NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 8 K 4.1229 8.1733 120.0758 56.3100 33.7839 174.1478 9 L 4.4069 8.1216 125.7871 52.8032 42.6041 175.2039 10 Y 4.3873 9.1374 122.7344 56.8369 40.9722 174.9738 11 C 3.7630 8.3141 122.5363 57.6690 32.3475 173.8287 12 I 3.9126 8.5928 121.6903 64.4899 36.6387 177.4635 13 C 4.3008 8.2240 112.3531 58.4481 30.2371 173.2929 14 K 3.9052 7.7280 119.2259 57.8433 29.4567 173.7885 15 T 4.8119 8.2708 109.3378 58.6300 72.4092 172.9727 16 P 5.1238 0.0000 0.0000 61.9945 32.0796 175.8581 17 Y 3.9886 8.7696 122.0618 57.6369 39.2854 174.2816 18 D 4.6534 8.6147 127.3906 52.0390 41.5442 176.0551 19 E 3.6814 8.4949 128.2553 57.7174 29.5700 177.7571 20 S 4.4549 7.9873 111.1752 58.6687 63.8773 174.4143 21 K 4.3172 7.7911 121.0080 55.2279 33.1581 175.6320 22 F 4.7059 8.3885 123.8834 57.9656 40.5296 174.0085 23 Y 4.8070 8.0338 122.3012 56.0255 42.0955 174.3980 24 I 4.4320 8.8999 121.6866 59.2187 40.8198 174.6490 25 G 3.1259 8.5244 116.2221 44.9301 0.0000 172.5251 26 C 4.8158 8.1365 123.5729 57.4665 32.6733 174.0514 27 D 4.2503 8.0644 126.2352 57.6828 40.5540 178.4722 28 R 3.9610 7.9337 116.4110 59.3698 28.9372 177.3849 29 C 4.2943 7.9184 110.3733 57.9523 30.5363 174.2473 30 Q 3.3737 8.0653 118.5124 56.9886 26.3966 172.7440 31 N 5.0298 7.3214 114.4452 52.2794 41.2531 173.3697 32 W 5.4144 8.4992 119.8442 54.9871 33.2436 174.2206 33 Y 5.0447 9.2244 120.4708 56.2023 41.5415 175.0258 34 H 4.3590 9.0075 120.9227 55.5641 29.6279 176.6136 35 G 3.9718 8.5444 111.8104 48.2974 0.0000 175.7603 36 R 4.0996 8.0397 120.1436 59.4506 29.9608 178.2334 37 C 4.2932 8.2535 116.0828 61.9508 28.2263 175.3484 38 V 4.3237 7.7875 110.7371 59.9576 31.8673 175.7121 39 G 3.8889 7.7234 106.4081 46.8190 0.0000 173.9579 40 I 4.4093 8.2017 121.0143 58.7384 38.9402 176.7836 41 L 4.2020 9.0037 126.5234 54.3465 43.0949 178.1817 42 Q 3.5682 8.3626 121.1629 59.0652 28.3612 179.5736 43 S 4.0906 7.7841 113.7819 61.5721 63.3531 176.0190 44 E 4.0819 8.0101 121.5293 58.9090 29.1913 178.7403 45 A 4.0580 8.3561 121.3291 55.3562 18.1589 179.5958 46 E 4.0152 7.7632 115.6200 59.4397 29.6427 178.2786 47 L 4.2270 7.8555 117.0583 55.6973 41.8411 176.6858 48 I 4.5462 7.2797 112.7548 59.1310 39.5355 175.2850 49 D 4.4154 8.8034 124.6573 56.6686 41.1538 176.8711 50 E 4.5472 7.7062 125.2801 54.1272 30.6811 173.3972 51 Y 4.3266 8.3824 127.4773 57.1582 40.4617 174.0674 52 V 4.2100 7.4522 126.0674 60.5704 33.5854 174.9078 53 C 3.5289 7.9386 122.9044 57.2822 30.2912 172.9295 54 P 4.0921 0.0000 0.0000 65.8560 30.7490 178.6611 55 Q 3.9286 7.9197 117.5358 59.5190 28.9790 177.9738 56 C 4.0627 7.9039 117.1662 62.8298 28.1358 175.7857 57 Q 3.8423 8.2271 121.4380 58.9944 28.5558 178.1577 58 S 4.0293 8.4202 114.6114 61.7588 62.2599 176.2903 59 T 3.8251 7.8584 117.2706 66.4730 68.2347 175.8857 60 E 4.0475 8.0913 120.2875 59.5375 29.9640 178.3781 61 D 4.5060 8.2897 118.6943 57.0649 39.2773 179.0774 62 A 3.8082 7.9728 117.9443 53.1411 18.2581 179.2632 *64 T 4.1721 7.8135 118.1587 65.3331 69.9720 176.6548 65 V 3.8955 7.7079 112.5464 62.6937 31.5496 177.2785 66 L 4.6559 7.0280 116.8447 54.5394 42.9038 177.0859 67 T 3.9578 7.4254 116.0232 62.7142 68.8627 172.2458 68 P 4.5374 0.0000 0.0000 63.3496 31.8457 176.1288 69 L 4.5125 8.8055 124.8130 55.0701 42.4542 176.7502 70 T 4.5880 9.5689 113.4516 60.0335 71.3163 175.3398 71 E 4.0170 8.9985 121.7737 59.6852 29.6898 179.3499 72 K 4.1132 8.0389 118.9563 59.6423 32.3941 178.3059 73 D 4.3496 8.1573 119.1496 57.7763 40.6390 178.5406 74 Y 3.7235 8.2683 116.9948 60.7690 37.7624 178.3945 75 E 4.1241 8.3372 120.0699 59.2602 29.5149 179.6215 76 G 3.4799 7.8090 105.3218 47.7429 0.0000 175.6854 77 L 3.4526 7.4576 121.5472 57.0648 41.3619 179.7757 78 K 4.0468 8.3535 118.8273 59.4655 32.0009 179.4655 79 R 3.9522 7.9166 118.2512 59.4033 30.1151 179.2750 80 V 3.6902 7.8922 117.8365 65.9268 31.5162 177.7511 81 L 4.1504 8.4302 120.2511 58.4619 42.0003 179.1904 82 R 4.2113 8.5535 118.6296 59.2467 29.7265 179.2224 83 S 4.3303 8.2526 113.5347 61.4543 63.3331 176.3743 84 L 4.3670 8.2326 122.5289 57.8438 41.2570 179.5215 85 Q 4.1306 8.2878 116.4197 58.5333 28.6898 178.0544 86 A 4.3602 7.8404 120.1023 52.3694 19.3140 177.1992 87 H 3.9406 7.4904 117.8747 56.1260 30.1873 176.5843 88 K 3.9272 8.5078 125.2360 57.0673 31.6347 177.5176 *90 A 4.4879 8.0685 120.9731 51.0230 20.5004 179.2075 91 W 4.3782 8.2005 114.1573 58.8783 27.9607 176.2379 92 P 4.1241 0.0000 0.0000 63.7823 30.9510 176.4971 93 F 4.8155 7.6190 117.2208 57.1785 39.9116 177.2412 94 L 4.0590 7.8064 121.9428 57.0253 41.5815 176.7499 95 E 5.0443 7.6689 115.0033 53.1891 33.3842 173.4677 96 P 4.3616 0.0000 0.0000 62.4726 31.9018 176.9433 97 V 3.3011 7.4894 120.9598 63.0930 31.9749 174.9506 98 D 4.7744 8.3054 126.0859 52.1238 42.1935 174.8720 99 P 4.6136 0.0000 0.0000 66.0224 31.5824 178.1594 100 N 4.3637 8.9136 114.9355 56.0570 38.5049 175.7459 101 D 4.5208 8.2928 116.5090 55.5868 41.6752 176.9380 102 A 4.5811 7.8274 119.5487 50.5435 20.6782 174.4646 103 P 4.3734 0.0000 0.0000 65.5740 31.8431 177.5389 104 D 4.6547 8.1804 115.5144 54.0709 40.0824 177.0640 105 Y 3.5216 7.5418 120.4663 61.8091 38.3636 177.2361 106 Y 4.3876 7.8795 117.0261 59.6279 38.2386 177.6003 107 G 3.9179 8.1825 106.8594 46.0505 0.0000 175.7328 108 V 4.1422 7.5152 118.8715 63.6260 32.0773 175.7528 109 I 4.0234 7.5061 120.5099 59.7826 37.0107 175.7512 110 K 4.2122 8.4221 125.7914 57.9989 32.7668 177.4166 111 E 4.6257 7.5918 117.0698 53.5253 29.4369 172.6874 112 P 4.4134 0.0000 0.0000 62.1870 32.7663 175.8143 *114 D 4.4253 8.1076 117.2381 52.8729 40.1378 175.6654 115 L 4.0314 8.6439 119.7476 57.6327 42.0854 179.1340 116 A 4.1787 8.1453 121.6325 55.6178 18.5804 180.7421 117 T 3.8301 8.3867 112.1164 63.8320 67.8847 176.2280 *119 E 4.3769 8.3450 124.1833 56.4473 31.7012 177.4373 120 E 3.9756 8.3052 118.1832 59.7003 29.4812 179.6206 121 R 3.8350 8.0315 117.9317 59.1376 30.0136 179.4054 122 V 4.1048 7.9931 117.6957 66.1339 31.4833 177.6152 123 Q 4.0761 8.2800 118.7377 58.8739 28.9376 177.5894 124 R 4.3379 7.7735 114.1990 54.9945 30.3729 176.3224 125 R 3.6552 7.8992 116.2931 57.7612 28.1494 176.9555 126 Y 4.0778 8.7186 119.7703 60.4490 39.3117 175.7110 127 Y 4.6065 7.7056 117.5451 57.7110 38.7569 175.0912 128 E 4.6857 10.2567 123.4194 56.4218 31.7099 176.0398 129 K 4.8942 7.8444 116.9121 53.2765 36.4950 176.7520 130 L 3.9061 8.5885 122.8054 58.6246 41.8288 179.2430 131 T 3.8774 7.6332 111.8874 65.3431 67.2002 175.8658 132 E 4.0701 8.1871 119.9358 59.2557 29.2981 179.0258 133 F 2.9770 8.0126 119.1932 61.0669 39.5517 176.8855 134 V 3.8689 7.9198 116.2642 65.8291 31.5923 177.4975 135 A 4.1908 8.1204 120.7312 55.1166 18.0668 180.0485 136 D 4.2145 7.7535 114.0017 55.5932 40.6695 178.5630 *138 T 4.2349 7.8928 118.8652 63.4814 70.6705 176.2794 139 K 3.9233 7.7793 121.9442 59.3092 31.9216 178.9133 140 I 3.4638 6.9654 120.1054 64.3794 36.9730 178.4947 141 F 4.2290 7.0527 117.9510 60.5345 38.8033 177.4373 142 D 4.3814 8.6306 118.9520 57.4476 40.5736 178.5085 143 N 4.3657 8.4003 117.2625 56.3521 38.4401 177.0232 144 C 4.3127 7.9581 119.8776 62.8446 31.6000 176.0143 145 R 3.7686 7.8503 117.8369 58.8076 29.5119 178.2744 146 Y 4.1763 7.9458 119.1533 60.7539 38.9976 176.5537 147 Y 4.0906 8.3338 119.2932 59.4418 39.3587 175.5288 148 N 4.8672 7.8829 116.0657 50.8312 40.5048 173.2785 149 P 4.4343 0.0000 0.0000 62.2658 32.1635 177.6390 150 S 2.0000 8.1266 114.3448 60.3537 62.7739 174.7192 151 D 4.5387 7.6680 118.2982 53.3465 39.9122 176.5742 152 S 4.4931 7.9684 115.9242 57.4197 64.3115 172.9232 153 P 4.2656 0.0000 0.0000 65.7119 31.0698 179.0667 154 F 4.2014 8.0357 116.7247 60.4825 38.9346 177.0863 155 Y 4.0919 8.1689 118.7776 60.9533 38.7514 177.9990 156 Q 4.1939 8.5315 119.0280 59.0868 28.7974 178.2856 157 C 4.0737 8.4854 119.8825 62.4069 31.5940 175.3737 158 A 3.7795 8.1950 122.3041 55.1023 17.8285 179.3488 159 E 3.6959 7.7354 116.3882 59.4988 29.5896 179.7388 160 V 3.5152 7.6788 117.9003 66.1558 31.5539 178.0083 161 L 3.8754 8.0539 118.9921 57.7210 41.2915 179.2258 162 E 3.3942 7.3443 119.2204 58.9971 29.5556 178.8445 163 S 4.1084 7.8058 113.0121 61.1003 62.4069 175.9382 164 F 4.1865 8.1914 123.7469 60.9492 39.1478 177.0122 165 F 4.3401 8.6487 120.7048 61.4648 39.3944 177.2161 166 V 3.3489 8.1961 118.2464 66.0524 30.9971 178.0347 167 Q 3.8702 7.6235 116.5915 58.9127 28.6461 178.6082 168 K 3.9036 7.5404 118.2027 59.1592 32.0198 179.1314 169 L 3.9548 7.3975 118.8031 57.1870 41.5899 177.7209 170 K 4.1053 7.5802 121.8459 56.8214 32.2040 176.5181 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 8 K 8.17 4.12 0.00 1.77 1.57 0.00 1.71 0.00 0.00 1.89 0.00 0.00 2.88 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.39 1.48 7.81 9 L 8.12 4.41 0.00 1.62 1.58 0.95 0.67 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 10 Y 9.14 4.39 0.00 3.00 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 11 C 8.31 3.76 0.00 3.32 2.99 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 12 I 8.59 3.91 2.05 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.11 1.01 0.00 0.00 13 C 8.22 4.30 0.00 3.15 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 14 K 7.73 3.91 0.00 1.92 1.86 0.00 1.65 0.00 0.00 1.84 0.00 0.00 3.03 0.00 0.00 3.25 0.00 0.00 0.00 0.00 1.65 1.52 7.81 15 T 8.27 4.81 4.34 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 1.31 0.00 0.00 16 P 0.00 5.12 0.00 2.13 2.11 0.00 3.80 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.08 0.00 17 Y 8.77 3.99 0.00 2.45 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 18 D 8.61 4.65 0.00 2.65 2.48 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.49 3.68 0.00 1.90 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 2.32 2.34 0.00 20 S 7.99 4.45 0.00 4.00 3.91 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 21 K 7.79 4.32 0.00 1.43 1.45 0.00 1.56 0.00 0.00 1.54 0.00 0.00 2.88 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.42 1.39 7.81 22 F 8.39 4.71 0.00 3.13 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 23 Y 8.03 4.81 0.00 2.79 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 24 I 8.90 4.43 1.64 0.00 0.00 0.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.80 1.34 0.69 0.00 0.00 25 G 8.52 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 0.00 0.00 0.00 26 C 8.14 4.82 0.00 3.05 2.89 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 27 D 8.06 4.25 0.00 2.70 2.69 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 28 R 7.93 3.96 0.00 1.72 1.95 0.00 3.11 0.00 0.00 3.22 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.56 0.00 29 C 7.92 4.29 0.00 3.12 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 30 Q 8.07 3.37 0.00 2.24 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.80 0.00 0.00 0.00 0.00 0.00 2.37 2.43 0.00 31 N 7.32 5.03 0.00 2.78 2.75 0.00 0.00 7.00 7.83 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 32 W 8.50 5.41 0.00 2.87 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 33 Y 9.22 5.04 0.00 3.02 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 34 H 9.01 4.36 0.00 3.27 3.13 0.00 5.84 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 35 G 8.54 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 36 R 8.04 4.10 0.00 1.92 1.95 0.00 3.18 0.00 0.00 3.33 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.73 0.00 37 C 8.25 4.29 0.00 3.31 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 38 V 7.79 4.32 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 0.83 0.00 0.00 1.01 0.00 0.00 39 G 7.72 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 40 I 8.20 4.41 1.86 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 1.32 0.90 0.90 0.00 0.00 41 L 9.00 4.20 0.00 1.70 1.52 0.90 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 42 Q 8.36 3.57 0.00 1.73 1.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.01 6.90 0.00 0.00 0.00 0.00 0.00 1.16 1.75 0.00 43 S 7.78 4.09 0.00 3.98 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 44 E 8.01 4.08 0.00 2.17 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 2.36 0.00 45 A 8.36 4.06 1.55 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 0.00 0.00 46 E 7.76 4.02 0.00 2.14 2.05 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 2.38 2.46 0.00 47 L 7.86 4.23 0.00 1.81 1.73 0.92 0.73 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 48 I 7.28 4.55 1.95 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 1.45 0.69 0.96 0.00 0.00 49 D 8.80 4.42 0.00 2.69 2.77 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 50 E 7.71 4.55 0.00 1.94 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 2.14 2.38 0.00 51 Y 8.38 4.33 0.00 3.06 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 52 V 7.45 4.21 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 0.78 0.00 0.00 0.84 0.00 0.00 53 C 7.94 3.53 0.00 2.26 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 54 P 0.00 4.09 0.00 2.12 2.11 0.00 3.24 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 2.06 2.09 0.00 55 Q 7.92 3.93 0.00 2.20 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.90 0.00 0.00 0.00 0.00 0.00 2.46 2.52 0.00 56 C 7.90 4.06 0.00 3.02 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 57 Q 8.23 3.84 0.00 2.13 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.81 0.00 0.00 0.00 0.00 0.00 2.28 2.49 0.00 58 S 8.42 4.03 0.00 3.86 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 59 T 7.86 3.83 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 60 E 8.09 4.05 0.00 2.08 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 2.29 2.32 0.00 61 D 8.29 4.51 0.00 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0.00 1.29 1.03 0.34 0.00 0.00 141 F 7.05 4.23 0.00 3.04 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 0.00 142 D 8.63 4.38 0.00 2.64 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 0.00 143 N 8.40 4.37 0.00 2.79 2.93 0.00 0.00 6.68 8.53 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 0.00 144 C 7.96 4.31 0.00 3.24 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 0.00 145 R 7.85 3.77 0.00 1.69 1.63 0.00 2.67 0.00 0.00 2.85 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.34 0.00 146 Y 7.95 4.18 0.00 3.11 3.18 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 0.00 147 Y 8.33 4.09 0.00 3.00 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 0.00 148 N 7.88 4.87 0.00 3.10 2.93 0.00 0.00 7.10 8.35 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 0.00 149 P 0.00 4.43 0.00 2.36 2.09 0.00 3.74 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 1.93 0.00 150 S 8.13 2.00 0.00 3.30 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 0.00 151 D 7.67 4.54 0.00 2.75 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 0.00 152 S 7.97 4.49 0.00 4.02 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 0.00 153 P 0.00 4.27 0.00 1.85 1.96 0.00 3.68 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.15 0.00 154 F 8.04 4.20 0.00 3.16 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 0.00 155 Y 8.17 4.09 0.00 3.19 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 0.00 156 Q 8.53 4.19 0.00 2.34 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.57 0.00 0.00 0.00 0.00 0.00 2.63 2.55 0.00 157 C 8.49 4.07 0.00 3.09 3.24 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 0.00 158 A 8.19 3.78 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 0.00 159 E 7.74 3.70 0.00 2.23 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 2.41 2.61 0.00 160 V 7.68 3.52 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 1.02 0.00 0.00 0.96 0.00 0.00 161 L 8.05 3.88 0.00 1.43 1.42 0.67 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 162 E 7.34 3.39 0.00 1.16 1.66 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 0.00 2.26 2.39 0.00 163 S 7.81 4.11 0.00 3.88 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 0.00 164 F 8.19 4.19 0.00 3.24 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 0.00 165 F 8.65 4.34 0.00 3.39 3.39 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 0.00 166 V 8.20 3.35 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 0.91 0.00 0.00 1.03 0.00 0.00 167 Q 7.62 3.87 0.00 2.07 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.77 0.00 0.00 0.00 0.00 0.00 2.33 2.44 0.00 168 K 7.54 3.90 0.00 1.67 1.74 0.00 1.58 0.00 0.00 1.45 0.00 0.00 2.95 0.00 0.00 2.98 0.00 0.00 0.00 0.00 0.68 1.22 7.81 169 L 7.40 3.95 0.00 1.48 1.48 0.16 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.70 0.00 0.00 0.00 0.00 0.00 0.00 170 K 7.58 4.11 0.00 1.83 1.67 0.00 1.66 0.00 0.00 1.69 0.00 0.00 3.00 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.40 1.65 7.81 * Residues marked with a * may have inaccurate shift predictions.