NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 12 E 4.3887 8.3033 116.7584 56.0128 32.5125 177.7986 13 R 3.7841 7.9970 118.8177 59.0110 30.0071 177.5506 14 T 3.7844 7.9708 115.2412 66.4809 68.9461 176.1929 15 R 3.4102 7.5957 120.1050 59.3239 29.9936 178.3457 16 R 3.7781 8.1842 118.4148 59.2619 30.0773 178.3083 17 A 3.9464 8.1556 120.9175 55.1527 18.2905 179.6915 18 I 3.6419 7.7938 118.2781 64.6378 37.1556 178.7861 19 L 3.9063 7.9519 119.7639 57.7057 41.3045 179.2880 20 D 4.3255 8.3856 119.0353 57.3352 40.7060 178.7019 21 A 3.9409 8.1484 121.0614 54.9141 18.2652 179.5526 22 A 3.8560 8.1306 119.5697 55.4755 18.3202 179.6789 23 M 3.9320 8.1675 117.3049 58.5975 31.8536 179.0752 24 L 3.9599 7.8174 117.7317 57.7069 42.0142 179.5782 25 V 3.7401 8.0713 118.4672 66.0881 31.0248 178.2090 26 L 3.9042 8.1356 118.5732 57.1772 41.0673 179.1573 27 A 4.1563 7.4380 120.3915 54.4539 18.2713 177.7968 28 D 4.6783 7.3732 115.8546 55.1746 42.9082 176.4948 29 H 4.8591 8.1523 116.1208 52.9405 29.0462 172.0902 30 P 4.1827 0.0000 0.0000 64.4872 31.7514 177.4327 31 T 4.4716 7.7480 106.4677 60.8653 69.0574 174.3526 32 A 3.9792 7.8477 124.9660 52.6528 19.0297 178.2116 33 A 4.2592 8.3271 123.7194 51.7122 19.3509 178.8971 34 L 4.1786 8.5999 120.1479 57.6525 41.5431 180.3259 35 G 3.6416 8.0875 105.5495 47.9625 0.0000 175.3533 36 D 4.3705 8.0369 121.3525 56.9999 40.6454 179.0336 37 I 3.6714 7.6839 119.6849 64.1675 37.2342 177.9206 38 A 3.9920 8.3228 121.7884 55.2893 18.2136 179.4116 39 A 3.9222 8.1619 118.9087 55.4525 18.2584 179.7604 40 A 4.0230 7.8593 117.1208 54.3711 18.5107 178.7100 41 A 4.3984 7.5892 117.5766 51.8278 19.3198 177.9954 42 G 3.8519 7.9492 105.2306 45.6888 0.0000 173.6450 43 V 4.5134 7.7000 111.2349 58.7885 35.3296 175.7315 44 G 3.9701 8.2624 110.1614 44.7989 0.0000 175.0948 45 R 3.9840 8.6855 118.6955 59.3871 29.9723 179.5475 46 S 4.1504 8.1140 113.3491 61.5892 62.5001 176.5390 47 T 3.9014 7.7289 119.4733 66.5848 68.2281 176.5056 48 V 3.7904 7.9195 119.5162 66.4999 31.3362 177.1782 49 H 4.2566 8.2472 118.0495 58.8059 29.7191 176.8431 50 R 3.9104 7.9235 119.4665 59.2832 29.8912 177.5701 51 Y 4.1282 7.4206 115.1035 58.8254 38.7977 175.1901 52 Y 4.7755 8.4472 118.0338 54.9921 39.1788 173.7214 53 P 4.3306 0.0000 0.0000 64.5224 32.2388 176.7462 54 E 4.7878 8.5016 115.9654 53.4940 33.2067 176.6204 55 R 3.9209 8.6526 120.6531 60.1559 29.9765 179.0153 56 T 3.8370 7.8795 114.9070 66.5570 68.4816 175.9385 57 D 4.3961 7.9163 120.5026 57.4483 40.8566 178.7687 58 L 3.1208 7.8088 119.9867 57.9441 42.1454 178.8156 59 L 4.0086 8.1180 119.1847 57.8982 41.5552 179.7929 60 R 3.8889 8.2071 117.9183 58.9324 29.9748 178.8427 61 A 3.9855 7.9493 120.7193 54.9642 18.2481 179.3832 62 L 3.8395 8.1325 118.9459 58.2269 42.1120 179.0955 63 A 4.0971 8.1336 120.6781 55.2567 18.2946 179.5184 64 R 4.0332 8.1934 117.2604 59.9204 30.0693 178.2301 65 H 4.1844 8.4957 118.0924 59.2546 29.7992 177.4404 66 V 3.5306 8.1545 120.3598 66.2233 31.3310 177.4829 67 H 3.8106 8.3951 118.1319 59.1926 29.5888 176.9609 68 D 4.3125 8.3198 120.8286 57.4163 40.6701 178.8154 69 L 3.9695 8.0433 119.6017 57.5948 41.5649 179.5512 70 S 4.0967 8.1696 113.3755 61.5542 62.4111 175.9437 71 N 4.2659 8.3645 119.3573 56.2811 38.1888 177.2914 72 A 3.9932 8.1838 121.9791 55.0306 18.3829 179.5763 73 A 4.0440 8.1261 119.4072 55.1774 18.5276 180.0006 74 I 3.6741 7.8956 118.4092 64.5992 36.9988 178.4583 75 E 3.9613 7.9912 118.0601 59.4599 29.3765 179.0988 76 R 4.0053 8.2456 117.7495 59.4156 30.2300 178.2259 77 A 4.0447 8.1961 119.6299 52.4561 19.9223 176.5995 78 D 4.2718 7.8706 115.6928 54.5887 39.5983 172.1560 79 P 4.2441 0.0000 0.0000 65.3499 31.9742 177.8991 80 T 4.1316 7.7187 105.3420 61.9309 69.2943 174.1015 81 S 4.2656 7.9483 118.6864 58.2657 62.8840 174.9350 82 G 3.8711 8.6256 117.3344 44.2627 0.0000 171.2240 83 P 4.3299 0.0000 0.0000 62.5544 32.9798 177.7550 84 V 3.5608 8.3090 120.6979 65.9984 31.5617 177.8999 85 D 4.2499 8.0525 117.0634 57.4518 41.2306 177.8949 86 A 3.9906 8.0070 120.4414 55.0300 18.3822 179.3155 87 A 3.9009 7.9785 119.1888 55.4153 18.5248 179.8951 88 L 3.9415 8.2207 117.8969 57.9427 41.5493 179.9745 89 R 3.9511 8.0867 118.0486 59.2873 30.0814 179.2463 90 R 3.8989 8.0436 117.8332 59.1517 29.9913 179.2626 91 V 3.5691 7.7978 117.9160 66.0420 31.5047 178.2189 92 V 3.5126 8.2146 118.3060 65.9632 31.4236 177.6796 93 E 3.9370 8.4024 118.7714 59.6363 29.1667 179.6483 94 S 4.2648 7.8126 112.3314 61.2111 63.4676 176.2038 95 Q 4.2965 8.4121 122.0852 58.9781 28.5153 178.5308 96 L 3.8658 8.2445 120.2806 57.7800 41.3745 179.2016 97 D 4.5457 7.9539 117.6557 56.8565 40.7268 178.3669 98 L 4.2046 7.9506 119.4245 55.6353 42.1572 178.0060 99 G 4.0138 8.6127 107.1881 44.3492 0.0000 171.8955 100 P 4.4440 0.0000 0.0000 64.3810 31.0417 177.7498 101 I 3.7368 7.7862 119.0003 64.1570 37.7442 177.5295 102 V 3.6128 7.5190 119.1604 65.8415 31.2638 177.8547 103 L 4.1088 7.7035 118.2283 57.7842 41.4945 178.9573 104 F 4.1183 8.0619 120.0119 61.5409 39.1085 177.3383 105 V 3.4600 8.0805 116.5599 66.2693 31.3984 177.2880 106 Y 3.7820 7.9667 115.1825 60.0224 37.8042 176.5773 107 Y 4.7145 7.5601 115.6267 57.0835 39.3016 175.4068 108 E 3.8686 7.6102 122.2597 54.9949 28.6645 175.5549 109 P 4.2268 0.0000 0.0000 65.4342 31.5793 178.2727 110 S 4.0192 8.1316 110.8447 59.5072 63.1311 175.3217 111 I 3.7679 7.2528 123.5884 63.9767 37.2491 177.1852 112 L 3.9956 7.2776 118.9036 55.1406 41.8536 178.1258 113 A 3.9177 7.1018 122.8215 54.4467 18.5823 178.0271 114 D 4.4533 7.6878 116.4818 53.2733 41.8744 174.9807 115 P 4.2577 0.0000 0.0000 66.1355 31.4353 178.9581 116 E 3.9806 8.1870 116.6656 61.2691 29.6444 181.0145 117 L 4.2311 9.2975 122.5569 57.7860 41.8900 178.8346 118 A 3.8363 8.0584 120.0383 54.9326 18.5493 179.2551 119 A 4.0934 8.1283 119.3101 55.5213 18.6646 178.9655 120 Y 4.1009 8.1555 118.1120 61.2637 38.5636 178.6501 121 F 3.3812 8.3727 117.2791 59.7668 39.0361 176.3901 122 D 4.5543 7.9234 115.9489 54.2982 41.3508 175.4885 123 I 4.4748 8.4779 119.8979 59.1871 38.7393 174.7517 124 G 4.2157 7.9211 121.1424 46.5064 0.0000 173.9106 125 D 4.9571 7.7072 120.7072 53.6229 40.1606 178.0670 126 E 3.9744 8.1559 122.5684 60.0629 29.5398 178.7806 127 A 4.0397 7.9010 120.3324 54.7957 18.4385 179.6473 128 I 3.4466 7.5402 118.2669 64.3938 37.1630 178.5159 129 V 3.4229 7.6543 119.1646 65.6987 31.2385 177.4582 130 E 3.8547 8.1534 119.1104 59.4736 29.4547 179.1374 131 V 3.5288 7.5349 117.6621 65.9652 31.3550 177.9306 132 L 3.9175 7.7327 117.8099 57.7323 41.7075 178.9341 133 N 4.4694 8.4886 116.8265 56.5252 38.3056 177.6685 134 R 3.9614 8.2094 118.2456 58.5253 30.1602 177.9681 135 A 4.5565 7.4819 117.6996 52.6766 19.5471 177.9491 136 S 4.1880 7.6369 115.1856 59.0948 63.2027 172.7423 *142 Y 4.4166 8.1558 117.5590 57.7520 38.4904 173.5736 143 P 4.4280 0.0000 0.0000 61.3861 32.1015 173.7080 144 P 4.3264 0.0000 0.0000 64.6300 31.0956 176.3813 145 G 3.9843 9.0988 110.1796 46.4420 0.0000 175.1070 146 W 4.1376 8.3034 131.0511 60.1442 30.7053 177.7401 147 A 3.6788 8.0653 120.3120 55.2659 17.7161 179.3350 148 R 3.7985 7.8808 116.3674 59.7266 30.2228 178.7228 149 R 3.8934 7.5912 117.7522 59.2375 29.8819 179.2870 150 V 3.2480 7.2884 118.1313 65.4836 31.4309 177.7756 151 F 3.7581 8.0138 120.4348 61.2112 39.1471 177.2747 152 W 4.1861 7.9561 117.3149 59.0606 28.7720 178.5800 153 A 3.9504 7.8809 121.3549 55.1497 17.8310 179.6783 154 L 3.8538 7.9287 117.6937 57.9400 41.5102 179.5602 155 M 3.6937 7.6913 118.7497 58.2378 31.8935 178.4151 156 Q 4.1882 8.3860 119.5943 59.4144 29.2523 178.3436 157 A 4.1344 8.0991 121.8005 55.0231 18.2558 179.8275 158 G 3.4018 7.9915 104.2053 48.2147 0.0000 175.5058 159 Y 4.2381 8.0295 119.7182 60.8650 37.6417 178.7080 160 E 4.0169 8.1765 118.3649 59.2972 29.9776 178.9494 161 A 4.1180 8.2577 120.7103 55.0122 18.4451 179.4652 162 A 3.9684 8.3725 119.6928 55.3658 18.2397 179.8399 163 K 4.0198 8.1448 116.0282 59.7844 32.2366 178.4890 164 D 4.6390 7.7534 116.1089 54.8033 40.8822 177.2379 165 G 3.9022 8.2305 108.4181 45.5283 0.0000 173.4509 166 M 4.1925 7.6902 118.8173 54.0802 33.0131 174.8613 167 P 4.4328 0.0000 0.0000 62.4652 33.5025 177.2272 168 R 3.8204 8.6335 120.6286 60.1164 29.9708 178.0182 169 H 4.0795 8.3084 117.2217 59.7627 29.7788 177.0096 170 Q 3.9089 7.9996 118.9917 58.7065 28.4771 178.5851 171 I 3.6350 7.5289 120.7680 64.2508 37.0634 178.5835 172 V 3.4698 7.8628 119.1442 66.0575 31.2916 177.6229 173 D 4.2696 8.0360 118.3482 57.4744 40.6913 178.8099 174 A 3.9349 7.9818 121.0263 55.1174 18.2470 179.8412 175 I 3.5676 7.9490 118.5726 64.7492 37.0513 178.6049 176 M 4.0184 8.1926 119.7586 58.7274 31.7591 179.0059 177 T 3.8876 8.1359 116.0864 66.7325 68.5614 177.0003 178 S 4.4039 8.0980 118.4594 60.9703 62.5892 176.6278 179 L 3.9744 8.0181 121.4755 57.6366 41.4353 178.9512 180 T 4.3489 7.5760 107.8699 62.8135 69.4854 175.6036 181 S 4.5058 8.0131 114.2197 56.6121 65.4656 175.1438 182 G 3.8917 8.2119 109.8272 44.6710 0.0000 173.2510 183 I 4.4588 8.2909 109.9416 60.4805 38.9959 174.8378 184 I 4.6994 7.4525 112.9297 59.3879 40.6369 174.5407 185 T 4.5209 8.1619 116.4712 61.5601 70.8002 174.3212 186 L 4.2492 8.3990 126.6542 53.5773 42.5739 175.5299 187 P 4.4215 0.0000 0.0000 63.0277 31.2075 176.4599 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 12 E 8.30 4.39 0.00 1.91 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 0.00 2.21 1.91 0.00 13 R 8.00 3.78 0.00 1.89 2.00 0.00 3.26 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 1.72 1.73 0.00 14 T 7.97 3.78 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 1.10 0.00 0.00 15 R 7.60 3.41 0.00 1.53 1.96 0.00 3.21 0.00 0.00 3.35 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.70 0.00 16 R 8.18 3.78 0.00 1.95 2.03 0.00 3.16 0.00 0.00 3.17 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.62 0.00 17 A 8.16 3.95 1.38 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 18 I 7.79 3.64 1.99 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.65 1.01 0.00 0.00 19 L 7.95 3.91 0.00 1.50 1.56 0.86 0.67 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 20 D 8.39 4.33 0.00 2.85 2.71 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 0.00 0.00 0.00 21 A 8.15 3.94 1.40 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 0.00 0.00 0.00 22 A 8.13 3.86 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 23 M 8.17 3.93 0.00 2.07 2.28 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.80 2.61 0.00 24 L 7.82 3.96 0.00 1.72 1.72 0.92 1.12 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 25 V 8.07 3.74 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 1.09 0.00 0.00 0.93 0.00 0.00 26 L 8.14 3.90 0.00 1.28 0.51 0.71 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 27 A 7.44 4.16 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 28 D 7.37 4.68 0.00 2.70 2.44 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 0.00 29 H 8.15 4.86 0.00 3.23 3.15 0.00 5.82 0.00 0.00 0.00 0.00 6.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 P 0.00 4.18 0.00 2.19 2.48 0.00 3.67 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 2.11 2.23 0.00 31 T 7.75 4.47 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 1.26 0.00 0.00 32 A 7.85 3.98 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 33 A 8.33 4.26 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 34 L 8.60 4.18 0.00 1.78 1.78 0.93 0.86 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 35 G 8.09 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 D 8.04 4.37 0.00 2.95 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 37 I 7.68 3.67 2.01 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 1.52 1.08 0.89 0.00 0.00 38 A 8.32 3.99 1.42 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 39 A 8.16 3.92 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 40 A 7.86 4.02 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 41 A 7.59 4.40 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 42 G 7.95 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 43 V 7.70 4.51 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 0.78 0.00 0.00 1.01 0.00 0.00 44 G 8.26 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 45 R 8.69 3.98 0.00 1.88 2.04 0.00 3.15 0.00 0.00 3.41 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.72 0.00 46 S 8.11 4.15 0.00 4.04 4.12 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 47 T 7.73 3.90 4.49 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 1.38 0.00 0.00 48 V 7.92 3.79 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 1.20 0.00 0.00 1.06 0.00 0.00 49 H 8.25 4.26 0.00 3.47 3.34 0.00 5.66 0.00 0.00 0.00 0.00 7.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 R 7.92 3.91 0.00 1.87 1.93 0.00 3.11 0.00 0.00 3.10 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 1.46 0.00 51 Y 7.42 4.13 0.00 2.52 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 0.00 0.00 0.00 52 Y 8.45 4.78 0.00 2.98 2.90 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 53 P 0.00 4.33 0.00 2.13 2.12 0.00 3.86 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.10 0.00 54 E 8.50 4.79 0.00 2.12 1.79 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 2.21 2.20 0.00 55 R 8.65 3.92 0.00 1.89 1.95 0.00 3.21 0.00 0.00 3.36 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.75 0.00 56 T 7.88 3.84 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 1.18 0.00 0.00 57 D 7.92 4.40 0.00 3.05 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 58 L 7.81 3.12 0.00 1.62 1.76 0.46 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 59 L 8.12 4.01 0.00 1.83 1.71 0.98 1.37 0.00 0.00 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0.00 0.00 0.00 0.00 0.00 0.00 68 D 8.32 4.31 0.00 2.89 2.71 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 0.00 0.00 0.00 69 L 8.04 3.97 0.00 1.78 1.68 0.82 0.69 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 70 S 8.17 4.10 0.00 3.91 3.87 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 71 N 8.36 4.27 0.00 2.72 2.75 0.00 0.00 6.97 6.81 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 72 A 8.18 3.99 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 73 A 8.13 4.04 1.45 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 0.00 0.00 0.00 0.00 0.00 0.00 74 I 7.90 3.67 2.03 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.27 0.92 0.00 0.00 75 E 7.99 3.96 0.00 2.05 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 2.59 2.42 0.00 76 R 8.25 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8.21 3.96 0.00 1.88 1.98 0.00 3.12 0.00 0.00 3.21 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.82 0.00 135 A 7.48 4.56 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 0.00 136 S 7.64 4.19 0.00 4.06 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 *142 Y 8.16 4.42 0.00 3.10 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 0.00 143 P 0.00 4.43 0.00 2.26 2.02 0.00 3.58 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.98 0.00 144 P 0.00 4.33 0.00 2.24 2.15 0.00 3.93 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 2.07 2.03 0.00 145 G 9.10 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 0.00 146 W 8.30 4.14 0.00 3.54 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 0.00 147 A 8.07 3.68 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 0.00 148 R 7.88 3.80 0.00 1.90 2.14 0.00 3.26 0.00 0.00 3.43 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 2.04 0.00 149 R 7.59 3.89 0.00 1.26 1.54 0.00 3.19 0.00 0.00 3.07 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.88 0.00 150 V 7.29 3.25 1.89 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 0.95 0.00 0.00 0.23 0.00 0.00 151 F 8.01 3.76 0.00 2.92 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 0.00 152 W 7.96 4.19 0.00 3.40 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 0.00 153 A 7.88 3.95 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 0.00 154 L 7.93 3.85 0.00 1.48 1.51 0.80 1.03 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 0.00 155 M 7.69 3.69 0.00 2.08 2.31 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.62 0.00 156 Q 8.39 4.19 0.00 2.17 2.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.79 0.00 0.00 0.00 0.00 0.00 2.77 2.56 0.00 157 A 8.10 4.13 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 0.00 158 G 7.99 3.40 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 0.00 0.00 0.00 0.00 159 Y 8.03 4.24 0.00 3.22 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 0.00 160 E 8.18 4.02 0.00 2.16 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 0.00 2.39 2.49 0.00 161 A 8.26 4.12 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 0.00 162 A 8.37 3.97 1.42 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 0.00 163 K 8.14 4.02 0.00 1.97 1.93 0.00 1.75 0.00 0.00 1.75 0.00 0.00 3.04 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.52 1.57 7.81 164 D 7.75 4.64 0.00 2.87 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 0.00 165 G 8.23 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 0.00 166 M 7.69 4.19 0.00 2.07 1.97 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.51 0.00 167 P 0.00 4.43 0.00 2.32 2.17 0.00 3.76 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.02 0.00 168 R 8.63 3.82 0.00 1.90 1.99 0.00 3.34 0.00 0.00 3.27 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.68 0.00 169 H 8.31 4.08 0.00 3.26 3.31 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 0.00 170 Q 8.00 3.91 0.00 2.22 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.69 0.00 0.00 0.00 0.00 0.00 2.43 2.45 0.00 171 I 7.53 3.64 1.92 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 1.36 0.84 0.84 0.00 0.00 172 V 7.86 3.47 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 1.08 0.00 0.00 0.95 0.00 0.00 173 D 8.04 4.27 0.00 2.73 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 0.00 174 A 7.98 3.93 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 0.00 175 I 7.95 3.57 1.87 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 1.33 0.61 0.67 0.00 0.00 176 M 8.19 4.02 0.00 1.99 2.07 0.00 0.00 0.00 0.00 0.00 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.87 0.00 177 T 8.14 3.89 4.21 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 1.20 0.00 0.00 178 S 8.10 4.40 0.00 3.97 3.87 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 0.00 179 L 8.02 3.97 0.00 1.77 1.73 0.96 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 180 T 7.58 4.35 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 1.27 0.00 0.00 181 S 8.01 4.51 0.00 3.92 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 0.00 182 G 8.21 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 0.00 183 I 8.29 4.46 1.88 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 1.49 0.77 0.91 0.00 0.00 184 I 7.45 4.70 1.88 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 1.44 0.74 0.92 0.00 0.00 185 T 8.16 4.52 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 0.00 186 L 8.40 4.25 0.00 1.64 1.60 0.92 1.11 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 0.00 187 P 0.00 4.42 0.00 2.04 1.97 0.00 3.71 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.08 0.00 * Residues marked with a * may have inaccurate shift predictions.