0147 116.5037 55.4236 41.8081 177.8481 151 G 4.0055 7.9110 107.0252 44.7759 0.0000 174.0559 152 F 4.7366 8.5574 119.5942 57.1888 40.4791 174.8430 153 R 4.9853 9.1705 118.2569 54.0697 32.9012 174.9836 154 G 4.2996 8.8792 108.5696 47.1191 0.0000 172.8050 155 Y 5.1365 8.6218 116.9700 56.8155 41.5348 174.2365 156 S 4.5881 7.3313 113.8124 57.2987 66.1447 172.0241 157 D 5.2606 8.1301 121.1057 51.9073 42.4832 175.2421 158 V 4.3846 8.1718 110.8535 60.1799 36.5869 172.8807 159 A 4.9801 8.4627 125.9632 51.1745 19.9941 176.7050 160 F 4.8540 9.2025 123.3421 57.9860 42.8684 173.5570 161 D 4.0954 8.8560 124.7416 55.2483 39.3254 174.2940 162 G 3.8691 8.5410 102.2720 45.4883 0.0000 173.4600 163 A 4.6712 7.9979 121.2707 49.6266 22.5727 175.5260 164 A 4.4504 8.4519 121.6494 52.4413 19.5808 176.6269 165 H 5.2091 9.8478 120.1214 53.8582 33.4558 172.5416 166 L 5.0002 8.7008 120.1814 52.9731 44.4578 175.7712 167 L 4.5219 8.0510 123.7725 54.0362 42.8409 176.0278 168 L 5.7707 9.4000 123.7896 53.1156 45.8540 175.2408 169 E 5.3685 9.5216 117.6954 54.9881 33.7424 174.0378 170 R 4.6191 9.2104 122.2843 53.9012 32.7857 175.4188 171 A 4.0810 8.6135 128.1126 52.6746 18.3221 176.7469 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 5 R 8.24 3.82 0.00 2.02 1.96 0.00 3.34 0.00 0.00 3.12 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.50 0.00 6 Q 7.34 4.28 0.00 2.25 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.49 6.80 0.00 0.00 0.00 0.00 0.00 2.30 2.48 0.00 7 V 9.09 4.09 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 0.83 0.00 0.00 0.94 0.00 0.00 8 L 8.92 4.83 0.00 1.54 1.48 0.68 0.39 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 9 K 8.50 5.17 0.00 1.59 1.66 0.00 1.69 0.00 0.00 1.76 0.00 0.00 3.01 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.33 1.40 7.81 10 T 8.87 4.71 4.28 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 1.17 0.00 0.00 11 D 8.87 4.55 0.00 2.79 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 12 R 8.50 4.58 0.00 1.85 1.92 0.00 3.10 0.00 0.00 3.22 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.54 0.00 13 L 7.73 5.08 0.00 1.53 1.51 0.90 1.04 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 14 V 8.42 4.56 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 0.89 0.00 0.00 0.95 0.00 0.00 15 L 9.07 5.27 0.00 1.55 1.51 0.72 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 16 E 9.19 5.00 0.00 2.15 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 2.26 2.29 0.00 17 P 0.00 3.95 0.00 1.32 0.49 0.00 3.65 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.53 0.00 18 Q 8.58 3.38 0.00 1.87 1.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 6.70 0.00 0.00 0.00 0.00 0.00 1.30 2.39 0.00 19 S 8.57 4.46 0.00 3.86 2.92 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 *21 A 9.01 4.36 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 R 7.52 4.54 0.00 1.34 1.65 0.00 2.71 0.00 0.00 2.93 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.62 0.00 23 F 8.58 4.50 0.00 3.40 3.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 D 8.38 4.03 0.00 2.81 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 25 Q 7.94 3.92 0.00 2.05 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.07 7.07 0.00 0.00 0.00 0.00 0.00 2.32 2.40 0.00 26 W 8.32 4.32 0.00 3.38 3.58 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 27 F 9.16 4.12 0.00 2.34 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 28 A 7.71 3.69 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 *30 E 8.18 4.03 0.00 1.74 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 0.00 1.47 1.47 0.00 31 R 7.58 3.87 0.00 1.63 1.78 0.00 2.74 0.00 0.00 2.25 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.06 0.00 32 Q 7.44 4.12 0.00 1.94 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.89 0.00 0.00 0.00 0.00 0.00 2.28 2.33 0.00 33 R 7.42 4.21 0.00 1.74 2.00 0.00 3.16 0.00 0.00 2.87 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.49 0.00 34 D 8.30 4.62 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 35 E 8.05 4.57 0.00 1.98 1.72 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 2.33 2.29 0.00 36 A 8.72 4.09 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 G 10.12 4.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 H 7.79 4.68 0.00 3.41 3.37 0.00 5.64 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 39 R 8.26 4.08 0.00 1.92 2.24 0.00 3.02 0.00 0.00 3.42 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 1.58 0.00 40 D 7.84 4.87 0.00 2.80 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 41 L 7.57 4.33 0.00 1.85 1.83 0.97 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 42 T 8.67 4.40 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 1.26 0.00 0.00 43 E 8.70 3.19 0.00 2.14 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 2.34 2.44 0.00 44 D 8.05 4.34 0.00 2.81 2.67 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 0.00 0.00 0.00 0.00 45 Q 8.21 4.06 0.00 2.38 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.58 0.00 0.00 0.00 0.00 0.00 2.43 2.42 0.00 46 A 8.27 4.31 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 W 8.67 4.00 0.00 3.06 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 48 L 8.36 4.10 0.00 1.82 1.73 1.05 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 49 R 8.14 3.88 0.00 2.15 2.52 0.00 3.63 0.00 0.00 3.44 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.73 0.00 50 L 7.93 3.42 0.00 1.08 1.35 0.21 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 0.00 0.00 0.00 0.00 51 C 7.94 3.68 0.00 2.86 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 52 A 7.51 3.99 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 53 R 7.52 3.94 0.00 1.78 1.95 0.00 3.17 0.00 0.00 2.91 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.60 0.00 54 Q 8.11 4.39 0.00 2.03 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 7.11 0.00 0.00 0.00 0.00 0.00 2.31 2.35 0.00 55 G 8.01 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 *57 W 7.98 4.84 0.00 3.65 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 58 D 8.32 4.30 0.00 2.62 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 59 A 7.80 3.82 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 60 Y 7.14 4.45 0.00 2.46 2.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 61 A 8.25 4.18 1.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 C 7.21 4.41 0.00 3.06 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 63 G 6.80 3.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 F 8.05 5.19 0.00 2.98 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 65 Y 9.09 5.18 0.00 2.90 2.87 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 66 Y 9.24 4.98 0.00 2.99 2.87 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 67 L 8.92 5.05 0.00 1.71 1.67 0.97 0.89 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 68 L 8.97 4.98 0.00 1.66 1.57 1.01 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 69 D 9.31 4.61 0.00 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0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.69 0.00 79 A 7.90 4.33 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 80 G 6.12 3.62 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 0.00 0.00 0.00 81 F 8.94 5.52 0.00 2.98 2.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 Q 9.24 4.92 0.00 1.87 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.74 0.00 0.00 0.00 0.00 0.00 2.36 2.18 0.00 83 F 8.64 4.62 0.00 2.79 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 84 R 8.47 4.69 0.00 1.62 1.70 0.00 3.20 0.00 0.00 3.42 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.50 0.00 85 R 7.90 5.10 0.00 1.71 1.80 0.00 3.21 0.00 0.00 3.23 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.61 0.00 86 R 7.44 3.74 0.00 0.67 1.12 0.00 2.29 0.00 0.00 2.62 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.35 0.00 87 G 8.46 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 88 F 7.87 4.80 0.00 2.99 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 89 G 8.22 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 0.00 0.00 0.00 90 P 0.00 4.35 0.00 2.26 2.26 0.00 3.84 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.02 0.00 91 G 8.16 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 92 F 8.21 4.58 0.00 3.26 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 93 D 8.39 4.71 0.00 2.93 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 94 N 8.49 4.22 0.00 2.79 2.81 0.00 0.00 6.99 7.43 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 95 H 7.24 4.94 0.00 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0.00 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 L 8.07 4.01 0.00 1.74 1.73 0.93 1.05 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 0.00 142 P 0.00 4.32 0.00 2.21 2.12 0.00 3.83 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.19 0.00 143 S 8.13 4.41 0.00 3.99 4.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 144 L 8.20 4.07 0.00 1.90 1.76 0.98 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 145 R 8.07 3.95 0.00 2.08 2.00 0.00 3.14 0.00 0.00 3.11 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.81 0.00 146 L 8.15 3.86 0.00 1.74 1.85 0.73 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 147 A 8.35 4.17 1.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 148 E 8.46 4.62 0.00 2.23 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.56 2.49 0.00 149 R 8.05 3.97 0.00 2.01 1.99 0.00 3.16 0.00 0.00 3.23 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.69 0.00 150 L 8.01 4.26 0.00 2.04 1.88 0.50 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 151 G 7.91 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 152 F 8.56 4.74 0.00 3.20 3.13 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 0.00 153 R 9.17 4.99 0.00 1.90 2.03 0.00 2.82 0.00 0.00 3.19 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.65 0.00 154 G 8.88 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 0.00 0.00 0.00 0.00 155 Y 8.62 5.14 0.00 2.91 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 0.00 156 S 7.33 4.59 0.00 3.54 2.92 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 0.00 157 D 8.13 5.26 0.00 2.52 2.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 158 V 8.17 4.38 1.63 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 0.01 0.00 0.00 0.01 0.00 0.00 159 A 8.46 4.98 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 0.00 160 F 9.20 4.85 0.00 3.00 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 0.00 161 D 8.86 4.10 0.00 1.93 2.47 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 0.00 162 G 8.54 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 163 A 8.00 4.67 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 0.00 164 A 8.45 4.45 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 0.00 165 H 9.85 5.21 0.00 3.06 3.04 0.00 5.77 0.00 0.00 0.00 0.00 6.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 166 L 8.70 5.00 0.00 1.65 1.48 0.87 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 167 L 8.05 4.52 0.00 0.68 1.02 0.24 -1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 168 L 9.40 5.77 0.00 1.80 1.88 1.00 0.66 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 0.00 169 E 9.52 5.37 0.00 1.90 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 2.26 2.19 0.00 170 R 9.21 4.62 0.00 0.67 0.87 0.00 2.33 0.00 0.00 2.78 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 1.29 0.00 171 A 8.61 4.08 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.