NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 N 4.7275 8.4093 119.2024 53.0207 39.9225 174.0504 2 F 4.3946 8.5417 120.9837 57.0078 38.9678 172.8401 3 M 4.8161 10.1013 120.9004 53.7487 36.0388 176.0624 4 L 5.2555 8.4679 120.0578 53.1233 45.0430 174.7843 5 N 5.4219 9.2942 123.6945 51.7760 41.0230 173.3557 6 Q 5.2090 8.6241 123.3053 53.3295 32.1030 173.4142 7 P 4.4348 0.0000 0.0000 63.1123 32.1919 176.1761 8 H 4.7618 8.3480 115.2197 58.2037 29.9893 175.0188 9 S 5.3371 7.5189 113.7221 56.4956 67.4620 173.6509 *11 V 4.3445 8.5538 115.5434 61.5788 33.1277 174.5359 12 S 5.1733 8.1952 116.2083 57.2681 66.3784 172.2532 13 E 4.6982 8.5937 120.0395 55.9016 33.8707 174.6315 14 S 4.9863 8.2847 119.0505 56.2834 65.1064 172.2275 15 P 4.4853 0.0000 0.0000 64.7111 31.1841 176.9460 16 G 3.8689 9.1515 110.1577 45.1659 0.0000 173.3935 17 K 4.4394 7.5306 119.0022 55.6879 34.9496 175.2529 18 T 5.1651 8.2353 116.5416 61.9547 71.4951 174.1541 19 V 4.6191 8.4549 124.1495 60.1100 35.1338 174.4197 20 T 4.8467 8.3396 117.7296 61.8124 71.6020 173.2608 21 I 4.5422 8.7152 127.1880 59.5250 39.6796 175.1902 22 S 5.3388 8.7677 121.5976 57.3167 65.7984 174.7497 23 C 4.9278 9.1188 121.1487 56.1111 45.9687 172.3759 24 T 5.0246 9.1460 124.6589 61.9200 70.1859 174.2109 25 R 4.6580 8.6295 128.1304 55.9083 30.2218 176.5736 26 S 4.5455 9.0402 122.2413 60.9560 63.7240 174.6256 27 S 4.5318 7.7474 112.0489 57.3143 65.9288 175.2785 27A G 3.7869 8.4503 110.4386 44.9052 0.0000 171.4998 27B N 4.9696 8.0981 116.3137 51.3663 40.4226 176.0925 28 I 3.4239 8.9326 126.6378 64.0227 38.0822 176.4814 29 D 4.6681 8.4131 117.3136 53.4991 39.5460 177.4501 30 S 4.2502 7.9000 117.1633 60.9657 63.1328 174.1488 31 N 4.9993 7.2687 115.6262 51.1313 42.4877 173.8975 32 Y 4.5708 8.4544 118.8056 58.3302 38.8377 174.9881 33 V 4.6054 9.2650 124.1280 61.3631 33.9686 174.4409 34 Q 5.1469 9.0036 126.5298 53.8891 32.1874 174.3913 35 W 5.3676 8.9800 121.9050 55.2095 32.3946 174.1629 36 Y 5.3274 9.7869 122.1001 56.3392 40.7752 174.2778 37 Q 4.5977 9.5061 124.9768 54.4697 31.5764 174.0339 38 Q 4.7173 8.9922 127.3285 54.5653 32.2051 174.3801 39 R 4.8064 8.4375 126.2082 54.0650 32.3583 174.6214 40 P 4.4090 0.0000 0.0000 64.7562 31.3171 176.5387 41 G 4.0025 9.1814 111.6703 44.8058 0.0000 173.1641 42 S 4.6909 7.4595 113.0930 55.9392 65.1239 173.8901 43 A 4.0947 8.1706 124.2660 51.2264 18.7913 175.6093 44 P 4.3671 0.0000 0.0000 63.1683 31.9555 176.1034 45 I 4.5605 8.9066 126.6693 59.5772 39.2909 175.4831 46 T 4.1506 8.8520 124.2840 64.2815 68.1304 174.3554 47 V 4.3090 8.8485 119.4678 61.5132 34.2277 176.3276 48 I 5.0968 7.6750 120.7037 59.7637 41.5962 173.7701 49 Y 5.0035 8.4776 123.8488 55.0831 41.8575 174.6399 50 E 3.6206 9.9692 117.1588 57.7363 27.6156 175.0195 51 D 5.4015 10.0045 123.1546 54.7113 40.4068 176.9689 52 N 5.0399 7.5696 108.9390 53.1990 39.6643 173.5924 53 Q 4.1793 7.9734 119.5988 55.3430 30.2455 174.8158 54 R 4.9423 8.2284 122.4577 54.0218 31.9615 174.7422 55 P 4.8037 0.0000 0.0000 62.0942 32.8982 176.0007 56 S 4.2820 8.5994 116.1759 60.1843 63.1181 174.9595 57 G 3.9616 8.9226 111.2696 45.4314 0.0000 173.5282 58 V 3.8578 7.2672 119.6344 61.3281 32.1547 174.1664 59 P 4.5769 0.0000 0.0000 62.2421 31.8504 177.0045 60 D 4.6343 8.6023 119.8134 55.3319 39.6771 177.6064 61 R 4.0149 7.9674 119.2268 58.1334 31.2418 176.0569 62 F 4.8931 8.1842 118.1208 56.1075 40.0573 175.4933 63 A 4.6886 9.0553 125.6902 49.9823 22.1264 174.7626 64 G 4.4855 8.9689 108.9426 43.8787 0.0000 172.6294 65 S 4.9405 9.0804 116.5237 56.9246 67.2549 172.6714 66 I 5.0185 8.2818 120.0733 59.5954 40.6572 174.9134 66A D 4.8225 9.4519 126.5694 52.3325 42.4723 176.4226 66B S 4.1672 8.6779 122.1183 60.9766 63.7096 176.7803 67 S 4.0368 8.3401 115.1966 60.7795 62.1288 174.5977 68 S 4.5239 8.0651 111.1627 57.0645 63.4172 173.0986 69 N 4.1321 7.8031 119.2641 54.9265 37.8559 172.9231 70 S 5.3375 8.2148 108.9957 56.4943 67.5565 172.8786 71 A 5.3904 9.1320 122.0523 50.4429 22.0963 175.6022 72 S 5.2377 9.4527 116.0735 56.6599 67.5742 172.7943 73 L 4.3794 8.0311 125.9678 53.3590 43.8904 174.9059 74 T 4.7956 8.6425 123.5983 61.7461 71.2620 173.3548 75 I 4.4328 8.3559 127.7562 59.4769 39.7208 175.3612 76 S 4.6256 8.1117 122.4277 55.4554 65.7281 173.9358 77 G 3.8628 8.3431 106.2643 45.6092 0.0000 174.0992 78 L 3.9428 7.6843 119.4275 55.4667 42.9418 175.9411 79 K 4.9148 9.0772 124.9402 54.2820 35.2097 177.2908 80 T 3.8939 8.5094 111.4205 64.7753 68.6538 176.1918 81 E 4.1270 8.1651 118.6786 58.7315 29.6379 177.5185 82 D 4.6717 8.2037 118.8963 55.9559 41.1212 175.8472 83 E 4.3253 8.4440 120.9387 56.5096 30.0840 175.7477 84 A 4.3438 8.3495 127.0792 51.8812 22.5494 173.8628 85 D 5.1917 8.2568 119.0203 53.5472 42.9294 175.7892 86 Y 5.1223 8.9819 120.5122 56.4679 41.2587 174.1384 87 Y 5.3859 9.5280 122.3272 56.3343 41.1513 173.0155 88 C 4.3738 9.1004 119.0441 54.8814 41.7017 172.3631 89 Q 4.7934 8.2383 120.1490 55.4117 32.6392 173.4932 90 S 4.3515 8.5894 119.2613 57.1146 66.1883 171.5138 91 Y 5.0820 8.8016 115.2149 56.4636 41.2031 174.5848 92 D 4.9158 9.0516 124.1339 52.9485 42.8335 177.7038 93 A 3.6411 8.4260 132.9331 53.5528 17.5836 179.2764 94 R 4.2713 8.9354 121.6838 58.6428 30.8417 175.2964 95 N 4.5909 8.1707 116.7127 53.1456 39.1842 174.2728 96 V 3.9415 8.3006 123.4979 62.6339 32.5642 175.0869 97 V 4.2792 8.3925 127.7981 61.0385 33.9482 173.9874 98 F 5.2162 8.7506 126.1951 55.4655 41.0261 175.7920 99 G 4.2759 9.3519 110.7013 45.8586 0.0000 174.4819 100 G 3.7670 8.8586 107.6905 45.8806 0.0000 174.7253 101 G 3.3698 8.0419 107.3045 45.7785 0.0000 173.0491 102 T 4.8654 8.4713 117.9747 61.4077 71.8740 173.0512 103 R 4.8433 9.0947 127.8783 54.8437 31.3620 174.6032 104 L 4.7963 9.3065 129.7563 54.2996 43.9690 174.9716 105 T 4.6856 8.8264 123.6841 62.0165 70.6842 173.7687 106 V 4.4576 8.3773 127.1291 61.2171 32.2777 175.6363 107 L 4.0182 8.8734 129.6712 55.5759 42.3605 177.8884 108 G 4.1673 8.6637 110.5027 46.1546 0.0000 173.4171 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 1 N 8.41 4.73 0.00 2.61 2.72 0.00 0.00 7.03 6.14 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 2 F 8.54 4.39 0.00 3.12 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 3 M 10.10 4.82 0.00 2.00 2.06 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.56 2.50 0.00 4 L 8.47 5.26 0.00 1.64 1.58 0.99 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 5 N 9.29 5.42 0.00 2.78 2.70 0.00 0.00 6.26 7.54 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 6 Q 8.62 5.21 0.00 2.15 2.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 6.78 0.00 0.00 0.00 0.00 0.00 2.29 2.39 0.00 7 P 0.00 4.43 0.00 2.17 2.08 0.00 3.98 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 2.02 1.97 0.00 8 H 8.35 4.76 0.00 3.23 3.62 0.00 5.43 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 9 S 7.52 5.34 0.00 3.77 3.76 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 *11 V 8.55 4.34 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 0.94 0.00 0.00 0.91 0.00 0.00 12 S 8.20 5.17 0.00 3.80 3.77 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 13 E 8.59 4.70 0.00 2.05 1.72 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 2.09 2.23 0.00 14 S 8.28 4.99 0.00 3.80 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 15 P 0.00 4.49 0.00 2.16 2.06 0.00 3.77 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 1.98 1.98 0.00 16 G 9.15 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 0.00 0.00 0.00 17 K 7.53 4.44 0.00 1.79 1.72 0.00 1.60 0.00 0.00 1.62 0.00 0.00 2.85 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.45 1.64 7.81 18 T 8.24 5.17 4.17 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 1.14 0.00 0.00 19 V 8.45 4.62 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 0.52 0.00 0.00 0.84 0.00 0.00 20 T 8.34 4.85 4.17 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 1.12 0.00 0.00 21 I 8.72 4.54 1.52 0.00 0.00 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.65 1.09 0.00 0.00 22 S 8.77 5.34 0.00 3.94 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 23 C 9.12 4.93 0.00 3.11 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 24 T 9.15 5.02 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 1.27 0.00 0.00 25 R 8.63 4.66 0.00 1.63 1.68 0.00 2.21 0.00 0.00 2.91 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.08 0.00 26 S 9.04 4.55 0.00 3.98 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 27 S 7.75 4.53 0.00 3.98 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 27A G 8.45 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 27B N 8.10 4.97 0.00 2.66 2.60 0.00 0.00 6.54 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 28 I 8.93 3.42 1.71 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 1.50 1.01 0.88 0.00 0.00 29 D 8.41 4.67 0.00 2.74 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 30 S 7.90 4.25 0.00 3.91 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 31 N 7.27 5.00 0.00 2.58 2.82 0.00 0.00 7.02 7.34 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 32 Y 8.45 4.57 0.00 3.21 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 33 V 9.26 4.61 2.13 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 0.79 0.00 0.00 0.91 0.00 0.00 34 Q 9.00 5.15 0.00 2.01 1.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 6.53 0.00 0.00 0.00 0.00 0.00 2.30 2.39 0.00 35 W 8.98 5.37 0.00 3.26 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 36 Y 9.79 5.33 0.00 3.10 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 37 Q 9.51 4.60 0.00 2.07 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.75 0.00 0.00 0.00 0.00 0.00 2.08 1.70 0.00 38 Q 8.99 4.72 0.00 2.16 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.62 0.00 0.00 0.00 0.00 0.00 2.25 2.57 0.00 39 R 8.44 4.81 0.00 1.76 1.82 0.00 3.21 0.00 0.00 3.24 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.56 0.00 40 P 0.00 4.41 0.00 2.17 2.09 0.00 3.73 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.99 0.00 41 G 9.18 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 S 7.46 4.69 0.00 3.98 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 43 A 8.17 4.09 1.24 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 0.00 0.00 44 P 0.00 4.37 0.00 1.57 1.75 0.00 3.51 0.00 0.00 3.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.75 0.00 45 I 8.91 4.56 1.98 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 1.41 1.09 0.93 0.00 0.00 46 T 8.85 4.15 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 1.25 0.00 0.00 47 V 8.85 4.31 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 0.48 0.00 0.00 1.15 0.00 0.00 48 I 7.67 5.10 2.20 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 1.47 1.04 1.08 0.00 0.00 49 Y 8.48 5.00 0.00 2.97 2.92 0.00 0.00 0.00 0.00 0.00 0.00 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 9.97 3.62 0.00 1.74 1.58 0.00 0.00 0.00 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 1.90 0.00 51 D 10.00 5.40 0.00 2.98 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 52 N 7.57 5.04 0.00 2.75 2.96 0.00 0.00 6.01 7.39 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 53 Q 7.97 4.18 0.00 0.93 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.64 6.85 0.00 0.00 0.00 0.00 0.00 1.99 2.07 0.00 54 R 8.23 4.94 0.00 1.70 1.89 0.00 3.51 0.00 0.00 3.59 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.65 0.00 55 P 0.00 4.80 0.00 2.11 2.00 0.00 3.76 0.00 0.00 4.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.39 2.25 0.00 56 S 8.60 4.28 0.00 3.99 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 57 G 8.92 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 58 V 7.27 3.86 2.21 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 0.66 0.00 0.00 0.88 0.00 0.00 59 P 0.00 4.58 0.00 2.40 2.05 0.00 3.79 0.00 0.00 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.42 2.20 0.00 60 D 8.60 4.63 0.00 2.77 2.82 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 61 R 7.97 4.01 0.00 1.50 2.02 0.00 3.45 0.00 0.00 3.28 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.53 0.00 62 F 8.18 4.89 0.00 3.03 2.97 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 63 A 9.06 4.69 1.13 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 64 G 8.97 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 0.00 0.00 0.00 0.00 65 S 9.08 4.94 0.00 3.85 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 66 I 8.28 5.02 1.90 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 1.00 0.92 0.00 0.00 66A D 9.45 4.82 0.00 2.64 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 66B S 8.68 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 67 S 8.34 4.04 0.00 3.85 4.13 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 68 S 8.07 4.52 0.00 4.00 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 69 N 7.80 4.13 0.00 2.87 2.81 0.00 0.00 6.67 8.41 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 70 S 8.21 5.34 0.00 4.04 3.92 0.00 0.00 0.00 0.00 0.00 0.00 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 9.13 5.39 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 72 S 9.45 5.24 0.00 3.70 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 73 L 8.03 4.38 0.00 0.27 0.13 0.75 0.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 74 T 8.64 4.80 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 1.12 0.00 0.00 75 I 8.36 4.43 1.49 0.00 0.00 0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.68 0.50 0.11 0.00 0.00 76 S 8.11 4.63 0.00 3.79 3.86 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 77 G 8.34 3.86 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 0.00 0.00 0.00 78 L 7.68 3.94 0.00 1.83 1.54 0.76 0.50 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 79 K 9.08 4.91 0.00 1.84 1.68 0.00 1.86 0.00 0.00 1.73 0.00 0.00 2.98 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.35 1.51 7.81 80 T 8.51 3.89 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 1.22 0.00 0.00 81 E 8.17 4.13 0.00 2.15 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 2.37 2.45 0.00 82 D 8.20 4.67 0.00 2.87 2.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 E 8.44 4.33 0.00 2.05 2.00 0.00 0.00 0.00 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 2.45 0.00 84 A 8.35 4.34 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 D 8.26 5.19 0.00 2.70 2.27 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 86 Y 8.98 5.12 0.00 3.04 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 87 Y 9.53 5.39 0.00 3.18 3.16 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 0.00 0.00 0.00 0.00 88 C 9.10 4.37 0.00 1.96 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 89 Q 8.24 4.79 0.00 1.83 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.49 0.00 0.00 0.00 0.00 0.00 1.51 1.16 0.00 90 S 8.59 4.35 0.00 3.86 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 91 Y 8.80 5.08 0.00 3.02 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 92 D 9.05 4.92 0.00 2.28 2.36 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 93 A 8.43 3.64 1.07 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 0.00 0.00 0.00 0.00 0.00 94 R 8.94 4.27 0.00 1.76 1.96 0.00 3.22 0.00 0.00 3.16 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.69 0.00 95 N 8.17 4.59 0.00 2.87 2.68 0.00 0.00 6.50 7.25 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 96 V 8.30 3.94 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 0.31 0.00 0.00 0.97 0.00 0.00 97 V 8.39 4.28 1.77 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 0.88 0.00 0.00 0.32 0.00 0.00 98 F 8.75 5.22 0.00 2.88 2.85 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 99 G 9.35 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 0.00 0.00 0.00 0.00 100 G 8.86 3.77 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 0.00 0.00 0.00 101 G 8.04 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 0.00 0.00 0.00 102 T 8.47 4.87 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 1.28 0.00 0.00 103 R 9.09 4.84 0.00 1.93 1.84 0.00 3.24 0.00 0.00 3.22 7.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.51 0.00 104 L 9.31 4.80 0.00 1.85 1.94 0.90 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 105 T 8.83 4.69 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 1.23 0.00 0.00 106 V 8.38 4.46 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 1.01 0.00 0.00 107 L 8.87 4.02 0.00 1.53 1.59 0.91 0.81 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 0.00 108 G 8.66 4.17 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 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.