NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- *1 V 4.1119 8.0393 117.9051 60.4258 33.3090 175.2812 2 S 4.2356 8.5393 119.6159 55.8218 63.7285 171.5068 3 S 3.6550 8.6157 112.4010 59.1918 62.6574 173.5883 4 D 4.6016 7.9571 119.7909 54.0288 42.0253 173.7383 5 P 4.4287 0.0000 0.0000 65.6317 31.3662 178.5385 6 L 4.1156 8.5409 118.1128 57.2614 41.5881 179.6355 7 V 3.5787 7.6816 117.9714 66.0027 31.4988 177.9515 8 I 3.8704 7.6758 118.2632 64.2162 37.0844 177.8946 9 G 3.8619 8.1665 103.1055 44.0363 0.0000 173.5745 10 R 4.0972 7.7636 117.9224 56.1928 28.6620 179.1120 11 V 3.3689 7.6514 119.3656 65.8797 31.9291 176.0991 12 I 4.2869 7.5783 122.3112 62.6428 36.4275 174.3974 13 G 4.1926 7.8346 118.6632 46.2553 0.0000 174.5739 14 D 4.4350 8.2326 121.9577 55.8632 41.7297 177.8156 15 V 4.1712 7.9763 116.6133 63.8876 32.9524 175.7520 16 V 4.6190 7.2177 110.4210 59.4276 35.6032 174.3830 17 D 4.8773 8.4775 121.4254 53.6825 41.5877 175.9381 18 H 4.2956 8.5705 120.2615 56.7753 30.2692 174.1016 19 F 4.9879 7.5111 118.4962 55.8590 40.5911 173.4564 20 T 4.3991 8.4035 118.5316 61.3558 70.1421 174.7673 21 S 4.7280 8.5883 121.9340 58.7301 63.6444 174.0598 22 T 4.6096 8.5095 111.2592 61.1594 69.7993 173.8840 23 V 4.4972 7.4697 121.0806 61.3085 34.8200 174.4291 24 K 4.7473 8.5743 125.8493 55.6717 34.1890 175.2783 25 M 5.5132 8.1991 118.7054 53.7711 34.7993 174.1654 26 S 4.5170 8.2982 114.6090 56.8288 67.6364 172.9410 27 V 4.3826 8.0354 124.1245 61.2259 33.1901 174.1444 28 I 4.7928 8.3032 129.4738 59.8188 39.1673 174.8512 29 Y 4.4188 8.8565 125.2201 55.8567 40.5056 175.8144 30 N 5.1077 7.9355 118.3101 52.9796 39.1870 174.8389 31 S 4.1856 8.2061 113.7208 59.9605 64.1044 176.9638 32B S 3.3304 7.5261 110.8616 58.7820 63.4437 171.2769 32C I 4.4134 7.9585 118.6989 59.6224 39.1013 174.9038 33 K 4.5931 8.9595 123.0141 54.9278 34.5602 174.6140 34 H 4.6748 8.8043 125.3956 55.0407 31.0785 174.5422 35 V 3.8410 7.9115 126.2069 62.6735 32.1517 174.7491 36 Y 4.6388 8.3888 125.2427 55.6111 40.1874 174.8110 37 N 4.1293 8.8884 121.5060 55.2103 38.8773 175.5994 38 G 3.7855 7.0653 110.5346 45.7041 0.0000 173.3463 39 H 4.5431 8.1210 117.4670 55.5377 30.1476 174.0791 40 E 5.0789 8.5887 121.9616 55.2997 30.8270 175.1576 41 L 4.6331 8.2837 125.0575 52.6865 45.1432 176.7054 42 F 4.6879 8.1476 120.1571 56.4771 40.1216 174.9400 43 P 4.2592 0.0000 0.0000 65.7801 31.2735 179.1401 44 S 4.1357 8.0925 111.0175 60.5596 62.9740 174.7339 45 A 4.2731 7.8866 122.4281 52.9883 18.7583 177.9702 46 V 3.9345 7.2860 108.8114 60.8755 32.3253 177.2252 47 T 4.1176 8.0500 112.7287 64.0305 69.0962 174.9143 48 S 4.5866 7.8524 117.4580 57.0027 64.1616 174.1042 49 T 2.4800 7.8271 119.8351 62.8300 68.7965 172.8029 50 P 3.9298 0.0000 0.0000 61.6521 34.0368 174.4458 *52 R 4.7179 8.1839 118.3288 56.4532 31.4948 173.9882 53 V 4.4617 8.6913 127.2591 61.4185 33.2779 174.4166 54 E 4.3311 8.7878 129.1553 55.8900 30.7681 176.1614 55 V 3.8887 8.2523 125.5724 61.7317 31.8730 175.7117 56 H 4.3489 8.9866 126.5271 57.4849 29.5319 175.2021 57 G 4.1538 7.6067 105.5901 45.0487 0.0000 172.5517 58 G 4.3698 9.0555 108.7839 44.7617 0.0000 171.6079 59 D 4.8587 8.2287 117.0467 51.5208 42.6692 176.1336 60 M 3.8622 8.6853 120.7306 58.7139 31.8671 178.4238 *61 R 4.4487 8.6683 115.6954 55.8138 29.9716 180.3201 62 S 4.7789 7.7341 113.5653 57.4342 65.8125 173.1965 63 F 5.2190 8.4921 120.6578 55.7921 42.1091 174.4065 64 F 5.3963 9.2235 119.6048 56.1258 43.0955 174.0075 65 T 5.1626 9.0002 118.3657 61.8349 71.4130 173.0367 66 L 5.2028 8.8344 127.5410 53.3491 44.7985 174.9600 67 I 4.9870 8.8640 126.5065 59.6539 40.7643 173.9130 68 M 4.8869 8.8454 126.6278 54.0813 34.3214 174.4428 69 T 4.9807 8.7704 119.7392 60.5375 72.1306 171.8385 70 D 5.0284 8.8138 125.4028 51.8968 43.1590 174.4232 71 P 4.5525 0.0000 0.0000 63.3573 32.3887 175.9751 72 D 4.7746 7.9734 120.1648 54.2366 40.9329 176.7978 73 V 4.2872 7.1575 112.3606 58.9443 34.3538 175.4915 74 P 4.4525 0.0000 0.0000 63.8300 32.0191 176.0089 75 G 4.2419 7.2577 107.2160 43.4496 0.0000 172.2800 76 P 4.1210 0.0000 0.0000 65.2389 31.7305 178.1669 77 S 4.3006 8.0207 114.5811 61.0249 63.0598 173.9623 78 D 4.7170 7.4583 118.6576 52.2157 41.9783 173.2445 79 P 4.7060 0.0000 0.0000 61.1955 30.5323 177.5701 80 Y 4.3226 7.4229 116.6323 59.3879 38.9753 177.0578 81 L 4.5337 7.1951 119.8903 54.2727 41.9326 176.6654 82 R 4.1489 7.5678 115.7796 56.4871 30.2454 176.0090 83 E 4.6794 9.0471 120.3897 55.4457 32.8129 174.2578 84 H 5.1994 8.7730 121.5597 54.5940 31.5567 173.3410 85 L 4.3191 8.0324 128.9533 54.9854 42.2192 175.9186 86 H 4.6190 8.8461 122.6127 56.5404 31.3744 174.4749 87 W 5.3038 7.5601 124.6749 56.6979 34.1265 173.3700 88 I 4.9567 8.6408 126.7423 59.7849 41.0944 174.0960 89 V 4.6379 8.3787 126.8792 61.2241 34.3523 174.3553 90 T 4.8695 8.8406 121.8491 59.8940 71.0620 172.6997 91 D 4.7712 9.1862 121.2462 55.3442 38.9889 174.7752 92 I 4.2887 8.0481 120.0605 59.8833 38.1711 174.5780 93 P 4.3574 0.0000 0.0000 61.7385 31.9076 176.3255 94 G 3.9386 8.1724 111.7219 47.4207 0.0000 173.6228 94A T 3.6380 8.3686 109.5065 61.5742 69.4424 172.6310 95 T 4.5192 6.9395 111.8901 61.5016 68.4887 174.9751 96 D 4.9562 8.6806 119.7513 51.8694 42.0445 176.0477 97 S 4.1996 8.8735 114.7725 61.2827 62.8263 177.0218 98 S 4.1200 8.1180 115.0948 60.8109 62.6302 175.0334 99 F 4.5181 8.2234 117.8206 57.8190 39.1800 175.7928 100 G 4.1910 7.6933 110.1545 44.2050 0.0000 172.2963 101 K 4.6369 8.5041 118.6911 54.1795 34.7571 175.6698 102 E 4.2395 8.9657 126.4799 56.9098 29.5569 175.8693 103 V 4.1320 8.8551 127.6714 64.3269 33.0304 176.0983 104 V 4.5693 7.5290 120.6249 60.5545 34.0062 174.7884 105 S 4.7636 8.8853 122.9242 58.2727 63.8305 173.4784 106 Y 4.0728 8.6894 123.5260 57.9262 39.1098 174.8136 107 E 4.4553 7.7242 127.1563 53.9249 31.9303 175.4973 108 M 4.0585 8.2673 123.4627 54.0394 32.1905 174.3745 109 P 4.0876 0.0000 0.0000 63.1559 32.2153 177.5752 110 R 4.6818 8.0997 121.9069 54.4540 30.7103 172.2730 111 P 4.2280 0.0000 0.0000 62.5973 31.8578 176.2905 112 N 4.3246 8.0424 122.0055 55.4872 39.6304 173.7309 *115 I 4.3462 6.8181 114.4483 62.1526 39.0552 177.2925 116 G 4.1712 8.5321 114.1264 45.3667 0.0000 171.5152 117 I 4.4788 8.3197 120.0287 60.4647 38.5358 175.2155 118 H 5.1102 9.1276 123.8288 53.9811 32.0014 173.4640 119 R 4.7726 8.4951 121.0556 55.6001 31.3524 176.1451 120 F 4.1313 8.8689 123.3896 55.8069 40.6610 174.5631 121 V 4.9009 8.3208 124.6786 61.0902 34.0017 174.3747 122 F 5.4025 9.5509 126.3470 55.7807 41.7574 174.3043 123 L 5.2091 9.1962 123.6261 52.6828 45.4445 175.1833 124 L 5.1482 8.2430 124.3697 53.2657 44.9275 175.0812 125 F 5.1786 9.2072 123.7628 55.4745 43.1442 173.8125 126 K 4.3444 8.7931 123.4661 55.6881 32.8263 176.4332 127 Q 4.2457 8.4482 126.6603 56.0459 29.2270 176.1190 128 K 4.2260 8.8162 123.0437 58.2480 33.3330 177.7395 *129 K 4.7150 7.4861 116.6550 52.1463 35.5318 177.3398 129A R 4.1167 8.2175 118.1840 56.6507 30.7624 176.9571 *143 V 3.9641 7.9409 116.7874 62.3214 32.4158 174.7853 144 V 3.4420 8.0423 122.3772 63.3009 31.1181 176.4388 145 C 4.4394 8.5514 125.9255 59.6749 28.9773 174.2921 146 R 4.0220 8.4247 121.6521 57.9128 30.3449 176.2188 147 D 4.8147 8.0357 117.9949 54.5085 41.6245 176.2408 148 G 3.8941 8.8869 111.3948 46.3701 0.0000 173.5493 149 F 4.2252 8.1753 121.4128 57.6832 40.1220 173.9696 150 N 5.0559 7.2783 122.4019 51.2888 41.2719 175.0501 151 T 3.7830 8.8462 126.2434 66.6250 68.6369 176.7021 152 R 3.9175 8.0383 119.4488 59.3478 30.0438 179.0835 153 K 3.8690 8.1782 117.8764 59.4064 32.2033 179.2232 154 F 3.9450 7.8833 121.1448 61.4525 39.2144 177.2728 155 T 3.6278 8.0641 109.5419 64.5478 68.4986 176.3849 156 Q 3.8354 7.9638 122.3750 59.1128 28.9263 178.1671 157 E 3.9465 8.1565 118.4657 58.5611 29.4279 178.1083 158 N 4.5963 7.4887 115.8355 51.9474 39.9092 175.5137 159 E 3.7197 7.3772 114.8603 57.0050 27.3083 179.1832 160 L 4.3535 8.2234 118.1532 54.1189 43.1280 179.6477 161 G 3.9132 7.6662 107.4192 45.2518 0.0000 173.2434 162 L 4.5426 8.3259 118.9091 53.0445 42.8946 174.9412 163 P 3.6569 0.0000 0.0000 63.1160 31.7151 176.8508 164 V 4.3244 7.9508 112.8299 61.8045 33.4763 175.3563 165 A 4.9618 7.3004 119.8051 51.5688 22.2390 174.8255 166 A 5.2104 8.6596 119.2642 51.4765 22.2049 176.1020 167 V 5.0680 8.8654 118.4503 60.8094 35.4989 173.2681 168 F 5.8597 9.6474 116.3517 55.6057 41.7041 173.0780 169 F 5.3875 8.9098 114.1322 55.2840 41.5526 173.5581 170 N 5.5174 9.0964 117.2690 52.7017 40.8132 173.8829 171 C 5.2662 9.2063 121.7259 58.3215 35.5912 172.6089 172 Q 5.1597 8.6624 122.5761 53.7761 31.8936 174.9429 173 R 4.0466 8.7047 118.4365 56.6653 30.1510 177.1947 174 E 4.1800 8.6401 114.8501 56.3622 29.7558 176.5213 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 V 8.04 4.11 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.00 0.00 0.93 0.00 0.00 2 S 8.54 4.24 0.00 4.06 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 3 S 8.62 3.65 0.00 4.15 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 4 D 7.96 4.60 0.00 2.72 2.59 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 5 P 0.00 4.43 0.00 2.34 2.21 0.00 3.69 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 2.18 2.24 0.00 6 L 8.54 4.12 0.00 1.76 1.76 1.01 0.84 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 7 V 7.68 3.58 2.25 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 1.08 0.00 0.00 0.94 0.00 0.00 8 I 7.68 3.87 1.95 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.81 0.97 0.00 0.00 9 G 8.17 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 10 R 7.76 4.10 0.00 2.03 2.09 0.00 3.12 0.00 0.00 3.17 7.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.49 0.00 11 V 7.65 3.37 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 1.00 0.00 0.00 0.46 0.00 0.00 12 I 7.58 4.29 1.89 0.00 0.00 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.07 0.97 0.00 0.00 13 G 7.83 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 0.00 0.00 0.00 14 D 8.23 4.44 0.00 2.75 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 15 V 7.98 4.17 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 0.85 0.00 0.00 0.89 0.00 0.00 16 V 7.22 4.62 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 0.86 0.00 0.00 1.07 0.00 0.00 17 D 8.48 4.88 0.00 2.77 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 18 H 8.57 4.30 0.00 3.11 3.26 0.00 5.92 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 19 F 7.51 4.99 0.00 3.13 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 20 T 8.40 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 1.23 0.00 0.00 21 S 8.59 4.73 0.00 4.16 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 22 T 8.51 4.61 4.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 23 V 7.47 4.50 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 0.58 0.00 0.00 0.89 0.00 0.00 24 K 8.57 4.75 0.00 1.76 1.73 0.00 1.68 0.00 0.00 1.86 0.00 0.00 2.89 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.48 1.43 7.81 25 M 8.20 5.51 0.00 1.84 1.94 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.39 2.37 0.00 26 S 8.30 4.52 0.00 3.69 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27 V 8.04 4.38 1.71 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 0.34 0.00 0.00 0.33 0.00 0.00 28 I 8.30 4.79 1.75 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.99 0.85 0.00 0.00 29 Y 8.86 4.42 0.00 2.76 2.74 0.00 0.00 0.00 0.00 0.00 0.00 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 N 7.94 5.11 0.00 2.60 2.64 0.00 0.00 7.07 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 31 S 8.21 4.19 0.00 3.94 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32B S 7.53 3.33 0.00 4.06 4.15 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 32C I 7.96 4.41 1.87 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 0.53 0.91 0.00 0.00 33 K 8.96 4.59 0.00 1.62 1.67 0.00 1.66 0.00 0.00 1.56 0.00 0.00 2.69 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.32 1.39 7.81 34 H 8.80 4.67 0.00 3.05 3.01 0.00 5.92 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 35 V 7.91 3.84 1.93 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 0.96 0.00 0.00 1.00 0.00 0.00 36 Y 8.39 4.64 0.00 2.62 2.52 0.00 0.00 0.00 0.00 0.00 0.00 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 N 8.89 4.13 0.00 2.72 2.76 0.00 0.00 7.13 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 38 G 7.07 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 0.00 0.00 0.00 39 H 8.12 4.54 0.00 3.30 3.24 0.00 5.63 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 40 E 8.59 5.08 0.00 1.97 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 2.14 2.55 0.00 41 L 8.28 4.63 0.00 1.10 1.11 0.01 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 0.00 0.00 0.00 0.00 42 F 8.15 4.69 0.00 3.04 2.80 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 43 P 0.00 4.26 0.00 2.18 2.10 0.00 3.73 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 2.18 2.18 0.00 44 S 8.09 4.14 0.00 3.95 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 45 A 7.89 4.27 1.17 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 0.00 0.00 46 V 7.29 3.93 1.82 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 -0.56 0.00 0.00 0.85 0.00 0.00 47 T 8.05 4.12 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 48 S 7.85 4.59 0.00 3.90 3.73 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 49 T 7.83 2.48 3.85 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 0.48 0.00 0.00 50 P 0.00 3.93 0.00 1.45 0.49 0.00 2.24 0.00 0.00 2.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 1.59 0.00 *52 R 8.18 4.72 0.00 1.86 1.80 0.00 3.17 0.00 0.00 3.50 7.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.46 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2.93 0.00 0.00 0.00 0.00 1.35 1.39 7.81 *129 K 7.49 4.72 0.00 1.72 1.52 0.00 1.80 0.00 0.00 1.70 0.00 0.00 2.96 0.00 0.00 2.72 0.00 0.00 0.00 0.00 1.24 0.98 7.81 129A R 8.22 4.12 0.00 1.66 1.75 0.00 3.15 0.00 0.00 3.12 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 1.28 0.00 *143 V 7.94 3.96 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.70 0.00 0.00 0.96 0.00 0.00 144 V 8.04 3.44 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 0.88 0.00 0.00 1.08 0.00 0.00 145 C 8.55 4.44 0.00 3.05 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 0.00 146 R 8.42 4.02 0.00 1.73 1.61 0.00 3.01 0.00 0.00 3.28 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.54 0.00 147 D 8.04 4.81 0.00 2.69 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 0.00 148 G 8.89 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 149 F 8.18 4.23 0.00 3.02 2.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 150 N 7.28 5.06 0.00 2.61 2.41 0.00 0.00 7.01 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 0.00 151 T 8.85 3.78 4.32 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 1.39 0.00 0.00 152 R 8.04 3.92 0.00 2.01 1.97 0.00 3.13 0.00 0.00 3.34 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.89 0.00 153 K 8.18 3.87 0.00 1.68 1.77 0.00 1.59 0.00 0.00 1.52 0.00 0.00 2.88 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.40 1.51 7.81 154 F 7.88 3.95 0.00 2.68 2.74 0.00 0.00 0.00 0.00 0.00 0.00 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 T 8.06 3.63 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 0.48 0.00 0.00 156 Q 7.96 3.84 0.00 2.32 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.83 0.00 0.00 0.00 0.00 0.00 2.35 2.27 0.00 157 E 8.16 3.95 0.00 1.98 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 2.34 2.22 0.00 158 N 7.49 4.60 0.00 2.31 2.53 0.00 0.00 7.07 7.03 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 0.00 159 E 7.38 3.72 0.00 2.09 1.81 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 2.18 2.13 0.00 160 L 8.22 4.35 0.00 1.25 1.50 0.78 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 161 G 7.67 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 0.00 162 L 8.33 4.54 0.00 1.71 1.64 1.09 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 163 P 0.00 3.66 0.00 0.49 1.02 0.00 3.32 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.83 0.00 164 V 7.95 4.32 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 0.82 0.00 0.00 0.99 0.00 0.00 165 A 7.30 4.96 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 0.00 166 A 8.66 5.21 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 167 V 8.87 5.07 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 0.90 0.00 0.00 1.07 0.00 0.00 168 F 9.65 5.86 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 0.00 169 F 8.91 5.39 0.00 3.29 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 0.00 170 N 9.10 5.52 0.00 2.81 2.90 0.00 0.00 6.70 7.26 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 0.00 171 C 9.21 5.27 0.00 3.39 3.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 172 Q 8.66 5.16 0.00 2.10 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.49 6.74 0.00 0.00 0.00 0.00 0.00 2.46 2.41 0.00 173 R 8.70 4.05 0.00 1.95 2.17 0.00 3.22 0.00 0.00 3.28 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.65 0.00 174 E 8.64 4.18 0.00 2.01 1.76 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 2.23 1.87 0.00 * Residues marked with a * may have inaccurate shift predictions.