NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 9 A 4.3820 8.1233 123.5855 52.3558 20.8783 179.1042 10 N 4.1681 8.0947 113.1995 56.1465 38.4853 175.9488 11 S 4.1776 8.8428 117.3869 61.8671 63.4603 176.4880 12 T 3.9346 7.7925 118.1060 66.4184 68.3072 176.9756 13 V 3.3917 7.6807 120.1449 65.9356 31.5616 178.1528 14 L 3.8652 8.1950 119.1926 57.5750 41.3318 179.4558 15 S 4.1305 8.2383 113.2177 61.4134 62.1780 175.9314 16 F 4.4734 7.9113 121.5971 61.7571 39.4513 176.5785 17 C 3.8793 8.1930 116.0048 62.4472 27.7292 175.8153 18 A 3.7374 8.0491 121.8968 54.3856 17.9156 178.6582 19 F 4.4687 7.1598 111.6643 56.5249 38.5551 176.2524 20 A 4.1899 7.0005 122.8930 51.7119 18.8079 179.3299 21 V 3.7708 8.2036 113.5170 63.5288 32.1171 176.4708 22 D 4.6799 7.4145 117.4035 50.3871 41.6729 173.4510 23 P 4.2013 0.0000 0.0000 65.1757 31.5285 177.6934 24 A 3.9880 7.9544 118.8892 55.0985 18.3120 179.4715 25 K 3.9330 8.5252 117.9170 59.3425 32.1132 179.0177 26 A 4.0167 7.8651 121.3375 55.2619 18.2475 178.9657 27 Y 4.2984 8.1376 118.1284 60.6670 38.8334 178.0583 28 K 3.7808 8.2943 120.6275 59.7357 32.3154 178.5545 29 D 4.3728 8.5391 119.4815 57.3788 40.6362 178.0556 30 Y 4.1126 8.5110 120.4148 60.7760 38.8224 178.2849 31 L 3.5592 8.2446 120.0307 57.6222 41.4794 179.4041 32 A 4.1822 7.8403 119.4327 54.6471 18.3066 178.8200 33 S 4.4455 7.5318 111.7842 58.5045 63.0168 175.0177 34 G 3.7612 8.0490 110.6427 45.1265 0.0000 174.4484 35 G 2.4234 7.1655 108.2552 44.5390 0.0000 173.6261 36 Q 4.1772 8.3271 122.0544 54.4197 29.8727 174.2971 37 P 4.7110 0.0000 0.0000 62.5611 32.0694 176.2837 38 I 4.0315 8.6468 122.5743 61.8119 37.5659 175.9572 39 T 4.7400 8.5266 114.9079 60.9647 71.1452 173.3844 40 N 4.3044 8.7684 116.6674 55.0546 35.5999 174.5409 41 C 4.4671 8.1190 114.2710 59.6829 29.3372 173.3222 42 V 4.5097 8.2557 114.7467 60.0843 33.2642 175.3468 43 K 4.8356 8.6336 123.2205 54.9449 34.6027 175.4369 44 M 4.4667 8.5345 123.1633 53.9042 33.8718 175.9178 45 L 4.3586 8.3865 124.5859 53.6728 42.2647 174.9559 46 C 4.9071 8.0687 120.0351 56.1437 32.9395 174.1636 47 T 3.9413 8.3002 109.1253 63.1927 68.2501 174.5488 48 H 4.7015 8.4624 117.3153 57.7621 25.4818 175.4131 49 T 4.4378 7.9035 106.5153 61.3477 68.8707 174.4804 50 G 3.9202 7.7714 111.9289 45.4663 0.0000 174.2502 51 T 3.8902 8.9913 109.4063 62.6964 68.7946 176.0770 52 G 3.9675 8.4155 109.8815 45.4860 0.0000 173.8471 53 Q 4.1148 7.6204 117.6366 55.4218 29.6077 176.3218 54 A 4.0609 8.7384 123.1626 54.6973 19.1763 177.7556 55 I 5.1716 7.4491 114.8397 59.9138 40.4108 174.8852 56 T 4.8408 9.1543 116.7238 59.9677 72.3139 175.3973 57 V 3.9317 8.6430 114.6181 63.2839 32.0397 176.3512 58 T 4.6265 7.4982 107.9370 58.5746 71.8215 171.7073 59 P 4.2126 0.0000 0.0000 63.3036 31.7210 176.5334 60 E 4.6733 9.3701 122.3193 55.7757 31.1672 175.4054 61 A 4.4820 7.6835 120.9085 52.2573 19.2081 178.3001 62 N 5.4133 8.7167 119.2833 50.7429 39.9793 175.2933 63 M 4.0663 8.7328 116.4065 58.5847 32.2220 176.6976 64 D 5.1183 8.4092 118.2285 53.8929 42.0377 176.2000 65 Q 5.1369 8.0485 115.8153 54.6439 33.5040 174.1933 66 E 4.7633 9.1515 119.6081 54.7711 33.2279 175.2931 67 S 5.2430 8.2721 118.2415 57.0523 65.3427 173.2628 68 F 5.3824 9.3079 123.1830 55.2098 42.5857 175.0062 69 G 3.8918 9.3264 109.3770 46.2863 0.0000 174.6693 70 G 3.8463 9.1107 112.8285 48.0512 0.0000 175.9069 71 A 4.0846 7.9877 123.3708 54.7421 18.1320 179.6070 72 S 4.1314 7.6287 111.6099 61.2394 63.1670 175.6584 73 C 4.5179 7.8907 117.0481 58.5313 28.4069 172.4389 74 C 4.6156 7.3955 122.7846 58.0848 32.4565 173.6022 75 L 3.5850 8.2331 129.7060 58.4865 41.7475 178.5480 76 Y 3.8641 7.2175 116.0259 61.0655 37.9092 178.0796 77 C 4.1972 7.9551 117.3293 62.8209 28.1392 176.1621 78 R 3.8377 7.8519 118.7939 58.7078 29.7111 177.9293 79 C 4.1889 7.7373 114.0698 59.0543 28.6884 173.0585 80 H 4.0448 7.6538 116.6659 56.9495 26.3167 174.1159 81 I 4.5833 7.4213 110.3464 58.3830 40.4865 174.6775 82 D 4.4102 8.3330 120.1415 54.7625 41.1817 175.8648 83 H 4.0399 8.1218 118.3410 54.0301 30.0732 173.5884 84 P 4.5376 0.0000 0.0000 62.1252 31.3202 175.8807 85 N 3.5650 7.3628 112.3799 58.1582 38.9946 177.8309 *89 F 4.2662 7.7031 126.8892 58.4064 40.8782 173.1405 90 C 4.2509 9.1454 120.0482 59.2823 31.6931 174.0505 91 D 4.7080 8.7731 125.6294 53.9922 39.9825 176.5034 92 L 4.4697 7.7743 120.1310 56.0914 43.3993 176.8064 93 K 3.9515 8.0160 118.6178 58.1504 32.2216 176.7388 94 G 3.8617 8.9466 113.6408 45.2854 0.0000 172.1728 95 K 4.6303 7.7038 118.9860 54.5012 36.2080 174.0349 96 Y 5.0988 8.8346 117.5000 56.6033 41.4613 175.2422 97 V 4.9641 8.8738 123.3972 61.3781 34.1158 174.1658 98 Q 5.0750 9.3280 128.0894 55.0184 29.8410 175.2086 99 I 4.2028 8.8153 125.3834 58.3060 40.4296 173.4462 100 P 4.4175 0.0000 0.0000 63.5917 31.9118 176.9328 101 T 3.8422 9.1451 122.4957 67.2061 68.4820 176.2282 102 T 4.1109 7.9103 107.4897 63.4212 68.9685 174.1326 103 C 4.6868 8.1712 119.3234 59.5993 29.1245 174.7759 104 A 4.3682 7.9797 121.7203 52.8485 17.7397 178.5609 105 N 4.6265 7.9334 114.0417 54.5283 38.5876 175.1113 106 D 4.7924 7.7522 118.0731 51.2952 41.3843 173.5804 107 P 4.0394 0.0000 0.0000 65.1708 30.4213 178.4487 108 V 4.3794 7.0669 118.0712 65.6464 31.5900 178.2543 109 G 4.2585 8.3918 106.2865 46.8215 0.0000 175.1812 110 F 3.6982 8.5900 123.7338 61.5034 39.1702 177.4941 111 T 3.7047 7.4422 107.3548 64.3017 68.6046 176.0037 112 L 4.2134 7.0807 121.4510 57.1896 41.8359 178.6151 113 R 4.2029 7.6011 116.0671 56.1657 30.4877 175.6174 114 N 5.0112 6.9340 115.0393 51.3782 41.6974 173.5303 115 T 4.9118 8.2996 114.5740 61.9305 72.2951 173.6529 116 V 4.0480 8.4852 126.2975 62.1800 32.7097 174.9955 117 C 4.3735 9.5050 130.0811 59.4961 31.7099 174.5670 118 T 3.8641 8.7947 117.1224 64.4073 68.4716 175.5685 119 V 3.7716 7.6402 121.6692 65.0858 31.6107 176.2544 120 C 4.3149 7.9712 112.5588 57.6757 30.4767 175.0987 121 G 3.7688 8.3175 109.4602 45.9671 0.0000 173.2664 122 M 4.6445 7.1100 119.2599 52.8750 34.3175 175.3013 123 W 4.8444 8.4546 120.1236 56.2628 29.8167 176.1745 124 K 4.2601 9.6094 126.3352 58.0496 31.8860 177.1118 125 G 3.9545 9.8801 114.8989 45.7434 0.0000 173.2778 126 Y 4.7605 8.3265 116.1730 53.8383 38.9870 173.2914 127 G 4.3272 8.9215 113.6497 46.2526 0.0000 172.3354 128 C 4.0483 8.2428 119.4506 60.6290 32.0783 173.3641 129 S 4.0714 8.8228 121.4469 59.2116 62.6901 171.9049 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 9 A 8.12 4.38 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 10 N 8.09 4.17 0.00 2.82 2.84 0.00 0.00 7.06 6.68 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 11 S 8.84 4.18 0.00 3.87 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 12 T 7.79 3.93 4.37 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 1.21 0.00 0.00 13 V 7.68 3.39 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 0.21 0.00 0.00 0.74 0.00 0.00 14 L 8.20 3.87 0.00 1.68 1.58 0.83 0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 15 S 8.24 4.13 0.00 4.13 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 16 F 7.91 4.47 0.00 3.07 3.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 C 8.19 3.88 0.00 2.82 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 18 A 8.05 3.74 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 F 7.16 4.47 0.00 3.09 3.10 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 20 A 7.00 4.19 1.06 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 0.00 0.00 21 V 8.20 3.77 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 0.70 0.00 0.00 0.92 0.00 0.00 22 D 7.41 4.68 0.00 2.59 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 23 P 0.00 4.20 0.00 2.07 2.01 0.00 3.74 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.24 0.00 24 A 7.95 3.99 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 25 K 8.53 3.93 0.00 1.97 1.96 0.00 1.65 0.00 0.00 1.67 0.00 0.00 2.96 0.00 0.00 3.22 0.00 0.00 0.00 0.00 1.60 1.47 7.81 26 A 7.87 4.02 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27 Y 8.14 4.30 0.00 2.96 3.09 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 28 K 8.29 3.78 0.00 1.95 2.00 0.00 1.69 0.00 0.00 1.65 0.00 0.00 2.93 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.41 1.45 7.81 29 D 8.54 4.37 0.00 2.86 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 30 Y 8.51 4.11 0.00 3.23 3.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31 L 8.24 3.56 0.00 1.59 1.47 0.50 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 32 A 7.84 4.18 1.30 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 33 S 7.53 4.45 0.00 3.84 3.81 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 0.00 0.00 0.00 34 G 8.05 3.76 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 0.00 0.00 0.00 35 G 7.17 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 0.00 0.00 0.00 36 Q 8.33 4.18 0.00 2.06 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.91 0.00 0.00 0.00 0.00 0.00 2.43 2.42 0.00 37 P 0.00 4.71 0.00 2.25 2.31 0.00 3.78 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 2.06 2.14 0.00 38 I 8.65 4.03 1.73 0.00 0.00 0.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.44 0.80 0.00 0.00 39 T 8.53 4.74 4.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 40 N 8.77 4.30 0.00 2.91 3.00 0.00 0.00 6.83 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 41 C 8.12 4.47 0.00 2.99 2.84 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 42 V 8.26 4.51 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 0.80 0.00 0.00 1.06 0.00 0.00 43 K 8.63 4.84 0.00 1.52 1.54 0.00 1.56 0.00 0.00 1.37 0.00 0.00 2.53 0.00 0.00 2.86 0.00 0.00 0.00 0.00 0.65 0.59 7.81 44 M 8.53 4.47 0.00 1.78 1.88 0.00 0.00 0.00 0.00 0.00 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 2.80 0.00 45 L 8.39 4.36 0.00 1.55 1.56 0.91 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 46 C 8.07 4.91 0.00 2.93 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 47 T 8.30 3.94 4.23 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 1.19 0.00 0.00 48 H 8.46 4.70 0.00 3.39 3.50 0.00 5.85 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 T 7.90 4.44 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 50 G 7.77 3.92 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 0.00 0.00 0.00 51 T 8.99 3.89 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 1.24 0.00 0.00 52 G 8.42 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 0.00 0.00 0.00 53 Q 7.62 4.11 0.00 2.07 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.89 0.00 0.00 0.00 0.00 0.00 2.38 2.30 0.00 54 A 8.74 4.06 0.12 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 55 I 7.45 5.17 1.80 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 1.48 0.54 0.97 0.00 0.00 56 T 9.15 4.84 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 1.23 0.00 0.00 57 V 8.64 3.93 2.15 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 0.77 0.00 0.00 0.97 0.00 0.00 58 T 7.50 4.63 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 1.21 0.00 0.00 59 P 0.00 4.21 0.00 1.80 1.79 0.00 3.19 0.00 0.00 2.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.84 0.00 60 E 9.37 4.67 0.00 1.93 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 2.44 2.38 0.00 61 A 7.68 4.48 1.21 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 0.00 0.00 62 N 8.72 5.41 0.00 2.99 3.02 0.00 0.00 6.86 7.24 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 63 M 8.73 4.07 0.00 2.03 2.20 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 2.56 0.00 64 D 8.41 5.12 0.00 2.64 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 65 Q 8.05 5.14 0.00 1.87 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.02 6.64 0.00 0.00 0.00 0.00 0.00 2.35 2.53 0.00 66 E 9.15 4.76 0.00 1.69 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 2.40 0.00 67 S 8.27 5.24 0.00 3.66 3.78 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 68 F 9.31 5.38 0.00 3.03 2.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 69 G 9.33 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 70 G 9.11 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 71 A 7.99 4.08 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 S 7.63 4.13 0.00 4.12 4.02 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 C 7.89 4.52 0.00 2.95 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 74 C 7.40 4.62 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 75 L 8.23 3.58 0.00 1.37 0.93 0.40 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 76 Y 7.22 3.86 0.00 2.67 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 77 C 7.96 4.20 0.00 3.09 2.97 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 78 R 7.85 3.84 0.00 1.80 1.82 0.00 3.22 0.00 0.00 3.16 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.67 0.00 79 C 7.74 4.19 0.00 2.79 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 80 H 7.65 4.04 0.00 3.30 3.35 0.00 5.59 0.00 0.00 0.00 0.00 6.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 I 7.42 4.58 1.80 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 1.36 0.73 0.76 0.00 0.00 82 D 8.33 4.41 0.00 2.60 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 83 H 8.12 4.04 0.00 2.66 2.84 0.00 5.87 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 84 P 0.00 4.54 0.00 1.99 1.88 0.00 2.45 0.00 0.00 2.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.53 0.00 85 N 7.36 3.57 0.00 2.66 2.74 0.00 0.00 6.93 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 *89 F 7.70 4.27 0.00 2.97 2.97 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 90 C 9.15 4.25 0.00 2.37 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 91 D 8.77 4.71 0.00 2.85 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 92 L 7.77 4.47 0.00 1.78 1.81 1.02 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 93 K 8.02 3.95 0.00 1.80 1.82 0.00 1.95 0.00 0.00 1.83 0.00 0.00 3.04 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.44 1.49 7.81 94 G 8.95 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 95 K 7.70 4.63 0.00 1.81 1.89 0.00 1.61 0.00 0.00 1.67 0.00 0.00 2.87 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.32 1.35 7.81 96 Y 8.83 5.10 0.00 3.02 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 97 V 8.87 4.96 2.31 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 1.48 0.00 0.00 1.07 0.00 0.00 98 Q 9.33 5.07 0.00 2.24 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.82 6.35 0.00 0.00 0.00 0.00 0.00 2.49 2.44 0.00 99 I 8.82 4.20 1.97 0.00 0.00 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.93 0.16 0.00 0.00 100 P 0.00 4.42 0.00 1.72 2.00 0.00 2.20 0.00 0.00 3.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 2.08 0.00 101 T 9.15 3.84 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 0.00 102 T 7.91 4.11 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 1.24 0.00 0.00 103 C 8.17 4.69 0.00 2.37 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 0.00 104 A 7.98 4.37 1.43 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 0.00 0.00 0.00 0.00 0.00 0.00 105 N 7.93 4.63 0.00 2.86 2.97 0.00 0.00 5.82 8.06 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 0.00 106 D 7.75 4.79 0.00 2.73 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 0.00 107 P 0.00 4.04 0.00 1.66 1.08 0.00 3.48 0.00 0.00 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 1.61 0.00 108 V 7.07 4.38 1.92 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 0.47 0.00 0.00 0.75 0.00 0.00 109 G 8.39 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 0.00 110 F 8.59 3.70 0.00 3.09 2.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 T 7.44 3.70 4.51 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 1.48 0.00 0.00 112 L 7.08 4.21 0.00 1.91 1.80 0.96 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 113 R 7.60 4.20 0.00 1.53 1.82 0.00 3.03 0.00 0.00 3.16 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.69 0.00 114 N 6.93 5.01 0.00 1.54 2.50 0.00 0.00 6.74 7.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 115 T 8.30 4.91 4.37 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 1.28 0.00 0.00 116 V 8.49 4.05 1.90 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 0.52 0.00 0.00 -0.01 0.00 0.00 117 C 9.50 4.37 0.00 3.05 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 0.00 118 T 8.79 3.86 4.23 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 1.21 0.00 0.00 119 V 7.64 3.77 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 0.84 0.00 0.00 0.93 0.00 0.00 120 C 7.97 4.31 0.00 3.14 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 0.00 121 G 8.32 3.77 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 0.00 0.00 0.00 122 M 7.11 4.64 0.00 2.08 2.04 0.00 0.00 0.00 0.00 0.00 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.69 0.00 123 W 8.45 4.84 0.00 3.71 3.37 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 0.00 124 K 9.61 4.26 0.00 2.04 1.86 0.00 1.76 0.00 0.00 1.78 0.00 0.00 3.10 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.52 1.51 7.81 125 G 9.88 3.95 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 0.00 0.00 0.00 126 Y 8.33 4.76 0.00 3.20 3.03 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 0.00 127 G 8.92 4.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 128 C 8.24 4.05 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 0.00 129 S 8.82 4.07 0.00 4.00 3.78 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 * Residues marked with a * may have inaccurate shift predictions.