NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 0 G 3.7300 8.3544 109.7295 45.3116 0.0000 174.0329 *2 S 4.0767 8.4469 111.7456 57.1374 64.1008 173.6440 3 R 3.6293 8.4013 123.1686 57.0254 29.4459 176.8954 4 G 3.7934 5.5751 104.8655 44.6201 0.0000 169.9135 5 H 5.6922 8.7389 118.8630 53.4913 33.3022 172.2338 6 C 5.3221 9.3877 123.1503 58.2078 30.8035 172.6401 7 I 4.8557 8.8781 125.0953 59.6598 39.1367 174.5765 8 L 5.0861 8.9149 127.8174 53.0288 44.1592 175.4545 9 A 5.1383 8.9333 127.8804 50.1797 20.6756 175.9956 10 H 4.6338 9.1279 118.6021 55.7916 30.0721 175.6275 11 G 4.0303 8.5564 107.2359 45.0992 0.0000 172.4616 12 F 4.7392 8.7799 122.1522 59.5101 39.6246 174.3103 13 E 3.4963 7.9888 125.1903 57.1511 28.0429 175.0606 14 S 4.7048 7.4021 114.8462 58.1982 63.1934 172.1750 15 G 3.7122 7.7603 106.0357 44.2641 0.0000 171.8486 16 P 4.4351 0.0000 0.0000 64.7376 31.2595 176.7394 17 D 4.7170 7.8209 117.2485 53.9908 41.4378 176.8372 18 A 4.2296 7.8006 124.5960 52.2871 20.2669 179.3778 19 L 3.9567 8.4916 125.3718 59.8831 40.9758 181.1959 20 K 4.2084 7.9298 119.0179 59.3169 32.1023 179.9340 21 V 3.6561 7.7258 112.2061 64.5212 31.4935 178.6492 22 T 3.8479 8.0931 115.4935 66.4949 68.3041 176.5197 23 A 4.0128 8.1446 122.7251 55.2543 18.3348 179.7478 24 L 3.9851 8.1081 117.2563 57.7136 41.5567 179.5491 25 A 3.8814 8.2406 121.0819 55.0786 18.2540 179.2999 26 E 3.9024 8.2567 117.9050 59.1930 29.6636 179.3053 27 V 3.5204 7.7744 118.1275 65.8337 31.6560 177.6613 28 A 3.9046 8.1886 120.7081 55.2332 18.3579 178.9666 29 E 3.9543 8.4389 118.0095 59.8906 29.5111 179.4672 30 R 4.0872 8.0727 116.0127 58.2814 30.1673 177.9365 31 L 4.5898 7.8356 116.8627 54.0047 41.9742 177.2274 32 G 3.9282 7.8405 106.7373 45.4594 0.0000 173.5883 33 W 4.7311 8.0818 119.0572 55.5012 30.6913 176.5936 34 T 4.5942 8.6354 113.9962 62.1172 70.1869 172.8206 35 H 5.7620 8.5404 115.4680 55.8329 31.1943 172.5804 36 E 4.7598 8.5610 116.3240 55.3660 33.2107 174.1506 37 R 5.3564 8.3419 119.9464 52.5677 31.3472 173.4990 38 P 4.2269 0.0000 0.0000 62.1687 32.5154 175.3557 39 D 4.6053 8.1663 121.9638 53.4838 41.8486 176.5060 40 F 4.9892 8.8164 124.4481 57.6767 39.4788 177.5341 41 T 4.0124 8.9123 113.9782 64.7707 68.1909 176.1802 42 D 4.3740 8.0383 121.0154 56.3713 39.7404 178.1606 43 L 4.2081 7.9520 119.9912 57.6654 41.3013 179.0179 44 D 4.5799 8.3660 118.6620 57.1338 40.5366 178.0054 45 A 4.0952 7.6829 118.9019 52.8097 19.9509 178.4308 46 R 4.3543 7.2445 119.2547 54.0547 28.9256 177.2228 47 R 4.1593 8.0183 120.5029 59.1572 30.7769 179.0879 48 D 4.4262 8.1719 116.0217 55.5683 39.3947 176.8663 49 L 4.4496 9.5371 118.4075 53.6873 42.1817 175.4680 50 G 4.4022 7.2838 106.2324 43.0490 0.0000 174.9323 51 Q 4.0317 8.1949 119.6063 57.8984 28.8083 177.5614 52 L 3.6199 7.6412 116.4221 53.8198 42.5074 178.2926 53 G 3.9119 7.8193 107.6022 46.1528 0.0000 175.4437 54 D 4.6393 8.3307 113.6934 53.1946 38.4256 177.7703 55 V 3.5596 7.6371 123.3205 65.4659 32.0502 176.6950 56 R 4.0032 8.1614 118.2212 59.5767 29.7580 178.5356 57 G 3.6403 8.3997 105.3474 47.7611 0.0000 175.9278 58 R 4.0289 8.2139 120.5785 59.0315 30.0248 179.0633 59 L 3.9629 8.1863 119.0465 57.9605 41.6694 179.4825 60 Q 3.9662 8.4235 119.7203 59.0039 28.9663 178.2090 61 R 3.9223 8.4330 120.1195 59.4405 30.1804 178.2266 62 L 4.1159 8.2870 120.2151 58.0090 41.9932 178.5039 63 L 3.9688 8.2084 120.4433 58.3894 42.0179 178.9406 64 E 3.9979 8.2564 118.3143 59.5129 29.4268 179.4737 65 I 3.7423 7.8870 119.6801 64.2624 37.0765 178.4370 66 A 4.0397 8.4879 122.1219 55.0058 18.0107 179.4934 67 R 3.8127 8.1628 116.3531 59.6529 30.3360 178.0646 68 A 4.1303 8.0244 120.1852 55.3465 18.3716 179.5080 69 A 3.9738 7.9730 119.3445 55.3884 18.0187 179.7478 70 T 4.5872 8.2232 109.1532 63.5486 68.7196 175.6758 71 E 4.2926 7.6641 119.8424 56.9482 29.7597 176.7728 72 K 4.4402 9.0929 117.7892 54.7231 34.7978 176.3445 73 G 3.9455 6.7512 105.1030 44.5639 0.0000 169.6050 74 P 4.7369 0.0000 0.0000 62.6804 32.7812 176.0091 75 V 5.0696 8.4236 121.2420 61.2959 35.0858 173.9825 76 V 4.8322 9.0885 127.8654 61.2580 33.8019 174.0792 77 L 5.3293 8.5034 127.0263 53.2319 44.1151 175.4105 78 A 5.6209 8.2504 123.4173 50.2504 23.3284 174.9649 79 G 4.1031 7.9349 104.7678 45.9794 0.0000 172.2925 80 S 4.6467 8.1334 113.5940 56.5089 65.7064 173.7708 81 S 4.2325 8.9712 120.5283 57.8139 62.7412 173.9307 82 L 4.0442 9.0173 119.1597 58.1929 41.2725 177.8543 83 G 3.5395 8.2789 105.5876 47.7616 0.0000 175.9397 84 S 4.0460 7.7154 116.9739 61.3435 62.9019 175.7800 85 Y 3.9175 8.0246 122.4989 60.7913 38.4831 178.4262 86 I 3.5809 7.9290 113.5764 63.4592 37.7173 178.0074 87 A 3.9005 7.9040 122.5500 54.9419 18.1890 179.3841 88 A 3.8886 7.9704 119.3257 55.5050 18.5713 179.9150 89 Q 3.8906 7.6782 116.5312 59.0703 28.6314 179.2689 90 V 3.6506 8.0874 119.7965 65.6901 31.3062 178.1386 91 S 4.5771 7.7559 114.6436 60.5633 62.7757 176.0619 92 L 4.1889 7.7550 121.2190 56.4549 41.4812 177.3458 93 Q 4.6308 8.1867 116.1000 55.2661 30.6793 175.7930 94 V 4.5280 7.3896 116.1599 58.5719 34.4917 173.3031 95 P 4.3974 0.0000 0.0000 63.0417 31.8819 175.6948 96 T 4.6647 8.2903 119.8151 61.3724 71.1126 174.9678 97 R 4.0927 9.1803 127.4478 59.3355 30.7481 176.1228 98 A 4.6643 7.4966 117.0739 51.2714 22.7474 174.8576 99 L 5.1746 8.7870 121.0246 53.3151 45.8574 174.9041 100 F 5.2866 9.2714 128.4604 56.7444 42.0011 173.8372 101 L 4.6066 7.9475 126.6658 52.0416 45.8383 176.2269 *103 V 4.4183 7.6955 109.0097 61.2276 31.6524 174.4778 104 P 4.5170 0.0000 0.0000 61.5933 32.5003 175.1752 105 P 4.3770 0.0000 0.0000 62.6430 32.3404 176.2954 106 T 3.9980 8.2610 110.3594 62.3567 69.7382 173.8886 107 K 4.8987 7.4963 120.1328 54.3690 36.2777 176.3174 *109 G 3.9828 7.8635 108.5677 45.4800 0.0000 173.8495 110 P 4.2555 0.0000 0.0000 63.3061 31.4720 176.1330 111 L 4.4187 6.9401 119.8827 53.0537 42.6244 174.7810 112 P 4.3308 0.0000 0.0000 62.7399 31.7777 176.5582 113 A 4.3148 8.4340 123.1408 51.7219 19.2602 177.0576 114 L 4.0402 8.3571 122.1311 56.0368 42.4894 175.8988 115 D 5.2757 8.5610 123.5789 53.8268 44.7002 173.4114 116 A 4.8739 8.5971 121.4761 51.1971 21.9430 176.1461 117 A 4.1077 8.4551 123.0941 52.2922 19.4901 178.3713 118 A 4.3398 8.1928 123.3129 51.7521 17.5237 176.3539 119 V 4.5173 6.9962 114.4847 57.7564 35.8964 174.4542 120 P 4.4000 0.0000 0.0000 63.4440 32.3136 175.7455 121 I 5.0896 8.4940 124.2809 59.5084 40.8400 174.2168 122 S 5.1839 9.2662 121.2114 56.5359 65.5046 172.5870 123 I 4.7760 8.6455 126.9364 59.3293 40.7576 174.4807 124 V 4.6543 8.1119 126.1368 61.4432 33.2050 174.1564 125 H 4.9401 9.1811 127.2860 54.1211 34.1655 171.6400 126 A 4.7232 7.6834 124.1547 50.4635 19.6070 178.2849 127 W 4.3589 8.9147 124.1165 59.9283 29.2856 177.0744 128 H 4.9824 8.0019 113.1609 55.3091 28.8294 174.3734 129 D 4.5090 7.9030 120.4125 54.5091 41.2539 177.0562 130 E 4.2352 8.8399 124.5591 58.2322 30.3491 177.4705 131 L 4.2433 8.0682 118.1523 55.4118 42.6600 176.0338 132 I 4.3559 8.0850 118.9889 58.1666 38.3590 173.1047 133 P 4.2695 0.0000 0.0000 62.6863 31.9998 177.5936 134 A 4.0382 9.0339 124.0823 55.5300 18.1481 179.7267 135 A 4.0535 8.1453 118.5124 55.4323 18.4103 179.5278 136 D 4.2957 8.1870 117.5654 57.5893 40.9249 179.1358 137 V 3.6330 7.6166 118.2903 65.7296 31.5512 177.8723 138 I 3.6690 8.1602 119.9239 64.4310 37.1165 178.2439 139 A 4.0367 8.3325 121.7461 54.8038 17.8324 179.5185 140 W 3.8747 8.2823 126.6198 60.5357 30.8003 178.1529 141 A 3.9857 8.7717 121.2501 55.1998 17.9555 179.2763 142 Q 3.8560 8.5877 118.3406 59.3752 28.8642 178.5396 143 A 4.0028 7.7052 120.3565 54.0938 18.4109 178.7336 144 R 4.2397 6.8237 113.2602 54.7221 31.2034 175.9703 145 S 3.6253 7.6823 113.2162 59.2184 61.2307 172.4148 146 A 4.3103 7.7744 119.9694 51.3753 19.5197 178.7501 147 R 4.0168 8.4355 120.6817 56.6004 31.3898 175.3595 148 L 5.1290 8.4004 127.0399 53.2787 45.2469 174.7240 149 L 4.6216 8.9763 128.8276 53.3095 44.2959 174.6469 150 L 4.7820 8.2889 126.2534 53.0007 43.2969 176.3304 151 V 4.4061 7.9550 116.1295 59.3475 35.8132 174.9868 152 D 4.9287 8.7750 123.2597 53.6207 39.6905 174.0766 153 D 4.5697 8.2372 122.8946 53.6187 45.6459 173.2915 154 G 4.3701 8.2178 109.2706 43.9151 0.0000 173.2885 155 H 4.2432 8.7920 117.1432 58.6515 29.6961 177.1509 156 R 3.9981 7.9882 116.2721 56.8355 30.3446 176.2167 157 L 3.8579 8.2389 117.4707 55.3837 39.8403 176.9816 158 G 3.5517 8.3991 108.2405 47.9088 0.0000 174.9798 159 A 4.6055 8.3190 120.8356 52.3145 19.3507 176.4382 160 H 4.9504 8.1711 114.4407 55.2842 30.3849 176.4340 161 V 3.6706 8.2211 123.5795 66.7675 31.3966 177.6239 162 Q 4.0060 8.0391 119.8306 60.0869 28.1154 180.0681 163 A 4.2114 8.0485 122.3704 55.0485 18.4229 179.4892 164 A 4.1542 8.4012 119.5052 55.3994 18.3746 180.0622 165 S 4.0708 8.3305 113.7896 61.8525 62.8591 177.1681 166 R 3.8822 8.2802 120.6294 59.1101 29.7812 178.9845 167 A 4.2040 8.2057 120.6460 55.1252 18.3358 179.4507 168 F 3.4151 8.1108 119.0766 61.0332 39.2232 177.0669 169 A 3.6469 8.0169 120.5322 55.2893 17.9289 179.4689 170 E 3.9873 8.0323 115.8862 59.2444 29.7501 179.2151 171 L 4.0395 7.6521 120.3489 58.2529 42.3792 179.0188 172 L 3.5380 7.5616 119.1703 57.7229 41.2109 179.4201 173 Q 4.2032 8.0758 116.9352 57.8057 28.7446 177.7245 174 S 4.4560 7.7345 113.8699 58.9928 63.6416 174.1069 175 L 4.3123 7.7014 127.5175 55.0771 41.5832 176.1828 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 0 G 8.35 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 0.00 0.00 0.00 *2 S 8.45 4.08 0.00 3.78 3.72 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 3 R 8.40 3.63 0.00 1.38 1.69 0.00 2.76 0.00 0.00 2.90 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 0.50 0.00 4 G 5.58 3.79 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 0.00 5 H 8.74 5.69 0.00 3.28 3.25 0.00 5.79 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 6 C 9.39 5.32 0.00 2.99 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 7 I 8.88 4.86 1.95 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 1.33 0.93 1.00 0.00 0.00 8 L 8.91 5.09 0.00 1.60 1.55 1.01 0.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 9 A 8.93 5.14 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 10 H 9.13 4.63 0.00 3.21 3.42 0.00 5.72 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 G 8.56 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 12 F 8.78 4.74 0.00 2.90 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 13 E 7.99 3.50 0.00 1.77 1.76 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 1.72 1.47 0.00 14 S 7.40 4.70 0.00 3.86 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 15 G 7.76 3.71 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 0.00 0.00 0.00 16 P 0.00 4.44 0.00 2.18 2.32 0.00 3.66 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.95 0.00 17 D 7.82 4.72 0.00 2.66 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 A 7.80 4.23 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 19 L 8.49 3.96 0.00 1.66 1.71 0.92 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 20 K 7.93 4.21 0.00 1.79 1.88 0.00 1.63 0.00 0.00 1.91 0.00 0.00 2.94 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.53 1.52 7.81 21 V 7.73 3.66 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 0.84 0.00 0.00 1.06 0.00 0.00 22 T 8.09 3.85 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 1.21 0.00 0.00 23 A 8.14 4.01 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 24 L 8.11 3.99 0.00 1.70 1.35 0.49 0.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 25 A 8.24 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 26 E 8.26 3.90 0.00 2.16 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 0.00 2.30 2.19 0.00 27 V 7.77 3.52 2.39 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 0.82 0.00 0.00 0.99 0.00 0.00 28 A 8.19 3.90 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 29 E 8.44 3.95 0.00 2.18 2.18 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 2.36 2.46 0.00 30 R 8.07 4.09 0.00 1.83 1.99 0.00 3.20 0.00 0.00 3.22 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.80 0.00 31 L 7.84 4.59 0.00 1.76 1.83 0.91 0.81 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 32 G 7.84 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 0.00 0.00 0.00 33 W 8.08 4.73 0.00 3.28 3.25 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 34 T 8.64 4.59 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 1.23 0.00 0.00 35 H 8.54 5.76 0.00 3.17 3.37 0.00 5.32 0.00 0.00 0.00 0.00 6.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 E 8.56 4.76 0.00 2.04 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 0.00 2.34 2.39 0.00 37 R 8.34 5.36 0.00 1.69 1.92 0.00 3.55 0.00 0.00 2.25 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.50 0.00 38 P 0.00 4.23 0.00 1.00 1.61 0.00 3.83 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 2.06 2.04 0.00 39 D 8.17 4.61 0.00 2.54 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 40 F 8.82 4.99 0.00 3.03 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 T 8.91 4.01 4.22 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 1.24 0.00 0.00 42 D 8.04 4.37 0.00 2.88 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 43 L 7.95 4.21 0.00 2.03 1.85 1.18 1.22 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 44 D 8.37 4.58 0.00 2.65 2.45 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 45 A 7.68 4.10 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 46 R 7.24 4.35 0.00 1.90 2.03 0.00 3.34 0.00 0.00 3.19 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.77 0.00 47 R 8.02 4.16 0.00 1.99 2.03 0.00 3.25 0.00 0.00 3.39 7.36 0.00 0.00 0.00 0.00 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0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.52 0.00 65 I 7.89 3.74 2.06 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 1.47 0.95 1.00 0.00 0.00 66 A 8.49 4.04 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 67 R 8.16 3.81 0.00 1.88 2.25 0.00 3.43 0.00 0.00 3.25 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.72 0.00 68 A 8.02 4.13 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 69 A 7.97 3.97 1.48 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 0.00 0.00 70 T 8.22 4.59 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 1.35 0.00 0.00 71 E 7.66 4.29 0.00 2.07 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 2.34 2.49 0.00 72 K 9.09 4.44 0.00 1.84 1.79 0.00 1.85 0.00 0.00 1.71 0.00 0.00 2.99 0.00 0.00 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0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.70 0.00 0.00 1.00 0.00 0.00 125 H 9.18 4.94 0.00 3.06 2.89 0.00 5.82 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 0.00 126 A 7.68 4.72 1.20 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 0.00 0.00 0.00 127 W 8.91 4.36 0.00 3.09 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 0.00 128 H 8.00 4.98 0.00 3.37 3.33 0.00 5.66 0.00 0.00 0.00 0.00 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 129 D 7.90 4.51 0.00 2.73 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 0.00 130 E 8.84 4.24 0.00 2.12 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 0.00 2.27 2.31 0.00 131 L 8.07 4.24 0.00 1.57 1.62 0.74 0.70 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 0.00 132 I 8.09 4.36 1.96 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.55 0.88 0.00 0.00 133 P 0.00 4.27 0.00 2.19 2.03 0.00 3.75 0.00 0.00 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.11 0.00 134 A 9.03 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 0.00 135 A 8.15 4.05 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 0.00 136 D 8.19 4.30 0.00 2.85 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 0.00 137 V 7.62 3.63 1.80 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 0.88 0.00 0.00 0.58 0.00 0.00 138 I 8.16 3.67 2.05 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.44 0.94 0.00 0.00 139 A 8.33 4.04 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 0.00 140 W 8.28 3.87 0.00 3.56 3.33 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 0.00 141 A 8.77 3.99 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 0.00 142 Q 8.59 3.86 0.00 2.20 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.74 0.00 0.00 0.00 0.00 0.00 2.34 2.37 0.00 143 A 7.71 4.00 1.18 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 0.00 0.00 144 R 6.82 4.24 0.00 1.20 1.66 0.00 2.21 0.00 0.00 2.37 7.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 1.07 0.00 145 S 7.68 3.63 0.00 3.94 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 0.00 146 A 7.77 4.31 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 0.00 147 R 8.44 4.02 0.00 1.95 1.86 0.00 3.09 0.00 0.00 3.13 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.60 0.00 148 L 8.40 5.13 0.00 1.60 1.44 0.82 0.85 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 0.00 149 L 8.98 4.62 0.00 1.76 1.46 0.92 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 150 L 8.29 4.78 0.00 0.77 0.13 0.35 0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.00 0.00 0.00 0.00 0.00 0.00 151 V 7.95 4.41 1.65 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 0.65 0.00 0.00 0.76 0.00 0.00 152 D 8.77 4.93 0.00 2.84 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 0.00 153 D 8.24 4.57 0.00 2.74 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 0.00 154 G 8.22 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 0.00 0.00 0.00 0.00 155 H 8.79 4.24 0.00 3.22 3.39 0.00 5.75 0.00 0.00 0.00 0.00 7.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 156 R 7.99 4.00 0.00 1.85 1.97 0.00 3.43 0.00 0.00 3.25 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.68 0.00 157 L 8.24 3.86 0.00 1.82 1.72 0.85 0.60 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 0.00 158 G 8.40 3.55 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 0.00 159 A 8.32 4.61 1.25 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 0.00 160 H 8.17 4.95 0.00 3.24 3.28 0.00 5.82 0.00 0.00 0.00 0.00 7.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 161 V 8.22 3.67 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 1.03 0.00 0.00 0.99 0.00 0.00 162 Q 8.04 4.01 0.00 2.10 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.68 0.00 0.00 0.00 0.00 0.00 2.36 1.99 0.00 163 A 8.05 4.21 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 0.00 164 A 8.40 4.15 1.49 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 0.00 0.00 0.00 165 S 8.33 4.07 0.00 4.07 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 0.00 166 R 8.28 3.88 0.00 2.09 1.99 0.00 3.14 0.00 0.00 3.18 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.77 0.00 167 A 8.21 4.20 1.61 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 0.00 0.00 0.00 0.00 0.00 0.00 168 F 8.11 3.42 0.00 1.62 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 0.00 169 A 8.02 3.65 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 0.00 170 E 8.03 3.99 0.00 2.11 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 2.33 2.38 0.00 171 L 7.65 4.04 0.00 1.82 1.67 0.96 0.84 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 0.00 172 L 7.56 3.54 0.00 1.32 1.10 -0.23 -0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.23 0.00 0.00 0.00 0.00 0.00 0.00 173 Q 8.08 4.20 0.00 2.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.87 0.00 0.00 0.00 0.00 0.00 2.38 2.36 0.00 174 S 7.73 4.46 0.00 4.04 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 0.00 175 L 7.70 4.31 0.00 2.06 1.82 0.77 0.70 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 * Residues marked with a * may have inaccurate shift predictions.