NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.2888 8.2649 123.5948 52.1459 19.8457 176.1689 2 N 4.5611 8.3804 116.2119 50.9922 39.5614 173.1310 3 A 4.4146 8.3964 127.3211 50.6357 21.1906 175.7660 4 F 4.3467 8.6246 120.7449 59.0160 39.8436 170.8691 5 L 3.2103 7.8487 135.0000 54.0615 41.4055 174.4473 *8 L 4.2771 8.4266 122.4833 54.4121 43.6511 177.6071 9 R 4.1401 7.6811 116.7462 54.6088 30.7574 174.4366 10 P 4.3490 0.0000 0.0000 62.6402 31.9094 175.5296 11 G 3.9618 8.1649 107.9305 44.3890 0.0000 173.5330 12 S 4.4631 8.0698 116.4420 55.9426 65.8531 174.8423 13 L 3.6990 8.2299 123.6810 55.8524 41.0966 177.5379 *15 R 4.0562 7.9367 114.3882 55.9316 31.2111 176.4590 *17 C 4.9883 8.1129 114.6402 56.8588 42.1001 174.0210 18 K 4.3002 7.7295 118.3323 56.5579 31.8683 176.8127 *21 Q 4.2895 7.9622 118.8290 55.9838 30.0459 172.5160 22 C 5.1104 8.9949 119.6524 53.2067 43.6672 174.3311 23 S 4.6829 8.6232 118.5780 57.8757 63.8559 175.1751 24 F 2.6759 8.0177 121.0482 57.6546 36.5465 174.7195 *27 A 3.9285 8.0367 127.3616 51.6035 20.7194 180.8213 28 R 4.3856 7.5247 116.1255 55.6252 29.4212 178.6559 *30 I 3.7994 7.9414 117.6175 60.8181 38.8250 177.3304 31 F 4.3344 7.7320 117.1588 57.9727 38.8411 175.6947 32 K 4.1652 8.2488 122.8472 57.0588 31.2126 175.6826 33 D 4.3361 7.6818 116.6813 54.2513 41.8637 177.2052 34 A 4.0597 8.7336 126.1689 54.1030 18.6024 178.9385 *36 R 4.1430 7.9822 117.8857 57.2464 32.1864 178.1811 37 T 3.8106 8.0037 114.4369 66.5995 68.2071 176.9759 38 K 4.3762 8.4961 120.6400 59.2595 31.8646 179.2293 39 L 4.0166 7.8837 119.6328 57.5707 42.3610 178.2621 40 F 4.3434 7.9635 120.7259 60.7795 39.5231 177.3433 41 W 4.3040 8.8318 128.1357 59.8823 30.3722 178.0181 42 I 3.6664 7.6127 113.7218 64.2997 36.8424 178.3651 43 S 4.2091 7.7516 115.2762 60.5826 62.9816 174.9906 44 Y 3.7541 7.5100 122.3563 59.4535 38.5129 176.3776 45 S 3.9853 6.9974 111.8886 57.7478 64.1264 174.4818 46 D 4.1623 7.2135 119.9467 56.0909 40.9560 174.6352 47 G 3.6890 7.9033 111.0970 45.1105 0.0000 172.1561 48 D 4.6520 8.3872 123.7138 54.6442 40.4801 176.3030 49 Q 4.2562 8.8260 124.6706 57.3233 28.7531 177.3240 50 C 4.4195 9.0381 116.2491 57.3049 40.2846 175.1819 51 A 3.8859 7.6299 123.0842 55.3529 18.0676 179.6815 52 S 4.0356 7.9528 111.6528 59.2673 63.8271 174.1648 53 S 3.7029 7.7920 116.6213 58.8769 60.1053 170.7689 54 P 4.1914 0.0000 0.0000 65.6477 31.7125 178.3645 55 C 4.3916 7.8440 116.5993 56.9772 38.6114 173.1963 56 Q 4.3154 8.8618 124.1796 54.3812 30.8877 174.6553 57 N 3.6961 9.1919 113.4402 54.5758 35.6334 174.5914 58 G 3.8035 7.8989 97.9628 46.7056 0.0000 174.0104 59 G 4.0850 7.3725 107.5633 45.1026 0.0000 173.7055 60 S 4.7255 8.9346 115.1751 56.9128 66.6790 172.9664 61 C 5.0925 8.8959 125.4133 55.7005 39.3531 172.5305 62 K 4.5553 9.1745 127.3603 54.3026 34.1685 174.6832 63 D 4.8188 8.8347 127.6936 54.8209 42.0414 175.0650 64 Q 4.5197 8.7901 122.8099 53.9358 33.0021 174.6455 65 L 4.2414 8.3807 118.6058 55.6594 41.0343 177.3696 66 Q 3.4742 9.9332 127.0221 55.9271 26.5169 173.5733 67 S 4.6101 7.2711 111.4067 58.6618 64.5470 174.5395 68 Y 5.4367 7.2628 117.9278 55.8832 41.4412 174.1326 69 I 4.7311 8.7979 118.4817 59.9178 41.4673 173.9707 70 C 5.4170 9.0594 123.9408 55.5559 42.0938 173.0235 71 F 4.7120 9.7433 123.6044 56.3374 40.1832 175.2762 72 C 5.1123 8.7914 121.5141 55.6633 43.4069 173.3108 73 L 4.6317 8.6526 119.3855 53.7930 42.5729 176.9711 74 P 4.0973 0.0000 0.0000 65.9556 31.4201 177.8751 75 A 4.1546 7.8247 119.5008 52.0165 18.0538 176.4459 76 F 5.3007 7.9267 116.4962 57.5481 43.5695 172.9640 77 E 4.6521 8.7386 117.9318 56.4181 31.3712 175.5202 78 G 4.2508 8.7462 104.7219 46.1867 0.0000 175.0151 79 R 3.8716 7.8645 122.1158 58.7721 30.7980 176.8163 80 N 5.0452 8.4560 114.0041 52.7571 39.2471 173.8831 81 C 4.5339 9.2161 114.3289 58.0284 38.2982 174.3436 82 E 3.8933 8.2578 117.6109 57.9472 30.3038 176.4346 83 T 4.1788 7.9981 118.4840 63.3283 69.0939 173.5483 84 H 4.7427 8.8497 124.3503 54.3627 28.1707 176.0700 85 K 4.1363 8.0469 124.3307 57.9609 31.8458 177.8802 86 D 4.6863 7.7781 117.6721 54.9028 41.8053 176.2162 87 D 4.9119 8.0584 118.8375 54.7198 41.5628 176.5956 88 Q 4.6322 7.8191 113.6910 55.2768 30.4071 176.2267 89 L 4.4790 7.6102 118.7109 54.3215 42.0773 174.7764 90 I 4.7187 7.0144 112.9314 59.1111 40.6488 177.7114 91 C 4.3570 9.7221 119.0174 60.0687 40.0722 176.4935 92 V 3.5129 7.7310 110.8029 62.5521 31.6723 175.7859 93 N 4.5652 7.8878 119.7833 52.5778 37.9430 174.2732 94 E 3.7499 8.8609 128.5749 57.9427 27.3759 174.8605 95 N 4.7350 8.5751 110.7934 53.1270 37.7852 174.2027 96 G 3.8169 8.6906 101.2203 45.8209 0.0000 175.9566 97 G 3.9471 8.5354 107.1564 45.3881 0.0000 174.3410 98 C 4.5070 7.6656 116.8434 56.6243 40.8693 173.6436 99 E 4.0003 9.0976 124.7045 58.5228 29.8624 176.8531 100 Q 4.2643 7.7090 112.2968 55.9005 30.9721 175.7044 101 Y 4.9394 6.1141 118.9372 57.7001 40.7104 174.5606 102 C 5.4675 8.8509 122.3412 54.9481 46.6802 173.3206 103 S 4.6053 9.1269 121.0694 56.7188 65.8885 173.6370 104 D 4.8730 8.6641 124.5994 54.7169 41.7687 175.8911 105 H 4.7829 8.4473 116.2744 54.2219 32.7887 172.8194 106 T 3.8716 8.6480 114.2749 63.7522 68.3073 173.0814 107 G 4.2365 8.9897 120.1620 45.8563 0.0000 174.1615 108 T 4.1167 6.7797 110.9750 60.7337 69.0979 173.2645 109 K 4.5428 7.4626 119.4726 55.3606 34.4146 176.2674 110 R 4.4924 7.6198 116.0382 56.5018 30.3457 175.7909 111 S 4.9177 9.0895 114.4830 56.8944 66.1204 172.3916 112 C 5.4847 8.7607 118.4798 55.9123 38.7996 172.6965 113 R 4.8091 8.9176 119.3860 55.3617 35.0015 172.9255 114 C 5.1839 8.5163 115.9637 55.3185 40.1128 173.9308 115 H 4.5450 9.1249 120.3134 55.1925 30.2149 174.3008 116 E 4.1750 8.3798 123.9877 58.0289 29.8896 177.3356 117 G 3.9895 9.5307 113.0182 45.1988 0.0000 171.8414 118 Y 5.2651 7.7116 115.4060 56.4051 42.1810 174.6525 119 S 4.7868 9.1240 115.3100 56.9531 68.0322 173.1080 120 L 5.2961 8.3059 123.8808 53.6257 42.8178 176.5539 121 L 4.4445 8.5360 125.7707 54.0410 42.9146 177.8563 122 A 4.0696 8.7037 122.9453 54.7417 18.2869 178.2628 123 D 4.4648 8.1474 113.6895 53.3121 39.8115 176.6006 124 G 4.1025 8.2406 107.6721 46.6365 0.0000 174.7994 125 V 4.4582 9.3092 112.9125 61.1874 36.6785 175.8567 126 S 5.0734 8.4196 115.6500 57.5007 65.4250 173.8809 127 C 6.1107 10.1506 118.7825 54.6904 44.0023 173.8721 128 T 4.9388 8.4408 116.1930 59.3894 70.8765 171.0728 129 P 4.2147 0.0000 0.0000 62.4374 31.9798 176.1906 130 T 4.6043 8.8771 114.2880 61.2649 69.5186 173.8648 131 V 4.4424 7.2515 113.2479 60.2696 35.7991 174.5372 132 E 3.7952 8.5695 121.8712 58.6739 29.9432 176.5665 133 Y 4.8481 7.2809 114.7263 55.1530 38.1630 173.1484 134 P 4.3647 0.0000 0.0000 62.1299 32.7633 177.2290 135 C 4.2518 8.5359 114.9846 59.6034 30.0820 174.9673 136 G 3.9450 8.8118 108.4388 45.5593 0.0000 173.5388 137 K 4.5312 7.4198 118.2896 54.6927 34.0707 176.5424 138 I 4.2596 7.9625 123.8354 59.2099 36.8237 174.8316 139 P 4.2387 0.0000 0.0000 65.7154 31.3649 178.6752 140 I 3.9420 7.7925 108.5339 62.3946 37.3742 176.0499 141 L 4.6487 8.0977 120.0453 54.6021 42.9170 176.2888 142 E 4.2562 8.3095 124.1975 56.4179 29.5282 175.7369 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 A 8.26 4.29 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 2 N 8.38 4.56 0.00 2.79 2.78 0.00 0.00 6.86 6.46 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 3 A 8.40 4.41 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 4 F 8.62 4.35 0.00 2.91 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 5 L 7.85 3.21 0.00 1.42 1.37 0.64 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 *8 L 8.43 4.28 0.00 1.67 1.70 0.80 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 9 R 7.68 4.14 0.00 1.75 1.81 0.00 3.18 0.00 0.00 3.19 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.59 0.00 10 P 0.00 4.35 0.00 1.98 1.98 0.00 3.62 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.05 0.00 11 G 8.16 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 12 S 8.07 4.46 0.00 3.85 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 13 L 8.23 3.70 0.00 1.36 1.50 0.66 0.85 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 *15 R 7.94 4.06 0.00 1.82 1.92 0.00 3.31 0.00 0.00 3.21 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.66 0.00 *17 C 8.11 4.99 0.00 3.15 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 18 K 7.73 4.30 0.00 1.84 1.89 0.00 1.88 0.00 0.00 1.84 0.00 0.00 3.04 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.69 1.58 7.81 *21 Q 7.96 4.29 0.00 2.12 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.68 0.00 0.00 0.00 0.00 0.00 2.38 2.42 0.00 22 C 8.99 5.11 0.00 3.19 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 23 S 8.62 4.68 0.00 4.10 4.08 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 24 F 8.02 2.68 0.00 2.02 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 *27 A 8.04 3.93 1.35 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 0.00 0.00 0.00 28 R 7.52 4.39 0.00 1.28 1.67 0.00 3.27 0.00 0.00 3.25 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.69 0.00 *30 I 7.94 3.80 1.14 0.00 0.00 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.34 0.09 0.00 0.00 31 F 7.73 4.33 0.00 2.92 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 32 K 8.25 4.17 0.00 1.88 1.93 0.00 1.67 0.00 0.00 1.61 0.00 0.00 2.93 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.31 1.31 7.81 33 D 7.68 4.34 0.00 2.77 2.56 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 34 A 8.73 4.06 1.35 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 0.00 0.00 0.00 *36 R 7.98 4.14 0.00 2.00 1.80 0.00 3.16 0.00 0.00 3.36 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.96 0.00 37 T 8.00 3.81 4.42 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 0.64 0.00 0.00 38 K 8.50 4.38 0.00 1.89 1.98 0.00 1.75 0.00 0.00 1.66 0.00 0.00 2.96 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.66 1.78 7.81 39 L 7.88 4.02 0.00 1.62 1.80 0.93 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 40 F 7.96 4.34 0.00 2.70 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 41 W 8.83 4.30 0.00 3.86 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 42 I 7.61 3.67 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 1.60 0.63 1.03 0.00 0.00 43 S 7.75 4.21 0.00 3.76 3.88 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 44 Y 7.51 3.75 0.00 1.77 2.23 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 45 S 7.00 3.99 0.00 3.46 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 46 D 7.21 4.16 0.00 2.79 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 47 G 7.90 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 48 D 8.39 4.65 0.00 2.71 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 49 Q 8.83 4.26 0.00 2.37 2.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.80 6.62 0.00 0.00 0.00 0.00 0.00 2.53 2.42 0.00 50 C 9.04 4.42 0.00 3.28 3.04 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 0.00 0.00 0.00 51 A 7.63 3.89 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 52 S 7.95 4.04 0.00 3.73 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 53 S 7.79 3.70 0.00 3.96 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 54 P 0.00 4.19 0.00 1.68 1.78 0.00 3.45 0.00 0.00 3.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.51 0.00 55 C 7.84 4.39 0.00 2.93 3.07 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 0.00 0.00 0.00 56 Q 8.86 4.32 0.00 2.04 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.12 6.26 0.00 0.00 0.00 0.00 0.00 2.22 2.45 0.00 57 N 9.19 3.70 0.00 1.61 1.46 0.00 0.00 6.85 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 58 G 7.90 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 59 G 7.37 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 0.00 0.00 0.00 60 S 8.93 4.73 0.00 3.70 3.63 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 61 C 8.90 5.09 0.00 2.90 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 62 K 9.17 4.56 0.00 1.91 1.87 0.00 1.78 0.00 0.00 1.61 0.00 0.00 2.75 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.23 1.51 7.81 63 D 8.83 4.82 0.00 2.86 2.56 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 64 Q 8.79 4.52 0.00 2.05 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.77 0.00 0.00 0.00 0.00 0.00 2.50 2.46 0.00 65 L 8.38 4.24 0.00 1.61 1.62 0.91 0.96 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 66 Q 9.93 3.47 0.00 2.04 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.96 0.00 0.00 0.00 0.00 0.00 2.48 2.40 0.00 67 S 7.27 4.61 0.00 3.83 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 68 Y 7.26 5.44 0.00 2.98 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 I 8.80 4.73 2.10 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.86 0.76 0.00 0.00 70 C 9.06 5.42 0.00 3.07 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 71 F 9.74 4.71 0.00 2.87 3.04 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 0.00 0.00 0.00 72 C 8.79 5.11 0.00 2.95 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 73 L 8.65 4.63 0.00 2.04 1.71 1.08 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 74 P 0.00 4.10 0.00 2.03 2.09 0.00 3.72 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 2.05 2.16 0.00 75 A 7.82 4.15 0.79 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 76 F 7.93 5.30 0.00 3.15 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 77 E 8.74 4.65 0.00 2.10 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 2.21 2.24 0.00 78 G 8.75 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 0.00 0.00 0.00 0.00 79 R 7.86 3.87 0.00 1.79 2.00 0.00 3.22 0.00 0.00 3.17 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.66 0.00 80 N 8.46 5.05 0.00 2.83 2.94 0.00 0.00 7.08 7.69 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 81 C 9.22 4.53 0.00 2.96 3.07 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 0.00 0.00 0.00 82 E 8.26 3.89 0.00 2.09 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 2.30 2.29 0.00 83 T 8.00 4.18 4.44 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 0.00 0.00 0.00 1.27 0.00 0.00 84 H 8.85 4.74 0.00 3.30 3.30 0.00 5.62 0.00 0.00 0.00 0.00 6.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 K 8.05 4.14 0.00 1.57 1.80 0.00 1.77 0.00 0.00 1.69 0.00 0.00 2.98 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.66 1.35 7.81 86 D 7.78 4.69 0.00 2.63 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 87 D 8.06 4.91 0.00 2.78 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 88 Q 7.82 4.63 0.00 1.98 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 7.54 0.00 0.00 0.00 0.00 0.00 2.41 2.25 0.00 89 L 7.61 4.48 0.00 1.71 1.58 0.92 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 90 I 7.01 4.72 1.87 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 1.41 0.78 0.91 0.00 0.00 91 C 9.72 4.36 0.00 3.16 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 92 V 7.73 3.51 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 0.66 0.00 0.00 0.93 0.00 0.00 93 N 7.89 4.57 0.00 2.74 2.86 0.00 0.00 7.06 8.61 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 94 E 8.86 3.75 0.00 2.19 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 2.29 2.21 0.00 95 N 8.58 4.73 0.00 2.93 2.80 0.00 0.00 7.58 7.97 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 96 G 8.69 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 0.00 0.00 0.00 97 G 8.54 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 98 C 7.67 4.51 0.00 3.13 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 99 E 9.10 4.00 0.00 1.95 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 0.00 2.22 2.22 0.00 100 Q 7.71 4.26 0.00 1.65 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.82 6.62 0.00 0.00 0.00 0.00 0.00 1.93 2.08 0.00 101 Y 6.11 4.94 0.00 2.92 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 0.00 102 C 8.85 5.47 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 0.00 103 S 9.13 4.61 0.00 3.83 3.60 0.00 0.00 0.00 0.00 0.00 0.00 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 D 8.66 4.87 0.00 2.51 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 0.00 105 H 8.45 4.78 0.00 3.14 3.11 0.00 5.64 0.00 0.00 0.00 0.00 6.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 T 8.65 3.87 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 0.00 107 G 8.99 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 0.00 0.00 0.00 0.00 108 T 6.78 4.12 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 1.25 0.00 0.00 109 K 7.46 4.54 0.00 2.02 1.85 0.00 1.62 0.00 0.00 1.76 0.00 0.00 3.03 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.37 1.37 7.81 110 R 7.62 4.49 0.00 1.99 1.98 0.00 3.07 0.00 0.00 3.28 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.64 0.00 111 S 9.09 4.92 0.00 3.91 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 0.00 112 C 8.76 5.48 0.00 2.95 3.04 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 0.00 0.00 0.00 113 R 8.92 4.81 0.00 1.88 1.93 0.00 3.13 0.00 0.00 3.22 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.67 0.00 114 C 8.52 5.18 0.00 2.82 3.01 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 0.00 115 H 9.12 4.55 0.00 2.76 2.95 0.00 5.60 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 0.00 116 E 8.38 4.17 0.00 2.01 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 2.37 2.38 0.00 117 G 9.53 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 0.00 118 Y 7.71 5.27 0.00 2.90 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 0.00 119 S 9.12 4.79 0.00 3.72 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 0.00 120 L 8.31 5.30 0.00 1.65 1.59 1.01 1.13 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 0.00 121 L 8.54 4.44 0.00 1.65 1.59 0.93 0.75 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 0.00 122 A 8.70 4.07 1.28 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 0.00 0.00 0.00 123 D 8.15 4.46 0.00 2.78 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 0.00 124 G 8.24 4.10 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 0.00 125 V 9.31 4.46 2.23 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 0.72 0.00 0.00 0.98 0.00 0.00 126 S 8.42 5.07 0.00 3.85 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 0.00 127 C 10.15 6.11 0.00 2.59 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 0.00 128 T 8.44 4.94 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 1.22 0.00 0.00 129 P 0.00 4.21 0.00 1.75 1.52 0.00 3.60 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 1.76 0.00 130 T 8.88 4.60 4.20 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 1.19 0.00 0.00 131 V 7.25 4.44 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 0.64 0.00 0.00 0.84 0.00 0.00 132 E 8.57 3.80 0.00 1.68 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 0.00 1.47 1.53 0.00 133 Y 7.28 4.85 0.00 2.98 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 0.00 134 P 0.00 4.36 0.00 1.60 1.45 0.00 3.79 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 1.93 1.67 0.00 135 C 8.54 4.25 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 0.00 136 G 8.81 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 0.00 137 K 7.42 4.53 0.00 1.95 1.78 0.00 1.89 0.00 0.00 1.77 0.00 0.00 2.92 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.56 1.61 7.81 138 I 7.96 4.26 1.89 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 1.43 0.80 0.93 0.00 0.00 139 P 0.00 4.24 0.00 2.25 2.32 0.00 3.64 0.00 0.00 4.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 2.38 0.00 140 I 7.79 3.94 1.88 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 1.43 0.54 0.93 0.00 0.00 141 L 8.10 4.65 0.00 1.74 1.71 0.93 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 142 E 8.31 4.26 0.00 2.07 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 2.49 2.40 0.00 * Residues marked with a * may have inaccurate shift predictions.