NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 0 A 4.2944 8.2649 123.5793 51.5004 19.9213 176.5649 1 K 4.0622 8.3122 120.0328 54.9634 33.3759 175.1525 2 K 4.1286 9.2867 125.7684 56.6657 33.5557 175.8366 3 K 4.8427 8.7446 127.3458 56.4931 32.9586 176.6514 4 V 4.7879 8.6531 116.5081 58.5658 36.5024 174.3602 5 L 4.9643 8.3193 121.2092 53.4514 44.5653 175.5143 6 I 4.7198 7.9326 122.6149 59.8106 39.6958 174.1705 7 Y 4.5723 9.1860 130.2415 58.8006 40.0046 174.1085 8 G 4.4121 9.3742 117.0298 46.1443 0.0000 173.3718 9 A 3.8992 9.1006 132.0532 51.3649 19.9120 177.3034 10 G 4.0646 7.5515 109.1088 45.1206 0.0000 173.8885 11 S 4.1291 8.6015 113.7042 61.4717 62.6195 176.3433 12 A 4.0587 7.9609 123.9218 55.0938 18.2398 179.7278 13 G 4.1930 8.0018 105.1517 47.2784 0.0000 175.5490 14 L 4.1052 7.9471 122.6633 58.2029 41.9150 179.1261 15 Q 4.0316 7.8198 116.6842 58.7486 28.7124 178.0481 16 L 4.1112 8.0129 120.2812 58.3214 42.4599 178.6137 17 A 4.1931 8.4746 120.8295 55.0393 18.3195 178.9697 18 N 4.7114 8.0038 113.6943 53.7016 38.7761 177.4774 *20 L 4.3134 7.8757 121.1995 54.9726 43.6571 179.5070 21 R 3.9484 8.3771 117.6184 59.1295 30.1303 177.6897 22 Q 4.0731 8.0177 115.3329 58.2841 28.9021 176.4903 23 G 3.9597 7.9285 107.7657 44.8758 0.0000 173.3493 24 K 4.4989 8.4484 115.6299 56.0554 32.9985 176.2049 25 E 4.2832 8.2156 120.9164 57.1411 31.5799 175.5281 26 F 5.5205 8.0501 115.2181 55.7786 42.8017 174.2339 27 H 4.9806 9.4578 122.0609 53.5818 32.2307 170.9828 28 P 4.6274 0.0000 0.0000 62.9630 31.1596 176.3935 29 I 3.9319 8.6768 126.7692 63.8773 37.9945 175.8133 30 A 4.4303 7.3870 120.4967 51.3838 22.6286 175.1194 31 F 5.1786 8.8378 117.7824 56.2123 41.8236 175.3042 32 I 4.9445 8.7117 122.4502 59.7235 39.6985 174.3483 33 D 4.8458 8.7594 125.0256 52.8072 44.3715 175.9695 34 D 4.3382 9.0236 124.9731 56.4511 41.3348 176.0937 35 D 4.5527 8.7494 120.1084 52.9768 40.2871 176.4166 36 R 4.0122 8.6268 127.1848 59.1721 30.2986 179.5215 37 K 4.0013 8.3577 116.4584 58.7470 32.2470 177.7912 38 K 4.2204 8.4457 117.1706 56.3699 32.6500 176.0043 39 H 4.1521 7.7801 120.1368 57.3655 29.9734 174.7159 40 K 3.3291 8.4229 124.7893 57.1852 30.2124 175.6708 41 T 4.2321 7.4740 110.7389 60.9937 70.0121 172.8235 42 T 5.4920 7.4929 109.7462 59.1074 71.8050 173.3470 *44 Q 4.0568 8.3430 116.9854 56.3431 29.8690 177.1904 45 G 4.0919 8.5276 104.9099 45.5995 0.0000 173.8498 46 I 4.4208 7.2793 120.1920 59.7083 39.1021 175.0807 47 T 4.6489 8.2372 114.6248 60.8230 71.3842 173.2512 48 I 5.0397 8.0506 123.5017 59.9419 39.8085 174.4677 49 Y 5.0028 8.7455 123.2379 55.6733 42.2119 175.6566 50 R 4.6423 8.5276 117.4642 54.9152 30.5725 176.0075 51 P 4.2665 0.0000 0.0000 64.9932 31.0355 178.7039 52 K 4.0672 8.1816 117.6634 59.3117 32.3901 177.1420 53 Y 4.1801 8.5414 115.6035 58.2680 37.8705 177.0491 54 L 3.9822 7.8894 121.7637 58.0732 41.8599 179.0828 55 E 3.9526 8.1587 117.8006 59.5725 29.4832 179.6624 56 R 3.9182 7.7993 115.4466 59.0619 29.6040 178.7214 57 L 3.9794 7.9364 119.8421 57.4932 41.5995 179.3074 58 I 3.7172 7.9204 119.9285 64.2821 36.5772 178.4580 59 K 3.9111 8.0635 120.4154 59.3846 31.8333 178.8229 60 K 3.9767 8.0566 118.8921 58.9047 32.1456 177.5478 61 H 4.7362 7.9677 113.0682 54.1843 30.1423 174.2321 62 C 4.1831 7.5186 116.5142 60.7092 26.0486 173.7098 63 I 4.2062 7.9562 119.3100 60.8873 38.0603 176.6519 64 S 4.8562 8.6984 117.7181 58.1931 64.5036 173.2391 65 T 5.1010 7.7574 116.9376 62.3284 72.9351 172.6823 66 V 4.6244 8.8424 125.7037 61.0235 34.9591 173.8879 67 L 5.0745 8.7201 127.6104 53.0979 44.0954 175.3011 68 L 4.7815 9.1321 124.3177 53.0134 42.9737 176.7650 69 A 4.9311 9.0585 126.3231 50.3765 18.3016 176.8605 70 V 4.6728 6.9522 115.8274 59.0007 32.6735 176.1212 71 P 4.3368 0.0000 0.0000 65.0713 31.7746 177.8995 72 S 4.4639 7.9186 111.5507 58.0619 63.5951 173.9792 73 A 4.2098 7.8050 125.3221 51.6448 18.9185 178.4563 74 S 4.3603 8.4048 116.7551 58.3495 65.1393 175.7441 75 Q 3.9506 8.5091 121.4985 58.9674 28.5486 179.0198 76 V 3.5686 7.7914 118.8632 66.2889 31.5596 177.8014 77 Q 3.9634 8.1135 119.1089 58.9321 28.7836 177.9261 78 K 3.8936 8.4095 121.2119 59.3667 32.1283 179.0294 79 K 3.9402 8.1650 118.9195 59.0744 31.9257 179.3460 80 V 3.5567 7.6564 118.4900 66.1562 31.4450 178.1070 81 I 3.5360 7.6404 119.1968 64.4472 36.8145 178.5499 82 I 3.6276 7.8916 120.8027 64.4689 36.8216 178.4497 83 E 3.9691 8.5634 120.1025 59.2436 29.0138 179.4553 84 S 4.1601 7.8976 113.6901 61.5193 63.1341 176.3557 85 L 4.1651 7.9914 122.2167 57.1454 41.4296 178.8884 86 A 3.9794 8.2488 122.2088 55.4122 18.3255 179.1832 87 K 4.2418 7.7813 111.4526 57.6843 32.0861 177.5627 88 L 4.4405 7.9542 118.5260 53.9347 42.1815 176.0294 89 H 4.1518 8.0092 114.5415 57.6274 26.4282 174.4186 90 V 4.6806 7.4216 109.8194 59.3313 35.3827 176.5991 91 E 4.3279 8.8783 123.5713 55.9526 31.3395 175.4165 92 V 4.8309 8.3030 124.4449 61.1613 34.5965 174.1321 93 L 5.3408 8.6738 127.0129 53.2411 45.6131 175.3477 94 T 5.1318 8.8016 115.2337 60.1767 71.1568 173.5057 95 I 4.7465 8.1378 121.0772 59.0270 38.9394 173.6017 96 P 4.4402 0.0000 0.0000 62.2850 32.0123 176.3141 97 N 4.5590 8.3830 116.7051 52.9202 39.5141 176.1039 98 L 3.9284 8.7546 122.1200 58.9605 41.5598 179.4122 99 D 4.4365 8.0802 117.6006 57.0136 40.7636 177.8287 100 D 4.2262 8.0907 118.6190 56.0771 41.0623 178.3435 101 L 4.1417 7.8994 120.1226 56.8153 41.5449 179.5572 102 V 3.5925 7.1592 118.0948 64.6676 31.4977 176.8852 103 N 4.5330 8.2196 114.7627 51.9254 37.3169 174.9647 104 G 3.9737 7.9547 105.7511 46.5756 0.0000 174.9539 105 K 4.0155 8.2455 121.5926 58.5184 32.2230 177.0293 106 L 4.9249 7.7220 116.4242 52.7205 44.6253 176.0869 107 S 4.5778 8.7212 116.0368 57.2034 63.3445 175.4339 108 I 3.7687 8.4163 126.5448 64.3252 36.9454 177.5609 109 G 3.7219 8.0086 107.3934 46.8217 0.0000 173.4539 110 Q 4.2572 8.1282 120.8272 55.6295 29.6061 174.9706 111 L 5.1598 8.5694 124.8350 52.8365 43.6212 175.9115 112 K 4.6604 8.7666 125.6799 54.1701 34.9412 175.1418 113 E 4.5220 8.7549 126.3533 56.4188 29.9196 177.4185 114 V 3.9697 8.2908 118.0255 60.9982 32.6492 176.5873 115 S 4.2780 8.5618 117.3489 58.1170 63.8563 175.2410 116 I 3.8083 8.3588 121.7648 64.2291 37.6830 177.9412 117 D 4.3694 8.0702 119.4009 57.6277 40.6700 178.4692 118 D 4.3405 8.1116 119.2094 57.1460 40.5962 178.4205 119 L 4.0268 8.2234 120.2587 57.7765 42.1986 178.2568 120 L 4.4733 7.9278 115.6635 53.1948 43.5344 176.0841 121 G 3.7999 7.4323 105.4881 46.4369 0.0000 174.1335 122 R 4.1224 8.1728 120.1489 56.4752 30.0977 177.3130 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 A 8.26 4.29 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 1 K 8.31 4.06 0.00 1.78 1.82 0.00 1.88 0.00 0.00 1.79 0.00 0.00 2.85 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.55 1.49 7.81 2 K 9.29 4.13 0.00 1.82 1.88 0.00 1.69 0.00 0.00 1.66 0.00 0.00 2.84 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.61 1.50 7.81 3 K 8.74 4.84 0.00 1.73 1.76 0.00 1.96 0.00 0.00 1.76 0.00 0.00 2.94 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.53 1.52 7.81 4 V 8.65 4.79 1.97 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 0.87 0.00 0.00 0.84 0.00 0.00 5 L 8.32 4.96 0.00 1.59 1.54 0.93 0.64 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 6 I 7.93 4.72 1.67 0.00 0.00 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.48 1.14 0.00 0.00 7 Y 9.19 4.57 0.00 3.03 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 8 G 9.37 4.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 9 A 9.10 3.90 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 10 G 7.55 4.06 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 0.00 11 S 8.60 4.13 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 12 A 7.96 4.06 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 13 G 8.00 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 0.00 0.00 0.00 0.00 14 L 7.95 4.11 0.00 1.67 1.79 1.03 0.66 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 15 Q 7.82 4.03 0.00 2.27 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.12 6.70 0.00 0.00 0.00 0.00 0.00 2.41 2.60 0.00 16 L 8.01 4.11 0.00 1.66 1.95 0.99 1.10 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 17 A 8.47 4.19 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 18 N 8.00 4.71 0.00 3.00 2.86 0.00 0.00 6.91 7.05 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 *20 L 7.88 4.31 0.00 1.90 2.01 0.88 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 0.00 0.00 0.00 0.00 0.00 0.00 21 R 8.38 3.95 0.00 2.02 1.99 0.00 3.29 0.00 0.00 3.31 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.58 0.00 22 Q 8.02 4.07 0.00 2.26 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.65 0.00 0.00 0.00 0.00 0.00 2.48 2.32 0.00 23 G 7.93 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 0.00 0.00 0.00 24 K 8.45 4.50 0.00 1.69 1.77 0.00 1.71 0.00 0.00 1.62 0.00 0.00 2.93 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.32 1.37 7.81 25 E 8.22 4.28 0.00 1.80 1.69 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 1.47 1.47 0.00 26 F 8.05 5.52 0.00 2.94 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 27 H 9.46 4.98 0.00 3.18 3.19 0.00 5.78 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 28 P 0.00 4.63 0.00 1.74 1.83 0.00 3.72 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 1.82 1.89 0.00 29 I 8.68 3.93 1.72 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.71 0.52 0.00 0.00 30 A 7.39 4.43 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 31 F 8.84 5.18 0.00 3.03 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 32 I 8.71 4.94 1.20 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 1.06 0.32 0.00 0.00 33 D 8.76 4.85 0.00 2.67 2.37 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 34 D 9.02 4.34 0.00 2.77 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 35 D 8.75 4.55 0.00 2.64 2.64 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 36 R 8.63 4.01 0.00 1.90 1.98 0.00 3.18 0.00 0.00 3.33 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.67 0.00 37 K 8.36 4.00 0.00 1.88 1.85 0.00 1.67 0.00 0.00 1.68 0.00 0.00 2.99 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.46 1.44 7.81 38 K 8.45 4.22 0.00 1.81 1.72 0.00 1.59 0.00 0.00 1.45 0.00 0.00 2.77 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.32 1.30 7.81 39 H 7.78 4.15 0.00 3.00 3.26 0.00 6.10 0.00 0.00 0.00 0.00 6.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 40 K 8.42 3.33 0.00 1.62 1.66 0.00 1.65 0.00 0.00 1.70 0.00 0.00 3.16 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.04 0.60 7.81 41 T 7.47 4.23 4.15 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 1.12 0.00 0.00 42 T 7.49 5.49 4.30 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 1.14 0.00 0.00 *44 Q 8.34 4.06 0.00 2.27 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 5.77 0.00 0.00 0.00 0.00 0.00 2.38 2.40 0.00 45 G 8.53 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 0.00 0.00 0.00 46 I 7.28 4.42 2.14 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 1.45 0.76 0.00 0.00 47 T 8.24 4.65 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 1.21 0.00 0.00 48 I 8.05 5.04 1.86 0.00 0.00 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.64 0.85 0.00 0.00 49 Y 8.75 5.00 0.00 2.79 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 50 R 8.53 4.64 0.00 1.97 1.96 0.00 3.28 0.00 0.00 3.33 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 1.65 0.00 51 P 0.00 4.27 0.00 2.27 2.28 0.00 3.63 0.00 0.00 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 2.23 0.00 52 K 8.18 4.07 0.00 1.82 2.02 0.00 1.81 0.00 0.00 1.81 0.00 0.00 3.00 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.45 1.56 7.81 53 Y 8.54 4.18 0.00 3.17 2.81 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 0.00 0.00 0.00 0.00 54 L 7.89 3.98 0.00 1.84 1.77 1.09 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 55 E 8.16 3.95 0.00 1.97 1.97 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 2.39 2.37 0.00 56 R 7.80 3.92 0.00 1.89 2.02 0.00 2.21 0.00 0.00 2.97 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.52 0.00 57 L 7.94 3.98 0.00 1.70 1.73 0.70 0.56 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 58 I 7.92 3.72 2.07 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.69 0.98 0.00 0.00 59 K 8.06 3.91 0.00 1.81 1.85 0.00 1.61 0.00 0.00 1.53 0.00 0.00 2.87 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.40 1.42 7.81 60 K 8.06 3.98 0.00 1.76 1.74 0.00 1.73 0.00 0.00 1.58 0.00 0.00 2.94 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.06 1.34 7.81 61 H 7.97 4.74 0.00 3.27 3.28 0.00 5.86 0.00 0.00 0.00 0.00 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 C 7.52 4.18 0.00 3.13 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 63 I 7.96 4.21 1.89 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 1.51 0.53 0.97 0.00 0.00 64 S 8.70 4.86 0.00 3.88 4.05 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 65 T 7.76 5.10 4.28 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 1.10 0.00 0.00 66 V 8.84 4.62 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 1.09 0.00 0.00 0.96 0.00 0.00 67 L 8.72 5.07 0.00 1.52 1.44 0.49 0.33 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 68 L 9.13 4.78 0.00 1.52 1.56 0.83 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 69 A 9.06 4.93 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 70 V 6.95 4.67 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 1.12 0.00 0.00 0.90 0.00 0.00 71 P 0.00 4.34 0.00 2.18 2.19 0.00 3.86 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 2.00 1.97 0.00 72 S 7.92 4.46 0.00 4.00 4.01 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 73 A 7.81 4.21 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 74 S 8.40 4.36 0.00 4.05 4.01 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 75 Q 8.51 3.95 0.00 2.07 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.90 0.00 0.00 0.00 0.00 0.00 2.44 2.35 0.00 76 V 7.79 3.57 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 1.03 0.00 0.00 0.92 0.00 0.00 77 Q 8.11 3.96 0.00 2.22 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.58 0.00 0.00 0.00 0.00 0.00 2.36 2.39 0.00 78 K 8.41 3.89 0.00 1.90 1.75 0.00 1.66 0.00 0.00 1.61 0.00 0.00 2.89 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.37 1.41 7.81 79 K 8.17 3.94 0.00 1.97 1.82 0.00 1.72 0.00 0.00 1.56 0.00 0.00 3.09 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.44 1.51 7.81 80 V 7.66 3.56 2.25 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 1.03 0.00 0.00 0.99 0.00 0.00 81 I 7.64 3.54 1.77 0.00 0.00 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.78 -0.04 0.00 0.00 82 I 7.89 3.63 1.82 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 1.46 0.72 0.92 0.00 0.00 83 E 8.56 3.97 0.00 1.97 1.99 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 2.32 2.49 0.00 84 S 7.90 4.16 0.00 4.07 4.15 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 85 L 7.99 4.17 0.00 1.87 1.77 0.88 0.93 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 86 A 8.25 3.98 1.39 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 0.00 0.00 87 K 7.78 4.24 0.00 1.72 1.85 0.00 1.68 0.00 0.00 1.70 0.00 0.00 2.99 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.47 1.54 7.81 88 L 7.95 4.44 0.00 1.75 1.68 0.95 1.34 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 89 H 8.01 4.15 0.00 3.29 3.33 0.00 5.62 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 90 V 7.42 4.68 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 0.76 0.00 0.00 1.02 0.00 0.00 91 E 8.88 4.33 0.00 2.08 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 2.31 2.27 0.00 92 V 8.30 4.83 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 0.93 0.00 0.00 0.92 0.00 0.00 93 L 8.67 5.34 0.00 1.53 1.48 0.91 0.42 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 94 T 8.80 5.13 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 1.25 0.00 0.00 95 I 8.14 4.75 1.98 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 1.41 1.30 1.02 0.00 0.00 96 P 0.00 4.44 0.00 2.07 2.05 0.00 3.69 0.00 0.00 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 2.12 0.00 97 N 8.38 4.56 0.00 2.75 2.73 0.00 0.00 6.41 6.74 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 98 L 8.75 3.93 0.00 1.91 1.68 0.92 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 99 D 8.08 4.44 0.00 2.73 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 0.00 100 D 8.09 4.23 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 0.00 101 L 7.90 4.14 0.00 1.86 1.71 0.93 0.61 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 0.00 102 V 7.16 3.59 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 0.74 0.00 0.00 0.93 0.00 0.00 103 N 8.22 4.53 0.00 2.86 2.96 0.00 0.00 5.96 7.00 0.00 0.00 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 G 7.95 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 0.00 105 K 8.25 4.02 0.00 1.85 1.98 0.00 1.75 0.00 0.00 1.71 0.00 0.00 3.00 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.46 1.43 7.81 106 L 7.72 4.92 0.00 1.64 1.61 0.93 0.80 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 0.00 107 S 8.72 4.58 0.00 3.88 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 0.00 108 I 8.42 3.77 1.89 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 1.36 0.66 0.94 0.00 0.00 109 G 8.01 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 0.00 0.00 0.00 110 Q 8.13 4.26 0.00 2.15 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.72 0.00 0.00 0.00 0.00 0.00 2.39 2.36 0.00 111 L 8.57 5.16 0.00 1.57 1.60 0.93 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 112 K 8.77 4.66 0.00 1.81 1.62 0.00 1.64 0.00 0.00 1.65 0.00 0.00 2.84 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.33 1.39 7.81 113 E 8.75 4.52 0.00 1.90 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 2.34 2.37 0.00 114 V 8.29 3.97 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 0.63 0.00 0.00 0.92 0.00 0.00 115 S 8.56 4.28 0.00 4.00 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 0.00 116 I 8.36 3.81 1.87 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 1.64 1.19 0.91 0.00 0.00 117 D 8.07 4.37 0.00 2.72 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 0.00 118 D 8.11 4.34 0.00 2.87 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 0.00 119 L 8.22 4.03 0.00 1.74 1.87 0.92 1.05 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 0.00 120 L 7.93 4.47 0.00 1.72 1.69 0.92 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 121 G 7.43 3.80 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 0.00 0.00 0.00 122 R 8.17 4.12 0.00 1.83 1.85 0.00 3.33 0.00 0.00 3.29 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.57 0.00 * Residues marked with a * may have inaccurate shift predictions.