NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 10 F 4.8446 8.1676 115.8839 57.2791 40.2837 176.6822 11 H 3.2384 5.5629 117.6326 56.7999 28.3764 173.3794 12 E 3.8049 8.1569 122.5973 59.1561 30.1279 180.0406 13 M 4.5225 7.1549 115.6003 55.5993 31.9602 177.5570 14 R 4.6511 7.8420 116.6959 55.8853 34.3495 175.7131 15 E 4.0836 8.1487 117.0618 55.0556 30.1215 174.9086 16 P 4.3340 0.0000 0.0000 63.1885 32.3654 175.0411 17 R 4.2779 7.6367 115.4089 55.5166 33.2696 173.6239 18 I 4.4964 8.2386 121.0416 60.6583 37.5298 175.4351 19 E 4.3106 9.0641 129.6573 58.3341 30.3184 176.4960 20 K 4.7559 7.4956 115.7231 56.0155 36.1198 174.8009 21 V 5.1980 8.5930 121.7239 60.2878 34.1638 174.0983 22 V 4.6139 8.0903 128.6562 61.6621 33.4705 174.7163 23 V 4.8031 8.5374 121.4822 59.8858 34.1469 174.2766 24 H 5.2437 9.0673 124.5320 54.6951 34.5428 171.9254 25 M 4.5271 8.3868 121.4171 53.3410 34.4615 175.7730 26 G 3.8190 8.1494 114.1828 46.3840 0.0000 173.0874 27 I 3.8112 8.2757 126.3858 61.7698 36.3847 177.7717 28 G 5.0781 5.3800 127.0700 46.8478 0.0000 172.2442 29 H 4.5413 7.3970 113.5289 55.6978 30.9902 174.6519 *35 A 4.3053 7.2457 122.5712 51.9330 18.6618 178.6090 36 N 4.4016 8.9734 112.6770 55.8967 37.3570 175.8991 37 A 4.2927 7.7702 121.3395 53.5173 19.7204 178.9020 38 E 3.9491 8.6831 116.7003 59.5368 29.3249 178.8274 39 D 4.4060 8.2069 118.5765 57.6170 40.8331 179.0638 40 I 3.7766 7.5698 113.2694 64.0340 37.6445 178.2753 41 L 4.1128 7.9548 120.5026 57.2471 41.3904 179.5831 42 G 3.5742 8.0257 105.6732 47.3175 0.0000 175.7442 43 E 4.0388 7.7774 119.8836 58.9765 29.5581 179.0316 44 I 3.9708 8.2003 118.4419 63.8815 38.0832 176.2047 45 T 4.5187 9.3986 109.3584 61.0971 69.6286 173.5978 46 G 3.4346 6.6134 115.6174 43.8883 0.0000 172.2143 47 Q 4.5511 7.6059 117.8343 54.6482 31.5728 173.7471 48 M 4.0498 8.4492 118.6231 55.4169 32.4440 174.7525 49 P 4.9119 0.0000 0.0000 61.6968 34.5504 174.3887 50 V 4.4197 8.3503 118.2453 61.0688 34.4150 175.5444 51 R 4.3822 8.8769 126.5664 57.2136 31.2453 176.5433 52 T 4.4872 8.9715 117.7822 61.8232 71.4886 174.0216 53 K 5.2169 8.9423 125.3834 55.3063 33.5841 175.7581 54 A 4.8847 7.9394 122.5699 50.1771 22.1573 175.4856 55 K 4.5966 8.0837 116.7874 55.7108 35.7380 175.3487 56 R 4.0961 8.6794 124.0512 56.0392 29.7439 176.2131 57 T 4.5288 8.1943 116.6097 62.8160 69.8120 174.6354 58 V 4.5371 8.5732 124.5491 60.6303 34.5602 176.9299 59 G 3.6820 8.7397 114.1680 48.4068 0.0000 174.6024 60 E 4.2704 8.0922 119.1132 58.1961 28.2451 176.0837 61 F 4.1522 7.7468 112.3635 60.3966 39.2146 174.7105 62 D 5.0202 7.8260 113.9816 52.4329 40.6405 176.1283 63 I 4.0289 7.6155 114.1593 62.6522 39.0983 177.2015 64 R 3.8459 7.9351 121.2787 55.9782 29.8353 174.6378 65 E 3.7436 8.5802 128.2692 58.3672 29.7444 176.0027 66 G 4.2166 8.1381 114.0605 46.1487 0.0000 172.6535 67 D 4.6090 8.5715 122.5860 51.1760 42.2616 173.4517 68 P 4.4733 0.0000 0.0000 63.8046 31.2695 175.8362 69 I 4.6872 8.9205 121.1212 61.7058 42.9389 174.5076 70 G 4.3558 7.8104 107.1732 45.7250 0.0000 171.5870 71 A 5.9400 8.5275 119.0133 50.1376 23.2331 175.2915 72 K 5.1037 8.3785 116.8920 55.9444 36.7566 175.0142 73 V 4.7164 8.4470 120.0401 61.5492 35.0727 173.5646 74 T 4.6154 8.5697 118.3905 60.2214 70.0226 173.5644 75 L 4.7351 8.4266 126.9947 53.1145 44.0557 176.1297 76 R 4.7150 7.9071 120.0316 55.2720 34.1929 176.7032 77 D 4.3197 8.8426 119.6933 55.3133 38.9181 175.7432 78 E 3.9591 9.0448 121.0551 61.3039 29.2804 178.6645 79 M 3.9435 8.2062 116.0977 58.7576 32.0224 178.3882 80 A 4.2328 8.0696 120.5043 54.9181 18.7048 179.5650 81 E 4.0067 8.0144 116.5359 59.7615 29.6040 179.1812 82 E 4.1197 8.3504 117.0877 58.7512 29.7204 178.4248 83 F 4.4690 7.8859 120.4004 60.0739 39.8603 177.3907 84 L 4.1485 8.4241 119.0469 57.1799 41.2534 178.7123 85 Q 4.1021 7.7744 114.0702 56.8002 28.3702 176.1288 86 T 4.4886 7.6895 108.6329 62.9344 73.7715 175.2469 87 A 3.9236 8.0336 125.4034 54.8260 18.9755 179.1072 88 L 3.6012 8.1737 114.8855 57.5875 41.9417 178.0190 89 P 4.1648 0.0000 0.0000 65.9741 31.2247 177.6032 90 L 4.3356 7.9417 113.8149 54.8428 40.9751 176.3325 91 A 4.7573 7.9284 120.5596 50.9286 22.1553 177.1953 92 E 4.5113 8.2967 119.8880 53.5700 29.1651 175.5500 93 L 3.9805 8.0093 121.1925 55.0325 41.4268 176.4304 94 A 5.4441 8.1851 122.6657 49.2984 22.1230 176.0951 95 T 3.8282 7.9068 115.9174 65.4179 69.0516 177.2473 96 S 4.1720 8.0959 118.4881 62.0704 62.4841 176.1203 97 Q 4.2916 7.9940 113.7944 56.8250 28.2444 175.4452 98 F 4.9772 8.3942 117.7689 55.5037 40.8640 175.2789 99 D 4.7218 9.5988 124.5186 54.1028 41.8949 175.7318 100 D 4.6362 8.5027 119.6169 56.3294 41.1877 177.8915 101 T 4.2221 9.2072 114.8748 63.7587 68.7603 175.3465 102 G 4.0366 8.3988 109.4872 45.7874 0.0000 172.9448 103 N 4.9984 7.7972 116.8891 51.5021 41.3324 173.2359 104 F 4.5691 7.4139 110.1211 56.3591 41.2862 173.1255 105 S 5.0567 8.3491 111.9661 56.6143 65.3173 172.9928 106 F 4.9630 8.9674 121.0821 55.7834 41.3684 173.8925 107 G 4.1007 8.7718 103.0713 44.6168 0.0000 173.0819 *128 L 3.9890 8.4121 123.1506 55.1370 43.5692 176.6374 129 D 4.8143 8.9165 127.3139 53.2716 43.1518 176.1478 130 V 4.4756 7.9952 121.1535 61.5524 34.5760 174.1251 131 T 4.8110 8.8525 125.1040 61.5365 72.0750 173.4900 132 V 4.5184 7.7861 124.5642 61.0334 34.4377 173.5738 133 N 4.6199 9.2496 127.7315 52.2927 40.1761 173.4461 134 L 5.2415 8.1146 126.0822 53.1743 44.3239 175.9270 135 V 4.2608 7.8463 120.2820 61.0173 34.9975 172.1781 136 R 3.9937 8.9343 117.7676 56.8587 31.0232 176.7779 137 P 3.2258 0.0000 0.0000 62.6797 33.0752 178.3989 138 G 4.0243 9.2120 115.8152 46.5554 0.0000 174.3310 139 Y 4.3297 7.7705 119.7491 59.8336 39.4929 175.8512 140 R 3.7970 8.1766 119.4217 59.3588 29.9353 177.9964 141 V 3.5095 7.3613 116.9738 65.4358 31.1843 176.7986 142 A 4.7488 7.5693 118.5033 51.1206 19.4628 177.1799 143 K 4.2293 7.3436 115.2052 56.0335 33.9707 176.5462 144 R 4.2728 7.7139 115.4622 55.7242 30.7775 175.9119 145 D 4.5632 8.4957 116.2702 56.2952 41.7046 177.7637 146 K 4.0916 7.8837 118.1915 57.1912 32.8148 176.5842 147 A 3.8965 8.8338 124.1122 52.4494 16.3004 176.8129 148 S 4.4813 7.1365 113.1746 61.0019 63.6752 173.5724 149 R 4.5030 8.4186 117.4654 55.3155 33.6430 174.0064 150 S 4.4419 8.6555 119.9641 58.0440 63.4990 173.5721 151 I 4.0142 8.1946 126.3288 60.1063 37.8039 174.4642 152 P 4.3693 0.0000 0.0000 62.8313 32.1336 177.1361 153 T 3.9025 8.8485 113.3826 65.3303 68.1014 176.4359 154 K 4.0005 8.1203 119.5557 59.1794 32.1832 177.5388 155 H 4.6815 8.0237 115.1676 55.5171 30.1781 175.2420 156 R 4.2215 7.6471 119.0789 56.2160 30.7547 175.7262 157 L 4.4227 8.0301 121.8077 54.5183 43.4335 175.5727 158 N 5.1909 8.1083 116.4335 49.7294 43.7204 173.8542 159 P 4.3830 0.0000 0.0000 66.1850 31.4433 178.3182 160 A 4.0535 8.1225 118.6046 55.9027 18.2013 179.1454 161 D 4.3234 8.1788 115.5716 57.0637 40.9369 179.2306 162 A 4.0761 8.2478 121.8031 55.1401 18.5253 179.3996 163 V 3.2948 8.4742 117.4424 66.8154 31.3967 177.2968 164 A 3.9210 8.3012 119.6988 55.3944 17.8115 178.9460 165 F 4.0119 8.3820 118.4667 61.7501 39.9561 178.0158 166 I 3.5216 8.1123 118.5471 64.4321 36.8863 177.8978 167 E 4.2566 8.4565 120.4812 58.6320 29.5011 177.9959 168 S 4.5008 8.0206 112.2566 57.6869 64.6502 175.1232 169 T 4.7533 7.7927 112.3587 63.2172 71.1477 173.2311 170 Y 3.3437 7.8526 118.1608 58.2941 35.0823 168.6506 171 D 4.3313 6.7920 117.5035 53.6392 41.8464 174.9407 172 V 4.5763 7.9505 117.7997 60.5845 35.2807 177.6052 173 E 4.3880 9.0386 124.2656 56.5287 28.9816 177.2937 174 V 3.7193 7.7667 116.9950 61.9748 31.8474 175.1087 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 10 F 8.17 4.84 0.00 3.36 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 11 H 5.56 3.24 0.00 2.99 2.14 0.00 5.48 0.00 0.00 0.00 0.00 6.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 12 E 8.16 3.80 0.00 1.63 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 0.00 2.30 2.26 0.00 13 M 7.15 4.52 0.00 1.89 2.07 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.63 2.62 0.00 14 R 7.84 4.65 0.00 1.89 1.92 0.00 3.42 0.00 0.00 3.41 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.91 0.00 15 E 8.15 4.08 0.00 2.10 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 2.48 2.25 0.00 16 P 0.00 4.33 0.00 0.93 1.51 0.00 3.72 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.00 0.00 17 R 7.64 4.28 0.00 1.80 1.85 0.00 2.73 0.00 0.00 3.12 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.50 0.00 18 I 8.24 4.50 1.95 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.84 0.95 0.00 0.00 19 E 9.06 4.31 0.00 1.80 1.93 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 2.26 2.24 0.00 20 K 7.50 4.76 0.00 1.84 1.80 0.00 1.45 0.00 0.00 1.72 0.00 0.00 2.95 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.32 1.34 7.81 21 V 8.59 5.20 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 0.87 0.00 0.00 0.98 0.00 0.00 22 V 8.09 4.61 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 0.86 0.00 0.00 0.84 0.00 0.00 23 V 8.54 4.80 1.93 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 0.29 0.00 0.00 0.61 0.00 0.00 24 H 9.07 5.24 0.00 3.29 2.97 0.00 5.52 0.00 0.00 0.00 0.00 6.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 M 8.39 4.53 0.00 1.91 1.84 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.42 2.38 0.00 26 G 8.15 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 27 I 8.28 3.81 1.91 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.67 0.78 0.00 0.00 28 G 5.38 5.08 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 0.00 0.00 0.00 29 H 7.40 4.54 0.00 3.11 3.28 0.00 5.76 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *35 A 7.25 4.31 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 36 N 8.97 4.40 0.00 2.83 2.97 0.00 0.00 5.81 7.26 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 37 A 7.77 4.29 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 38 E 8.68 3.95 0.00 2.01 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 2.31 2.54 0.00 39 D 8.21 4.41 0.00 2.68 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 40 I 7.57 3.78 1.88 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 1.75 1.20 0.91 0.00 0.00 41 L 7.95 4.11 0.00 1.83 1.71 0.93 0.87 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 42 G 8.03 3.57 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 0.00 0.00 0.00 43 E 7.78 4.04 0.00 1.95 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 2.35 2.64 0.00 44 I 8.20 3.97 2.04 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 0.85 1.10 0.00 0.00 45 T 9.40 4.52 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 0.91 0.00 0.00 46 G 6.61 3.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 7.61 4.55 0.00 2.19 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.08 6.86 0.00 0.00 0.00 0.00 0.00 2.19 2.27 0.00 48 M 8.45 4.05 0.00 2.01 2.03 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.53 0.00 49 P 0.00 4.91 0.00 2.02 2.04 0.00 3.42 0.00 0.00 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.04 0.00 50 V 8.35 4.42 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 0.84 0.00 0.00 0.94 0.00 0.00 51 R 8.88 4.38 0.00 1.72 1.85 0.00 3.35 0.00 0.00 3.28 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.61 0.00 52 T 8.97 4.49 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 1.21 0.00 0.00 53 K 8.94 5.22 0.00 1.63 1.78 0.00 1.72 0.00 0.00 2.35 0.00 0.00 2.80 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.42 1.27 7.81 54 A 7.94 4.88 1.22 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 0.00 0.00 55 K 8.08 4.60 0.00 1.59 1.67 0.00 1.85 0.00 0.00 1.70 0.00 0.00 2.88 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.32 1.42 7.81 56 R 8.68 4.10 0.00 1.98 1.98 0.00 3.20 0.00 0.00 3.23 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.64 0.00 57 T 8.19 4.53 4.26 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 1.24 0.00 0.00 58 V 8.57 4.54 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 1.08 0.00 0.00 0.99 0.00 0.00 59 G 8.74 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 60 E 8.09 4.27 0.00 2.14 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 2.31 2.34 0.00 61 F 7.75 4.15 0.00 3.02 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 62 D 7.83 5.02 0.00 2.92 2.54 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 63 I 7.62 4.03 1.93 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.81 1.05 0.00 0.00 64 R 7.94 3.85 0.00 1.78 2.17 0.00 3.22 0.00 0.00 3.25 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.62 0.00 65 E 8.58 3.74 0.00 2.04 1.73 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 2.37 2.32 0.00 66 G 8.14 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 0.00 0.00 0.00 0.00 67 D 8.57 4.61 0.00 2.64 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 68 P 0.00 4.47 0.00 1.93 2.06 0.00 3.63 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.14 0.00 69 I 8.92 4.69 2.02 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 1.41 0.85 0.00 0.00 70 G 7.81 4.36 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 0.00 71 A 8.53 5.94 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 72 K 8.38 5.10 0.00 1.75 1.87 0.00 1.41 0.00 0.00 1.69 0.00 0.00 2.75 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.36 1.39 7.81 73 V 8.45 4.72 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 1.01 0.00 0.00 0.85 0.00 0.00 74 T 8.57 4.62 4.19 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 1.15 0.00 0.00 75 L 8.43 4.74 0.00 1.61 1.54 0.59 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 76 R 7.91 4.72 0.00 1.62 1.76 0.00 3.31 0.00 0.00 3.22 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.61 0.00 77 D 8.84 4.32 0.00 2.88 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 78 E 9.04 3.96 0.00 2.02 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 2.42 2.43 0.00 79 M 8.21 3.94 0.00 1.97 2.33 0.00 0.00 0.00 0.00 0.00 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.60 0.00 80 A 8.07 4.23 1.37 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 81 E 8.01 4.01 0.00 2.17 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 2.46 2.45 0.00 82 E 8.35 4.12 0.00 1.96 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 2.36 2.57 0.00 83 F 7.89 4.47 0.00 3.25 3.28 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 84 L 8.42 4.15 0.00 1.90 1.77 1.07 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 85 Q 7.77 4.10 0.00 1.94 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.83 0.00 0.00 0.00 0.00 0.00 2.18 2.58 0.00 86 T 7.69 4.49 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 1.14 0.00 0.00 87 A 8.03 3.92 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.17 3.60 0.00 1.75 1.67 0.95 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 89 P 0.00 4.16 0.00 2.14 2.13 0.00 3.68 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 1.99 2.11 0.00 90 L 7.94 4.34 0.00 1.81 1.73 0.91 0.58 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 91 A 7.93 4.76 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 92 E 8.30 4.51 0.00 1.95 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 0.00 2.20 2.29 0.00 93 L 8.01 3.98 0.00 1.57 1.62 0.72 0.48 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 94 A 8.19 5.44 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 95 T 7.91 3.83 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 1.17 0.00 0.00 96 S 8.10 4.17 0.00 4.02 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 97 Q 7.99 4.29 0.00 2.55 2.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.10 6.80 0.00 0.00 0.00 0.00 0.00 2.49 2.45 0.00 98 F 8.39 4.98 0.00 3.10 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 99 D 9.60 4.72 0.00 2.67 2.87 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 0.00 100 D 8.50 4.64 0.00 2.72 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 0.00 101 T 9.21 4.22 4.29 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 1.23 0.00 0.00 102 G 8.40 4.04 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 0.00 0.00 0.00 103 N 7.80 5.00 0.00 2.77 2.67 0.00 0.00 6.58 8.13 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 0.00 104 F 7.41 4.57 0.00 2.78 1.86 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 0.00 105 S 8.35 5.06 0.00 3.72 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 0.00 106 F 8.97 4.96 0.00 3.20 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 0.00 107 G 8.77 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 *128 L 8.41 3.99 0.00 1.75 1.62 0.95 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 129 D 8.92 4.81 0.00 2.77 2.49 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 0.00 130 V 8.00 4.48 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 0.00 0.00 0.91 0.00 0.00 0.85 0.00 0.00 131 T 8.85 4.81 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 1.07 0.00 0.00 132 V 7.79 4.52 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 1.03 0.00 0.00 0.77 0.00 0.00 133 N 9.25 4.62 0.00 2.76 2.56 0.00 0.00 6.58 6.68 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 0.00 134 L 8.11 5.24 0.00 1.65 1.43 1.27 1.06 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 0.00 135 V 7.85 4.26 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 0.24 0.00 0.00 0.70 0.00 0.00 136 R 8.93 3.99 0.00 1.74 2.03 0.00 3.06 0.00 0.00 2.84 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.47 0.00 137 P 0.00 3.23 0.00 2.14 1.88 0.00 3.66 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 2.04 2.11 0.00 138 G 9.21 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 0.00 0.00 0.00 139 Y 7.77 4.33 0.00 3.19 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 0.00 140 R 8.18 3.80 0.00 1.93 1.94 0.00 3.25 0.00 0.00 3.26 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.68 0.00 141 V 7.36 3.51 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 0.92 0.00 0.00 0.98 0.00 0.00 142 A 7.57 4.75 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 143 K 7.34 4.23 0.00 1.61 1.78 0.00 1.74 0.00 0.00 1.63 0.00 0.00 3.13 0.00 0.00 3.26 0.00 0.00 0.00 0.00 0.75 1.31 7.81 144 R 7.71 4.27 0.00 1.89 1.94 0.00 3.09 0.00 0.00 3.19 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 1.55 0.00 145 D 8.50 4.56 0.00 2.67 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 0.00 146 K 7.88 4.09 0.00 1.80 1.70 0.00 1.80 0.00 0.00 1.81 0.00 0.00 2.88 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.51 1.42 7.81 147 A 8.83 3.90 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 0.00 148 S 7.14 4.48 0.00 3.77 4.04 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 0.00 149 R 8.42 4.50 0.00 1.84 1.71 0.00 3.08 0.00 0.00 3.08 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.51 0.00 150 S 8.66 4.44 0.00 3.91 3.74 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 0.00 151 I 8.19 4.01 1.97 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 1.42 1.13 1.04 0.00 0.00 152 P 0.00 4.37 0.00 2.21 2.00 0.00 3.66 0.00 0.00 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.09 0.00 153 T 8.85 3.90 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 1.24 0.00 0.00 154 K 8.12 4.00 0.00 1.77 1.97 0.00 1.65 0.00 0.00 1.66 0.00 0.00 3.11 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.47 1.60 7.81 155 H 8.02 4.68 0.00 3.13 3.46 0.00 5.94 0.00 0.00 0.00 0.00 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 156 R 7.65 4.22 0.00 2.03 1.88 0.00 3.43 0.00 0.00 3.23 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 1.75 0.00 157 L 8.03 4.42 0.00 1.53 1.85 0.90 0.95 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 0.00 158 N 8.11 5.19 0.00 3.01 2.65 0.00 0.00 6.80 8.03 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 0.00 159 P 0.00 4.38 0.00 2.16 2.18 0.00 3.66 0.00 0.00 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.48 0.00 160 A 8.12 4.05 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 0.00 161 D 8.18 4.32 0.00 2.73 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 0.00 162 A 8.25 4.08 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 0.00 0.00 0.00 0.00 0.00 163 V 8.47 3.29 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 0.81 0.00 0.00 0.28 0.00 0.00 164 A 8.30 3.92 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 0.00 165 F 8.38 4.01 0.00 3.06 3.38 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 0.00 166 I 8.11 3.52 1.91 0.00 0.00 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.10 0.89 0.00 0.00 167 E 8.46 4.26 0.00 1.91 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 2.27 2.30 0.00 168 S 8.02 4.50 0.00 3.84 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 0.00 169 T 7.79 4.75 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 1.24 0.00 0.00 170 Y 7.85 3.34 0.00 3.00 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 0.00 171 D 6.79 4.33 0.00 2.83 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 0.00 172 V 7.95 4.58 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 0.84 0.00 0.00 0.89 0.00 0.00 173 E 9.04 4.39 0.00 1.93 1.43 0.00 0.00 0.00 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 2.17 0.00 174 V 7.77 3.72 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 0.91 0.00 0.00 0.86 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.