NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 0 S 4.5138 8.3349 116.7455 58.2914 64.3692 173.3870 1 L 4.3507 8.3976 123.5422 54.2567 43.4977 173.9583 2 N 5.5934 9.3761 119.2697 51.7793 42.6757 173.3953 3 A 5.2726 9.0601 122.0392 50.6379 23.5715 174.9531 4 I 4.9076 8.7611 120.0704 59.5661 40.7076 174.7960 5 I 4.4985 8.2888 127.1346 59.9528 39.1874 174.7884 6 I 4.7872 8.7337 128.8157 59.9216 38.8828 173.7609 7 D 4.8449 8.8245 124.1811 53.3875 44.4556 174.8699 8 D 4.5937 8.8897 124.1279 53.6741 40.3045 176.3237 9 H 4.6250 8.5499 119.4511 54.2926 29.5473 173.5978 10 P 4.2249 0.0000 0.0000 65.7783 31.2638 178.4009 11 L 3.9414 7.8998 118.0016 58.1170 42.1523 178.6370 12 A 4.0020 7.9576 120.2806 54.9952 18.2623 179.2536 13 I 3.5902 8.0250 118.3674 64.6916 37.1812 178.4446 14 A 3.9459 7.8588 120.5463 55.1154 18.2370 179.5598 15 A 3.9128 8.0588 119.2917 55.3133 18.3660 180.0215 16 I 3.6405 8.2232 118.7871 64.3673 37.1817 178.5296 17 R 3.8526 8.1730 119.7698 59.7309 29.9318 178.3974 18 N 4.3577 8.4062 116.2890 55.9553 38.3063 177.3105 19 L 3.9289 7.9027 121.9837 58.0264 42.2386 178.9908 20 L 3.9576 8.1041 119.1176 57.7878 41.6181 179.3490 21 I 3.6688 7.7979 119.7346 64.5419 36.9118 178.4062 22 K 4.0094 7.9122 118.5146 58.6847 31.8958 177.3556 23 N 4.8297 7.4699 115.2144 52.1423 39.7260 173.9635 24 D 4.3644 7.9577 117.2524 55.6890 40.2409 173.2267 25 I 4.7149 7.6818 117.4128 59.2922 39.4823 175.9746 26 E 4.3895 9.0702 126.8639 55.7722 31.3000 175.6007 27 I 4.6328 8.1363 124.0498 60.1033 37.6772 175.7075 28 L 4.3028 9.1177 128.8093 57.4658 42.4775 177.3356 29 A 4.5561 7.5201 117.0982 51.0217 22.5772 175.0661 30 E 5.0725 8.7843 118.8484 54.5776 32.5138 175.4593 31 L 4.9005 9.1280 124.9195 52.9056 45.0065 177.1689 32 T 4.6334 8.4168 110.4782 61.0289 69.3993 173.0039 33 E 4.7821 7.8427 118.1823 55.8553 32.3284 174.9622 34 G 3.9846 8.3388 107.2700 45.1385 0.0000 176.4008 35 G 3.6136 8.2813 109.0374 48.2053 0.0000 174.5412 36 S 4.4914 8.4024 112.4087 58.0862 64.0732 175.8592 37 A 3.8977 7.7946 124.1868 55.4825 18.0515 179.7168 38 V 3.4297 7.6995 116.0859 66.2601 31.6369 177.7357 39 Q 3.9484 8.0101 118.6297 59.3696 28.8256 178.4113 40 R 3.9278 8.1560 119.1341 59.0602 30.1018 179.2247 41 V 3.4559 8.0142 118.4397 66.0968 31.3141 178.0630 42 E 4.0533 8.2905 117.3978 59.3495 29.2686 179.1919 43 T 4.1394 7.7070 115.2027 66.3843 68.8894 176.7602 44 L 4.1193 8.1378 119.2816 54.6502 42.9411 176.9705 45 K 3.9091 7.9931 117.5672 56.7973 29.7597 173.3823 46 P 4.5882 0.0000 0.0000 62.6186 32.8089 176.8494 47 D 4.6385 8.6684 119.3078 56.7948 42.1665 176.3723 48 I 5.1996 8.0557 118.3279 59.3748 41.5042 174.8098 49 V 4.7957 9.2367 125.9905 61.1550 34.7684 173.9624 50 I 4.8676 8.6487 128.6433 59.6763 39.5732 174.5998 51 I 4.9443 8.6268 127.9060 59.3120 40.6848 174.4332 52 D 4.9785 9.1584 128.1207 53.9047 41.7559 177.8680 53 V 3.7183 8.6152 119.0533 63.8266 31.7072 176.7966 54 D 4.9096 8.3981 118.7394 53.6836 40.9140 176.2023 55 I 3.6579 7.3813 119.7669 60.7171 38.3550 174.2409 56 P 4.5253 0.0000 0.0000 63.0859 32.9425 176.7895 57 G 3.9879 8.3849 106.5573 45.7411 0.0000 174.7563 58 V 3.6100 8.3353 123.0396 62.8235 32.0576 175.5283 59 N 4.6073 8.7539 125.1628 52.6897 39.2685 176.1670 60 G 3.6482 8.6794 109.2695 48.3535 0.0000 176.1337 61 I 3.8407 7.8206 121.6898 63.9324 37.0855 178.1066 62 Q 3.9598 8.9267 121.1426 59.0246 28.7961 178.4103 63 V 3.5477 8.0644 119.5430 65.8745 31.5758 177.5567 64 L 3.9554 7.8654 119.9522 58.4879 41.8403 178.9059 65 E 4.0248 8.4883 118.5878 59.7656 29.2967 179.5735 66 T 3.9137 8.3069 116.1572 66.4611 68.4081 176.9039 67 L 4.0126 8.1905 121.1518 57.9153 41.6835 179.7881 68 R 3.9874 8.2269 118.0679 59.0921 29.7577 178.9694 69 K 4.0263 8.2130 118.8851 59.1707 32.1724 177.9858 70 R 4.4302 7.8599 116.1621 55.7899 30.1297 176.5480 71 Q 3.7373 7.9322 116.0064 56.7512 26.1937 172.8955 72 Y 4.2006 8.2845 120.5222 57.9930 39.0385 176.1817 73 S 4.5096 7.9012 121.6078 58.1173 63.8005 174.6274 74 G 3.6902 5.3800 109.4060 43.8072 0.0000 172.3621 75 I 4.4504 8.3827 120.7760 60.5134 38.6258 175.3451 76 I 5.0453 9.5530 128.3584 59.5694 40.1115 174.5107 77 I 4.7925 8.7081 128.3885 59.5021 39.7368 174.9216 78 I 4.6428 8.6485 128.5546 60.7448 38.7351 175.5074 79 V 4.6413 8.7758 119.1811 59.5924 35.6523 174.5898 80 S 4.8753 8.2997 116.1746 56.5699 65.6128 174.9901 81 A 3.9150 8.8236 128.5808 55.1011 19.3951 178.7665 82 K 4.5915 7.5873 123.2416 56.2454 31.0087 177.2723 *84 D 4.5480 8.4421 126.1755 54.9640 40.1201 175.0641 85 H 4.8511 8.9666 117.1179 55.7731 29.2443 175.1623 86 F 4.5286 8.2059 122.1231 59.3795 41.6822 176.3189 87 Y 4.1561 7.8461 117.7473 61.3783 37.3467 179.2790 88 G 3.5132 7.3424 105.9735 47.4020 0.0000 175.6221 89 K 3.6143 7.6870 121.4856 59.4704 32.2586 178.1257 90 H 4.1362 7.9896 117.8819 59.5870 29.8367 176.7574 91 C 4.1374 8.1319 118.2382 62.7289 27.9391 176.0675 92 A 3.7372 7.8731 122.5621 55.1641 17.6277 179.5009 93 D 4.2942 8.1091 116.3481 56.9584 40.9425 178.0123 94 A 4.3297 7.7387 119.0838 52.4142 18.7591 177.9779 95 G 3.8959 7.8593 105.5987 45.0663 0.0000 174.0178 96 A 4.3517 7.8484 121.7473 52.0106 19.1068 178.3878 97 N 4.6865 9.1665 117.6367 55.4498 39.9539 175.1864 98 G 3.3752 7.4420 103.8871 45.3487 0.0000 172.2034 99 F 5.3666 8.3699 122.2095 56.5760 42.3867 174.2232 100 V 4.3919 7.9619 118.6991 59.3525 35.9167 174.8863 101 S 4.5524 8.4062 119.0140 57.7738 62.9826 174.9930 102 K 4.0142 9.3565 127.5218 58.0169 32.2966 179.1970 103 K 3.9205 7.4455 120.5201 59.3221 32.1003 177.2817 104 E 4.1821 7.9821 114.9436 56.1606 29.5609 175.3116 105 G 3.7952 7.6069 105.7079 44.6932 0.0000 174.5574 106 M 3.9373 8.4781 116.6633 57.5191 31.9018 178.5104 107 N 4.3080 8.1621 116.7443 56.4953 38.6832 176.7469 108 N 4.3507 7.7619 117.4735 55.9170 38.5740 177.6579 109 I 3.5420 7.5416 121.6349 64.3222 37.1622 178.2774 110 I 3.6076 7.5657 118.7869 63.8020 37.8289 177.5037 111 A 3.8170 7.9533 121.5868 54.9938 18.0387 179.5154 112 A 3.2480 7.2700 119.1103 54.9863 18.2752 179.9860 113 I 3.5839 7.6064 118.3343 64.5289 37.1675 178.5755 114 E 3.9089 8.5051 119.6854 59.0746 29.1699 179.0812 115 A 4.0251 8.3228 121.0940 55.3844 18.5132 179.6143 116 A 4.4401 8.1785 120.6920 54.8056 18.1988 179.9328 117 K 3.9640 8.2258 116.5003 59.2948 32.1818 178.2598 118 N 4.8396 7.8309 113.6844 53.1042 38.7886 175.8445 119 G 3.8517 8.1476 108.9668 45.2227 0.0000 172.7193 120 Y 4.9636 8.4209 116.7775 55.9500 41.7670 174.4357 121 C 5.2937 8.8666 115.4673 56.9687 33.1708 173.1542 122 Y 4.5883 8.4764 120.1448 56.1505 40.5518 173.5971 123 F 5.3412 8.4512 123.6300 54.4849 43.1468 173.4462 124 P 4.4006 0.0000 0.0000 63.0045 31.8078 175.5587 125 F 4.8962 8.7189 123.6691 56.2196 41.1751 174.8502 126 S 4.5120 7.6937 121.4268 56.2837 64.9326 173.8136 127 L 3.9062 8.2431 125.5167 56.0994 42.4841 176.0688 128 N 4.4988 7.8373 119.8619 54.1112 38.4368 174.6089 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 0 S 8.33 4.51 0.00 3.77 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1 L 8.40 4.35 0.00 1.72 1.58 0.92 0.35 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 2 N 9.38 5.59 0.00 2.68 2.68 0.00 0.00 6.99 8.16 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 3 A 9.06 5.27 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 4 I 8.76 4.91 1.83 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.68 0.87 0.00 0.00 5 I 8.29 4.50 1.86 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.66 0.90 0.00 0.00 6 I 8.73 4.79 1.93 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.76 0.89 0.00 0.00 7 D 8.82 4.84 0.00 2.64 2.49 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 0.00 0.00 0.00 0.00 8 D 8.89 4.59 0.00 2.77 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 9 H 8.55 4.62 0.00 3.30 3.29 0.00 5.84 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 10 P 0.00 4.22 0.00 2.16 2.13 0.00 3.62 0.00 0.00 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.17 0.00 11 L 7.90 3.94 0.00 1.76 1.66 0.92 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 12 A 7.96 4.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 I 8.03 3.59 2.02 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.77 0.90 0.00 0.00 14 A 7.86 3.95 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 15 A 8.06 3.91 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 16 I 8.22 3.64 1.90 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 1.36 0.70 0.88 0.00 0.00 17 R 8.17 3.85 0.00 1.93 2.07 0.00 3.09 0.00 0.00 3.16 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.67 0.00 18 N 8.41 4.36 0.00 2.75 2.84 0.00 0.00 6.71 7.14 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 19 L 7.90 3.93 0.00 1.82 1.88 0.88 0.41 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 20 L 8.10 3.96 0.00 1.83 1.68 0.90 1.06 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 21 I 7.80 3.67 2.01 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.18 0.90 0.00 0.00 22 K 7.91 4.01 0.00 1.83 2.07 0.00 1.76 0.00 0.00 1.68 0.00 0.00 3.03 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.44 1.47 7.81 23 N 7.47 4.83 0.00 2.64 2.77 0.00 0.00 6.96 8.22 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 24 D 7.96 4.36 0.00 2.78 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 25 I 7.68 4.71 1.96 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 1.21 0.96 0.90 0.00 0.00 26 E 9.07 4.39 0.00 1.92 1.85 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 2.29 2.28 0.00 27 I 8.14 4.63 1.86 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.40 0.97 0.00 0.00 28 L 9.12 4.30 0.00 1.48 1.72 0.97 0.72 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 29 A 7.52 4.56 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 30 E 8.78 5.07 0.00 1.80 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 2.18 2.28 0.00 31 L 9.13 4.90 0.00 1.51 1.51 0.89 0.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 32 T 8.42 4.63 4.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 33 E 7.84 4.78 0.00 2.02 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.35 0.00 34 G 8.34 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 G 8.28 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 0.00 0.00 0.00 36 S 8.40 4.49 0.00 4.01 4.09 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 0.00 0.00 0.00 0.00 37 A 7.79 3.90 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 V 7.70 3.43 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 1.08 0.00 0.00 0.91 0.00 0.00 39 Q 8.01 3.95 0.00 2.19 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.69 0.00 0.00 0.00 0.00 0.00 2.42 2.50 0.00 40 R 8.16 3.93 0.00 1.96 1.93 0.00 3.33 0.00 0.00 3.08 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.75 0.00 41 V 8.01 3.46 1.85 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 0.37 0.00 0.00 0.75 0.00 0.00 42 E 8.29 4.05 0.00 1.94 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 2.37 2.50 0.00 43 T 7.71 4.14 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 1.21 0.00 0.00 44 L 8.14 4.12 0.00 1.73 1.72 0.91 1.21 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 45 K 7.99 3.91 0.00 1.93 1.90 0.00 1.72 0.00 0.00 1.79 0.00 0.00 3.06 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.44 1.54 7.81 46 P 0.00 4.59 0.00 2.42 2.06 0.00 3.89 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 2.00 1.94 0.00 47 D 8.67 4.64 0.00 2.80 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 48 I 8.06 5.20 1.88 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.88 0.91 0.00 0.00 49 V 9.24 4.80 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 1.00 0.00 0.00 0.77 0.00 0.00 50 I 8.65 4.87 1.84 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.45 0.86 0.00 0.00 51 I 8.63 4.94 1.87 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.82 0.96 0.00 0.00 52 D 9.16 4.98 0.00 2.94 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 53 V 8.62 3.72 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 0.36 0.00 0.00 0.91 0.00 0.00 54 D 8.40 4.91 0.00 2.88 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 55 I 7.38 3.66 1.98 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.61 0.95 0.00 0.00 56 P 0.00 4.53 0.00 2.21 1.97 0.00 3.85 0.00 0.00 3.91 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 57 G 8.38 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 V 8.34 3.61 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.00 0.00 0.93 0.00 0.00 59 N 8.75 4.61 0.00 3.08 2.97 0.00 0.00 6.14 6.92 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 60 G 8.68 3.65 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 61 I 7.82 3.84 1.96 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.72 0.94 0.00 0.00 62 Q 8.93 3.96 0.00 2.23 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.13 6.79 0.00 0.00 0.00 0.00 0.00 2.37 2.43 0.00 63 V 8.06 3.55 2.26 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 0.98 0.00 0.00 0.95 0.00 0.00 64 L 7.87 3.96 0.00 1.85 1.88 1.00 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 65 E 8.49 4.02 0.00 2.19 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 2.48 0.00 66 T 8.31 3.91 4.25 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 1.22 0.00 0.00 67 L 8.19 4.01 0.00 1.89 1.80 0.73 0.64 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 68 R 8.23 3.99 0.00 1.87 2.02 0.00 3.34 0.00 0.00 3.32 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 1.83 0.00 69 K 8.21 4.03 0.00 1.85 2.04 0.00 1.80 0.00 0.00 1.72 0.00 0.00 3.03 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.47 1.50 7.81 70 R 7.86 4.43 0.00 1.92 2.06 0.00 3.30 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 1.64 1.76 0.00 71 Q 7.93 3.74 0.00 2.27 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.83 0.00 0.00 0.00 0.00 0.00 2.29 2.44 0.00 72 Y 8.28 4.20 0.00 3.03 3.02 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 0.00 0.00 0.00 73 S 7.90 4.51 0.00 3.67 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 74 G 5.38 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 75 I 8.38 4.45 1.99 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.51 0.91 0.00 0.00 76 I 9.55 5.05 1.97 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 1.40 1.09 0.96 0.00 0.00 77 I 8.71 4.79 1.81 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 1.19 1.00 0.79 0.00 0.00 78 I 8.65 4.64 2.20 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 1.10 1.09 0.00 0.00 79 V 8.78 4.64 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 0.61 0.00 0.00 0.89 0.00 0.00 80 S 8.30 4.88 0.00 3.96 3.67 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 81 A 8.82 3.91 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 82 K 7.59 4.59 0.00 2.11 1.51 0.00 1.98 0.00 0.00 1.86 0.00 0.00 3.09 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.52 1.54 7.81 *84 D 8.44 4.55 0.00 2.93 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 85 H 8.97 4.85 0.00 3.22 3.49 0.00 5.83 0.00 0.00 0.00 0.00 6.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 86 F 8.21 4.53 0.00 2.99 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 87 Y 7.85 4.16 0.00 2.63 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 88 G 7.34 3.51 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 0.00 0.00 0.00 89 K 7.69 3.61 0.00 1.57 1.54 0.00 1.49 0.00 0.00 1.57 0.00 0.00 2.76 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.51 1.32 7.81 90 H 7.99 4.14 0.00 3.22 3.46 0.00 5.93 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 91 C 8.13 4.14 0.00 3.34 3.26 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 92 A 7.87 3.74 0.39 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 93 D 8.11 4.29 0.00 2.74 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 94 A 7.74 4.33 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 G 7.86 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 96 A 7.85 4.35 1.56 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 0.00 0.00 0.00 0.00 0.00 0.00 97 N 9.17 4.69 0.00 2.83 2.89 0.00 0.00 6.96 8.44 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 98 G 7.44 3.38 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 0.00 99 F 8.37 5.37 0.00 3.26 3.20 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 0.00 100 V 7.96 4.39 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 0.65 0.00 0.00 0.75 0.00 0.00 101 S 8.41 4.55 0.00 3.96 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 0.00 102 K 9.36 4.01 0.00 1.83 1.78 0.00 1.66 0.00 0.00 1.51 0.00 0.00 2.79 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.37 1.36 7.81 103 K 7.45 3.92 0.00 1.90 1.85 0.00 1.82 0.00 0.00 1.74 0.00 0.00 2.99 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.46 1.43 7.81 104 E 7.98 4.18 0.00 1.99 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 2.31 2.38 0.00 105 G 7.61 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 M 8.48 3.94 0.00 2.00 2.09 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.66 2.54 0.00 107 N 8.16 4.31 0.00 2.75 2.86 0.00 0.00 7.18 6.92 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 0.00 108 N 7.76 4.35 0.00 2.61 2.95 0.00 0.00 6.97 7.37 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 0.00 109 I 7.54 3.54 1.90 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 1.29 0.77 0.82 0.00 0.00 110 I 7.57 3.61 1.80 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.33 0.89 0.00 0.00 111 A 7.95 3.82 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 112 A 7.27 3.25 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 I 7.61 3.58 1.91 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 1.47 0.69 0.87 0.00 0.00 114 E 8.51 3.91 0.00 1.94 1.96 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 2.38 2.43 0.00 115 A 8.32 4.03 1.54 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 0.00 116 A 8.18 4.44 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 0.00 117 K 8.23 3.96 0.00 1.90 1.90 0.00 1.68 0.00 0.00 1.83 0.00 0.00 3.01 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.47 1.63 7.81 118 N 7.83 4.84 0.00 2.98 3.05 0.00 0.00 7.23 8.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 119 G 8.15 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 0.00 0.00 0.00 0.00 120 Y 8.42 4.96 0.00 3.02 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 0.00 121 C 8.87 5.29 0.00 3.37 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 0.00 122 Y 8.48 4.59 0.00 3.00 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 0.00 123 F 8.45 5.34 0.00 3.01 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 0.00 124 P 0.00 4.40 0.00 2.17 2.13 0.00 4.08 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 2.43 2.44 0.00 125 F 8.72 4.90 0.00 2.88 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 0.00 126 S 7.69 4.51 0.00 3.89 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 0.00 127 L 8.24 3.91 0.00 1.68 1.72 1.16 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 128 N 7.84 4.50 0.00 2.71 2.70 0.00 0.00 6.80 7.56 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 * Residues marked with a * may have inaccurate shift predictions.