NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 9 L 4.2191 8.1693 122.4957 53.9132 43.4598 176.1452 10 P 4.1700 0.0000 0.0000 62.0618 30.7061 175.2817 11 Q 3.9134 9.1379 125.4664 59.2643 29.7369 180.3488 12 S 4.0922 8.0652 113.6504 61.2665 62.5817 175.4282 13 F 4.1938 8.3074 123.3922 61.5297 39.2361 176.8907 14 L 3.5296 7.4905 119.8764 57.6784 41.6842 178.5261 15 L 4.1655 7.8166 118.4875 56.4820 41.6090 178.9748 16 K 4.1153 7.8320 119.7017 59.3847 32.2236 178.3762 17 C 3.9855 7.8785 117.1631 62.7307 28.0507 175.6328 18 L 3.8764 7.5742 121.3720 58.4022 41.7481 178.7057 19 E 3.9234 7.9010 118.5974 59.1087 29.4328 178.9124 20 Q 3.7874 7.4565 118.3021 58.4865 28.8760 178.1704 21 V 3.2144 7.4391 119.5352 66.2862 31.4596 178.4421 22 R 3.8261 8.1656 117.6947 58.6434 29.7528 179.1889 23 K 3.8527 7.6361 119.4185 59.4811 32.1954 179.0347 24 I 4.2999 7.6080 121.3815 64.0837 36.9886 178.3034 25 Q 4.0564 8.1268 119.0361 59.0647 28.5270 179.4457 26 G 3.5635 8.2910 106.7573 47.8398 0.0000 175.5402 27 D 4.4976 8.2289 121.4570 56.9828 40.7812 178.6354 28 G 3.6810 8.4612 106.4325 48.0651 0.0000 175.1738 29 A 3.9492 8.3988 123.7955 54.5289 18.4206 179.3777 30 A 3.8844 8.4103 119.4102 55.2832 18.3524 179.6819 31 L 3.8341 8.0082 118.5005 58.4099 42.2725 178.7384 32 Q 3.9925 8.0842 118.3967 59.3556 28.7797 179.5517 33 E 4.2632 8.1695 117.8451 59.0298 29.6322 179.1593 34 K 4.0003 7.8287 119.3375 59.0863 32.0281 179.2939 35 L 4.1185 8.2340 119.8982 57.8557 41.7344 178.5935 36 C 4.9085 9.1531 119.9695 58.6279 43.3721 174.6941 37 A 4.1714 7.7638 119.9869 53.0565 19.0470 178.4916 38 T 4.0411 7.8535 113.8957 64.6631 69.4383 175.2559 39 Y 4.8850 7.7120 117.7424 57.8054 39.1167 175.7966 40 K 4.3050 8.2690 114.6729 56.0730 30.1311 175.5837 41 L 4.5152 7.7181 119.8946 53.8665 40.5294 176.0663 42 C 4.9083 8.5405 118.0771 56.5115 35.7435 174.1403 43 H 4.7757 7.8191 117.4912 52.7958 31.2811 171.8288 44 P 4.2628 0.0000 0.0000 66.0625 30.9638 178.3517 45 E 4.1481 8.1800 114.9746 58.2751 29.5228 177.8436 46 E 4.5049 7.7649 115.7533 56.4249 30.3245 176.4565 47 L 4.8723 8.0415 119.1448 54.1936 43.2564 178.6413 48 V 3.7595 7.7653 121.0653 64.1752 31.2126 178.1277 49 L 3.9022 7.8117 121.1683 58.0136 42.1795 178.0384 50 L 4.1016 8.1371 119.9692 58.2695 41.7584 178.9564 51 G 3.7730 7.9352 103.9444 48.3866 0.0000 174.8643 52 H 4.4517 8.4462 119.2654 58.8348 28.5034 178.1221 53 S 4.1884 8.0416 115.7283 60.9375 63.0861 175.8019 54 L 4.2517 8.2030 120.4209 54.1116 41.3237 177.3590 55 G 4.0323 8.0913 106.9380 45.8364 0.0000 173.7518 56 I 3.3170 6.8692 118.7144 60.6070 37.4617 174.2847 57 P 4.2471 0.0000 0.0000 61.4681 32.4740 175.2667 58 W 4.9649 8.0349 119.5333 54.6962 31.7673 175.3769 59 A 4.1807 8.4448 125.5487 50.9372 18.5722 175.7780 60 P 4.7338 0.0000 0.0000 62.8886 32.3610 175.2062 61 L 4.4414 8.0129 118.0984 54.1799 44.2308 173.7681 *71 L 4.1559 7.8791 125.4794 54.2398 43.8861 178.6266 72 A 3.8104 7.2400 117.8016 55.7085 18.7337 179.1304 73 G 3.7623 8.2742 101.0098 49.0872 0.0000 174.8175 74 C 4.1434 7.9932 117.4852 62.0261 28.4796 176.1129 75 L 4.0073 8.2549 121.9933 58.2344 41.5327 179.2413 76 S 4.2903 8.4732 115.7071 61.3122 62.7126 176.3185 77 Q 4.0501 8.3315 122.6531 58.9569 28.7838 178.0626 78 L 4.2688 8.3294 121.6930 58.2777 42.0646 178.2319 79 H 4.1208 8.3178 118.2039 59.7148 29.9021 177.5005 80 S 4.3783 8.6020 117.0005 61.4009 62.5747 177.0582 81 G 3.5412 8.5511 109.0564 47.8019 0.0000 175.8590 82 L 4.2955 8.3544 121.4875 57.2611 41.5535 179.4681 83 F 4.1946 8.1415 120.6590 61.1213 39.2977 176.7125 84 L 3.7280 7.8850 119.9244 58.6335 41.8350 178.6345 85 Y 3.9346 7.7997 116.3472 61.0836 37.7395 178.5451 86 Q 4.1170 8.6042 119.5826 59.0741 28.8759 178.9465 87 G 3.4680 7.8143 106.5434 47.9584 0.0000 175.5516 88 L 4.0779 7.9470 121.8777 57.2322 41.7756 179.6013 89 L 4.1469 8.2158 118.9445 57.5008 41.4302 179.3110 90 Q 3.9799 8.2734 119.5888 59.1233 28.8466 177.9552 91 A 4.0567 7.6844 120.0009 54.9967 18.6777 178.8160 92 L 3.9303 7.6757 114.7191 54.8214 42.0159 176.7446 93 E 3.7600 9.4506 118.6271 57.3117 27.5767 176.1896 94 G 3.8341 8.1560 105.4346 44.6586 0.0000 173.5545 95 I 3.3947 7.8932 122.3011 61.6645 36.2356 173.8435 96 S 4.7699 7.2114 111.1293 55.0285 66.3977 173.0296 97 P 4.1733 0.0000 0.0000 65.6019 30.6171 178.6929 98 E 3.9811 7.4971 117.1386 59.2970 30.1777 178.3861 99 L 4.3748 7.9386 116.7243 55.5414 41.6362 178.8179 100 G 3.7474 7.7099 107.0877 47.7144 0.0000 173.7622 101 P 4.2564 0.0000 0.0000 65.3513 31.4434 178.7050 102 T 3.8794 7.9817 113.7265 66.9485 68.2790 176.3291 103 L 4.0769 7.9324 120.0759 57.3721 41.6274 179.1422 104 D 4.3510 8.2007 119.2534 57.6558 40.6813 178.7963 105 T 3.8591 8.0057 116.1697 66.6437 68.3904 176.4280 106 L 4.1349 7.7001 122.2721 58.0775 41.9977 178.9185 107 Q 4.0089 8.3234 118.1745 59.0871 28.6575 178.7097 108 L 4.0193 8.0668 119.8434 58.1593 41.5685 179.5542 109 D 4.3885 8.5200 119.0303 57.3334 40.7734 178.9617 110 V 3.7716 8.2169 118.8061 65.7925 31.4932 177.7475 111 A 4.0578 8.4470 120.8443 55.4574 18.2367 178.9760 112 D 4.4909 8.4193 117.6667 58.0158 40.9947 179.6050 113 F 4.6392 8.2764 120.5729 61.0706 39.3981 176.9835 114 A 3.9424 8.2139 120.5891 55.5084 18.2158 179.5754 115 T 3.9782 8.1507 114.0809 67.2469 68.5923 176.5467 116 T 4.0503 8.2031 117.5220 67.1181 68.6015 176.4240 117 I 3.8842 7.8530 121.2146 64.1542 37.0837 178.2970 118 W 3.5875 8.3570 128.9723 60.6346 30.5928 177.8653 119 Q 4.1319 8.6428 118.3582 59.2278 27.9196 179.0578 120 Q 3.6025 7.9770 120.4673 59.1613 28.8930 178.1197 121 M 3.7594 7.4470 119.7415 58.2479 31.8525 178.3118 122 E 3.7877 7.8517 119.0266 59.3161 29.5421 179.0284 123 E 4.1774 7.9739 116.2589 57.9802 29.6693 177.5066 124 L 4.4737 7.1953 120.2011 54.1494 42.4717 176.3506 125 G 3.9185 8.1131 105.1057 46.8850 0.0000 174.9541 126 M 4.2701 7.7332 125.5517 55.1514 31.3537 176.2416 *137 M 4.0938 8.4515 124.4988 55.1206 33.2638 173.6475 138 P 4.0753 0.0000 0.0000 62.8008 31.8030 175.1252 139 A 4.5084 7.8973 121.5965 50.5699 20.6998 177.4957 140 F 4.2584 8.3008 123.3569 56.0663 37.5517 175.7424 141 A 4.1739 8.7238 125.1831 53.2279 19.0158 177.8924 142 S 4.7994 7.7885 108.8233 55.4587 67.4256 174.2179 143 A 4.0139 8.3764 125.3983 55.0614 18.3024 179.6204 144 F 4.0717 8.2328 118.6573 61.5157 39.4337 177.2110 145 Q 4.0181 8.2625 117.6449 58.6635 28.3608 178.9693 146 R 3.8303 7.9884 121.6264 59.8215 30.2153 179.8761 147 R 3.7484 7.5474 119.6772 61.4363 29.4748 180.6177 148 A 4.1785 7.8609 122.1640 54.2878 18.2111 179.7417 149 G 3.6719 8.0552 104.3880 46.9995 0.0000 176.3642 150 G 3.4233 8.0153 108.6793 47.8648 0.0000 175.6682 151 V 3.5618 7.5944 121.5602 65.6969 31.5516 177.9328 152 L 4.0627 7.8590 119.2283 57.7643 41.9047 179.1243 153 V 3.8775 8.0039 118.1842 65.8489 31.6348 177.6998 154 A 3.9566 8.0892 120.6163 55.3097 18.1809 179.4656 155 S 3.9435 7.9058 111.3303 62.0666 62.4754 176.2494 156 H 3.9429 7.8518 118.1596 58.1390 28.1504 177.7164 157 L 3.1303 8.2141 122.9210 57.8795 41.9371 178.3181 158 Q 3.8618 7.9019 119.5889 59.8311 28.4504 179.4342 159 S 4.1326 7.8438 115.2712 61.3018 62.8011 176.4593 160 F 4.2613 8.5620 123.9500 61.4387 39.1514 177.2834 161 L 4.4439 8.2454 120.2790 57.0803 41.2767 179.2743 162 E 4.0546 8.1302 118.7769 59.5077 29.3990 179.5832 163 V 3.5858 7.5323 117.9454 65.8522 31.5435 178.2129 164 S 4.1227 7.8687 114.2181 61.2670 62.7049 175.9085 165 Y 4.1165 8.2467 125.6073 61.4376 38.5419 179.1244 166 R 3.6126 8.0900 121.6678 61.1602 29.2230 180.9222 167 V 3.8543 7.9041 111.6865 64.1530 31.8799 178.3614 168 L 4.1544 8.2177 119.3881 57.4314 41.5881 178.9154 169 R 3.7601 7.8454 118.7228 60.1426 29.7759 177.9839 170 H 4.4227 8.2308 113.4177 57.3381 28.8389 176.8525 171 L 4.2315 7.7617 121.9880 56.7169 42.0916 176.0406 172 A 4.2612 7.5555 124.4351 52.2215 19.3423 175.2896 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 L 8.17 4.22 0.00 1.65 1.74 0.84 0.82 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 10 P 0.00 4.17 0.00 2.41 2.23 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 2.18 2.00 0.00 11 Q 9.14 3.91 0.00 2.20 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.13 6.97 0.00 0.00 0.00 0.00 0.00 2.45 2.54 0.00 12 S 8.07 4.09 0.00 3.97 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 13 F 8.31 4.19 0.00 3.18 3.29 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 0.00 14 L 7.49 3.53 0.00 1.99 1.60 1.00 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 15 L 7.82 4.17 0.00 1.84 1.66 0.92 0.48 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 16 K 7.83 4.12 0.00 1.87 1.89 0.00 1.77 0.00 0.00 1.83 0.00 0.00 3.02 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.56 1.62 7.81 17 C 7.88 3.99 0.00 2.96 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 18 L 7.57 3.88 0.00 1.80 1.64 0.93 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 19 E 7.90 3.92 0.00 1.97 2.11 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 2.25 2.30 0.00 20 Q 7.46 3.79 0.00 1.88 1.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.72 0.00 0.00 0.00 0.00 0.00 2.29 2.36 0.00 21 V 7.44 3.21 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 0.94 0.00 0.00 0.80 0.00 0.00 22 R 8.17 3.83 0.00 1.70 1.84 0.00 3.13 0.00 0.00 2.91 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.63 0.00 23 K 7.64 3.85 0.00 1.96 1.84 0.00 1.61 0.00 0.00 1.63 0.00 0.00 2.91 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.39 1.43 7.81 24 I 7.61 4.30 1.83 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 1.59 1.64 0.93 0.00 0.00 25 Q 8.13 4.06 0.00 2.12 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.90 0.00 0.00 0.00 0.00 0.00 2.30 2.51 0.00 26 G 8.29 3.56 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 0.00 27 D 8.23 4.50 0.00 2.80 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 28 G 8.46 3.68 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 0.00 0.00 0.00 29 A 8.40 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 30 A 8.41 3.88 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 31 L 8.01 3.83 0.00 1.77 1.90 0.92 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 32 Q 8.08 3.99 0.00 2.10 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.55 0.00 0.00 0.00 0.00 0.00 2.37 2.38 0.00 33 E 8.17 4.26 0.00 2.23 2.17 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 2.26 2.56 0.00 34 K 7.83 4.00 0.00 1.95 1.84 0.00 1.76 0.00 0.00 1.62 0.00 0.00 2.90 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.41 1.44 7.81 35 L 8.23 4.12 0.00 1.85 1.81 0.99 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 36 C 9.15 4.91 0.00 2.99 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 37 A 7.76 4.17 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 38 T 7.85 4.04 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 0.26 0.00 0.00 39 Y 7.71 4.88 0.00 2.95 2.85 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 40 K 8.27 4.31 0.00 1.92 1.90 0.00 1.83 0.00 0.00 2.40 0.00 0.00 2.90 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.38 1.43 7.81 41 L 7.72 4.52 0.00 1.80 1.65 0.92 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 42 C 8.54 4.91 0.00 2.77 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 43 H 7.82 4.78 0.00 3.12 3.16 0.00 5.65 0.00 0.00 0.00 0.00 6.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 P 0.00 4.26 0.00 2.13 2.11 0.00 3.60 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.19 0.00 45 E 8.18 4.15 0.00 1.95 2.03 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 2.32 2.32 0.00 46 E 7.76 4.50 0.00 2.14 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 0.00 2.48 2.42 0.00 47 L 8.04 4.87 0.00 1.86 1.71 0.95 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 0.00 0.00 0.00 0.00 48 V 7.77 3.76 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 0.88 0.00 0.00 0.83 0.00 0.00 49 L 7.81 3.90 0.00 1.81 1.74 0.96 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 50 L 8.14 4.10 0.00 1.97 1.95 1.08 1.09 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 51 G 7.94 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 52 H 8.45 4.45 0.00 3.34 3.36 0.00 5.62 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53 S 8.04 4.19 0.00 4.10 3.94 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 54 L 8.20 4.25 0.00 1.79 1.48 1.01 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 55 G 8.09 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 56 I 6.87 3.32 1.46 0.00 0.00 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.44 0.00 0.00 0.00 57 P 0.00 4.25 0.00 1.94 1.81 0.00 3.24 0.00 0.00 3.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.73 0.00 58 W 8.03 4.96 0.00 3.29 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 59 A 8.44 4.18 0.98 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 60 P 0.00 4.73 0.00 2.29 2.18 0.00 3.85 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 2.06 2.01 0.00 61 L 8.01 4.44 0.00 1.97 1.67 1.11 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 *71 L 7.88 4.16 0.00 1.77 1.55 0.94 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 72 A 7.24 3.81 1.26 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 73 G 8.27 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 74 C 7.99 4.14 0.00 3.00 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 75 L 8.25 4.01 0.00 2.00 1.81 1.02 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 76 S 8.47 4.29 0.00 4.10 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 77 Q 8.33 4.05 0.00 2.39 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 7.04 0.00 0.00 0.00 0.00 0.00 2.46 2.44 0.00 78 L 8.33 4.27 0.00 2.00 1.89 0.96 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 79 H 8.32 4.12 0.00 3.49 3.64 0.00 5.65 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 80 S 8.60 4.38 0.00 3.99 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 81 G 8.55 3.54 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 0.00 82 L 8.35 4.30 0.00 1.96 1.86 0.66 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 0.00 0.00 0.00 0.00 0.00 0.00 83 F 8.14 4.19 0.00 3.00 3.19 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 84 L 7.88 3.73 0.00 1.71 1.59 0.76 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 0.00 0.00 0.00 0.00 85 Y 7.80 3.93 0.00 3.13 3.06 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 86 Q 8.60 4.12 0.00 2.25 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.81 0.00 0.00 0.00 0.00 0.00 2.38 2.43 0.00 87 G 7.81 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 88 L 7.95 4.08 0.00 1.78 1.83 0.64 1.20 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 89 L 8.22 4.15 0.00 1.84 1.73 1.03 0.70 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 90 Q 8.27 3.98 0.00 2.26 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 6.71 0.00 0.00 0.00 0.00 0.00 2.34 2.36 0.00 91 A 7.68 4.06 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 92 L 7.68 3.93 0.00 1.76 1.53 0.75 0.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 93 E 9.45 3.76 0.00 2.02 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 2.28 2.39 0.00 94 G 8.16 3.83 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 0.00 0.00 0.00 0.00 0.00 0.00 95 I 7.89 3.39 1.87 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 1.24 0.39 0.89 0.00 0.00 96 S 7.21 4.77 0.00 4.03 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 97 P 0.00 4.17 0.00 2.19 2.16 0.00 3.64 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 2.13 2.16 0.00 98 E 7.50 3.98 0.00 1.82 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 2.31 2.34 0.00 99 L 7.94 4.37 0.00 1.82 1.71 1.12 0.92 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 0.00 100 G 7.71 3.75 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 0.00 0.00 0.00 101 P 0.00 4.26 0.00 2.16 2.12 0.00 3.79 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.19 0.00 102 T 7.98 3.88 4.40 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 0.00 0.00 0.00 1.20 0.00 0.00 103 L 7.93 4.08 0.00 1.84 1.70 0.95 0.83 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 0.00 104 D 8.20 4.35 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 0.00 105 T 8.01 3.86 4.40 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 0.00 0.00 0.00 1.28 0.00 0.00 106 L 7.70 4.13 0.00 1.81 1.85 0.93 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 107 Q 8.32 4.01 0.00 2.36 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.55 0.00 0.00 0.00 0.00 0.00 2.40 2.66 0.00 108 L 8.07 4.02 0.00 1.86 1.76 0.94 0.98 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 0.00 109 D 8.52 4.39 0.00 2.84 2.73 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 0.00 110 V 8.22 3.77 2.32 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 1.17 0.00 0.00 1.06 0.00 0.00 111 A 8.45 4.06 1.46 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 0.00 0.00 112 D 8.42 4.49 0.00 3.04 3.05 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 0.00 113 F 8.28 4.64 0.00 3.11 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 0.00 114 A 8.21 3.94 1.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.15 3.98 4.57 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 1.32 0.00 0.00 116 T 8.20 4.05 4.76 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 1.57 0.00 0.00 117 I 7.85 3.88 2.14 0.00 0.00 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 1.29 0.45 0.99 0.00 0.00 118 W 8.36 3.59 0.00 3.56 3.21 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 0.00 119 Q 8.64 4.13 0.00 2.31 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.70 0.00 0.00 0.00 0.00 0.00 2.49 2.80 0.00 120 Q 7.98 3.60 0.00 1.24 1.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.50 0.00 0.00 0.00 0.00 0.00 1.16 1.89 0.00 121 M 7.45 3.76 0.00 1.39 1.31 0.00 0.00 0.00 0.00 0.00 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.27 0.00 122 E 7.85 3.79 0.00 2.03 1.94 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 2.28 2.07 0.00 123 E 7.97 4.18 0.00 2.06 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 2.44 2.17 0.00 124 L 7.20 4.47 0.00 1.45 1.80 0.85 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 125 G 8.11 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 0.00 126 M 7.73 4.27 0.00 1.83 1.72 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.65 2.41 0.00 *137 M 8.45 4.09 0.00 1.96 1.99 0.00 0.00 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.45 2.52 0.00 138 P 0.00 4.08 0.00 1.48 1.91 0.00 3.56 0.00 0.00 3.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 1.73 0.00 139 A 7.90 4.51 1.13 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 0.00 0.00 140 F 8.30 4.26 0.00 3.07 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 0.00 141 A 8.72 4.17 1.27 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 0.00 0.00 142 S 7.79 4.80 0.00 3.90 3.94 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 0.00 143 A 8.38 4.01 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 0.00 144 F 8.23 4.07 0.00 3.08 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 0.00 145 Q 8.26 4.02 0.00 2.44 2.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.65 0.00 0.00 0.00 0.00 0.00 2.52 2.59 0.00 146 R 7.99 3.83 0.00 1.94 1.87 0.00 3.13 0.00 0.00 3.19 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.90 0.00 147 R 7.55 3.75 0.00 1.86 1.94 0.00 3.27 0.00 0.00 3.17 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.52 0.00 148 A 7.86 4.18 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 149 G 8.06 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 0.00 0.00 0.00 150 G 8.02 3.42 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 0.00 151 V 7.59 3.56 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 0.98 0.00 0.00 1.01 0.00 0.00 152 L 7.86 4.06 0.00 2.14 1.88 1.01 1.23 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 0.00 153 V 8.00 3.88 2.17 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 1.31 0.00 0.00 1.23 0.00 0.00 154 A 8.09 3.96 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 0.00 155 S 7.91 3.94 0.00 3.86 4.07 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 0.00 156 H 7.85 3.94 0.00 2.61 2.96 0.00 5.87 0.00 0.00 0.00 0.00 6.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 157 L 8.21 3.13 0.00 1.48 1.74 0.45 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 158 Q 7.90 3.86 0.00 2.32 2.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.65 6.52 0.00 0.00 0.00 0.00 0.00 2.31 2.42 0.00 159 S 7.84 4.13 0.00 3.89 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 0.00 160 F 8.56 4.26 0.00 3.20 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 0.00 161 L 8.25 4.44 0.00 1.81 1.65 0.91 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 162 E 8.13 4.05 0.00 2.00 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 2.29 2.44 0.00 163 V 7.53 3.59 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 1.04 0.00 0.00 0.94 0.00 0.00 164 S 7.87 4.12 0.00 4.11 3.83 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 0.00 0.00 0.00 165 Y 8.25 4.12 0.00 3.02 3.22 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 0.00 166 R 8.09 3.61 0.00 1.84 1.92 0.00 3.32 0.00 0.00 3.17 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.54 0.00 167 V 7.90 3.85 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 0.90 0.00 0.00 1.00 0.00 0.00 168 L 8.22 4.15 0.00 1.65 1.69 1.02 1.08 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 0.00 169 R 7.85 3.76 0.00 1.61 1.88 0.00 2.99 0.00 0.00 3.02 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.53 0.00 170 H 8.23 4.42 0.00 3.08 3.32 0.00 5.70 0.00 0.00 0.00 0.00 6.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 171 L 7.76 4.23 0.00 1.96 1.79 0.94 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 172 A 7.56 4.26 1.29 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 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.