NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 P 4.2480 0.0000 0.0000 62.3912 32.0444 175.6274 3 R 3.9735 8.4236 125.1708 54.0905 29.9252 174.6434 4 A 4.3014 9.1284 131.3483 50.7465 18.5654 176.4895 5 K 4.2693 8.1880 120.5139 57.2185 32.9680 178.1633 6 T 3.9361 8.5808 117.8294 64.8818 69.6039 177.8047 7 G 3.8814 8.3988 107.6991 45.8497 0.0000 173.1982 8 V 3.8804 8.3305 116.7114 64.7710 34.0657 180.5677 9 V 2.5225 6.4917 114.4308 62.0261 34.8553 176.4306 10 R 3.7697 7.9376 118.3413 59.9549 30.2321 178.1804 11 R 3.8618 8.0690 117.3531 59.6694 30.3068 178.4014 12 R 3.8937 8.1065 117.0556 59.4505 28.7970 178.9905 13 K 3.9124 8.2701 118.4447 59.7065 31.9446 178.4651 14 H 4.6924 8.2026 116.0530 57.8057 29.2278 177.2797 15 K 3.8430 8.2166 120.9713 60.7298 32.0847 178.3788 16 K 3.8288 8.1058 119.0310 59.6238 31.7366 178.8966 17 I 3.7257 7.3531 120.4434 64.8121 37.3951 178.2103 18 L 4.0478 8.4609 120.0259 57.7188 41.3917 179.3781 19 K 4.0413 8.4663 118.2279 59.8722 31.9051 178.7392 20 L 3.8570 7.4735 117.7344 57.3913 41.5457 178.9414 21 A 3.9464 8.5584 120.6270 50.7305 20.6150 176.6987 22 K 4.0638 7.3333 121.2016 58.7409 32.8875 178.3014 23 G 3.8858 8.7064 110.7649 45.4681 0.0000 173.0394 24 Y 4.8995 6.8246 116.9030 56.9507 39.4463 175.1033 25 W 4.2982 9.1046 133.1073 58.4772 31.1991 178.3428 26 G 4.0051 8.5134 103.5568 45.0142 0.0000 177.6142 27 L 3.5828 8.9252 128.3686 56.9047 41.7450 178.8689 28 R 4.1253 8.2988 117.8534 58.6454 30.0639 177.3320 29 S 5.0264 9.0373 112.7614 57.7137 63.2885 174.8038 30 K 4.4788 8.6192 118.2635 56.5735 35.2843 176.1767 31 S 4.5506 7.9841 116.9039 56.8140 63.3201 175.1942 *32 F 3.8842 8.5839 127.3875 58.8681 38.2176 172.7655 33 R 4.5535 7.6383 112.0028 56.8232 31.5477 177.6317 34 K 3.9469 9.2267 118.3860 59.3732 32.0876 178.5520 35 A 4.7987 8.7459 122.9200 55.1297 18.4242 179.3725 36 R 3.2334 7.7808 113.6620 59.2587 29.9628 177.9780 37 E 3.5454 8.1835 117.6226 59.9741 29.6658 179.9639 38 T 3.7513 7.9532 115.6111 66.5694 68.3900 176.6410 39 L 4.0237 7.9311 119.6662 57.8545 41.8123 179.6555 40 F 4.6564 7.7565 117.2565 60.5207 38.8924 177.1935 41 A 3.5848 7.6108 118.7930 55.3224 18.2361 179.2937 42 A 4.0967 8.1536 119.2531 56.2766 18.4174 178.8812 43 G 3.7071 8.6265 104.3033 47.8185 0.0000 175.1993 44 N 4.4575 8.1426 116.2982 55.9789 39.0964 176.4792 45 Y 4.4433 8.2044 117.8111 61.8071 37.9976 178.5599 46 A 4.0133 8.2448 120.7656 55.4875 18.6976 178.6016 47 Y 4.1627 8.1900 116.3205 61.1689 38.7797 178.9005 48 A 3.9866 9.8301 121.1813 55.3507 18.3392 179.4118 49 H 4.2241 8.4425 115.0639 59.0873 28.9498 178.0111 50 R 3.5470 8.4808 120.2242 59.3329 29.1885 179.1776 51 K 4.0005 7.5336 117.2819 59.0343 31.9271 179.6406 52 R 3.6994 7.6820 118.5949 59.2783 30.1311 178.7605 53 R 3.7912 8.6378 119.3958 60.1061 29.9145 177.6307 54 K 3.9295 7.7560 117.1297 60.0891 32.2299 178.5427 55 R 4.1795 7.7854 114.7994 57.4774 29.4671 178.1539 56 D 4.1227 8.1124 120.5822 57.8028 41.3128 178.1014 57 F 3.1883 7.8298 118.1027 59.9791 38.6226 177.2472 58 R 3.9926 7.3292 117.4155 59.9952 29.8902 178.7446 59 R 3.7749 7.6540 115.4421 59.6077 30.1128 179.1947 60 L 3.7449 7.2925 117.2842 57.2976 41.7109 179.4428 61 W 4.6984 8.0119 118.6049 59.4422 29.5768 178.5703 62 I 3.6703 7.5315 119.3771 64.5933 36.1654 177.7754 63 V 3.4798 7.4828 118.2658 66.7313 30.9875 177.6962 64 R 3.9174 8.0673 116.1495 59.9976 30.2366 178.5719 65 I 3.5120 7.8965 117.3062 65.6629 37.2372 177.1187 66 N 4.5306 9.4604 117.0153 57.4573 38.6453 176.8288 67 A 4.2623 9.2704 118.4875 52.8293 18.3324 176.9805 68 A 4.5355 8.5535 123.1601 54.9328 21.1450 178.5918 69 C 4.7755 9.1219 109.2533 58.5575 30.0251 175.1993 70 R 4.6344 7.8781 121.4005 57.9903 30.1000 177.9552 71 Q 4.1398 7.8433 117.9329 58.5393 29.1325 175.8486 72 H 4.8800 7.6660 113.8011 55.6053 29.4224 174.7445 73 G 4.0541 7.7497 104.8505 45.6465 0.0000 174.2367 74 L 4.5952 7.2260 115.8585 53.0937 43.5880 174.5124 75 N 4.7534 8.6172 118.1798 53.0983 40.5733 175.8434 76 Y 3.9611 8.9312 125.3553 61.3652 38.9520 178.3124 77 S 4.2581 8.5469 114.5840 61.7528 62.8860 176.1111 78 T 3.9043 8.0737 118.8569 66.9071 68.2502 175.4961 79 F 3.6984 8.9673 119.7006 61.9597 39.0853 177.0549 80 I 3.5901 8.2644 118.2627 65.1359 37.2701 177.4008 81 H 4.4185 8.3707 117.9527 59.7740 29.5300 177.3792 82 G 3.7497 8.4329 105.8945 46.9978 0.0000 174.8024 83 L 4.3871 9.0703 121.2451 56.8012 42.2289 178.3081 84 K 4.1048 8.0363 119.0556 59.7118 31.8219 177.6860 85 K 4.2905 7.7848 115.3212 57.1727 32.1321 177.0344 86 A 4.6030 7.1195 118.1345 54.0272 20.4620 176.9588 87 G 4.0056 8.4572 107.6624 44.9702 0.0000 174.4798 88 I 4.8132 7.9043 124.6441 61.4528 37.6999 175.1734 89 E 4.3511 8.1318 118.7382 57.4460 29.5786 177.8371 90 V 4.4126 8.6810 121.2555 62.6559 33.3300 174.7971 91 D 4.4684 9.1204 119.6687 54.8088 41.1192 173.3035 92 R 3.5230 7.6619 118.3845 57.3187 28.2017 176.9342 93 K 4.4500 8.1085 124.4998 59.3936 32.7797 177.7319 94 N 3.1400 7.4859 117.4424 55.6939 38.6282 176.5275 95 L 4.0267 7.8405 117.0532 55.7852 41.7723 177.5756 96 A 4.4077 7.2501 123.1155 51.5537 18.6996 177.9714 97 D 4.4756 7.6070 120.9520 55.8720 41.8633 176.6521 98 L 4.4231 7.7139 120.3448 57.9048 41.4348 178.6856 99 A 3.4218 7.5780 119.3178 54.9199 17.9832 177.6028 100 V 3.8664 7.3480 114.7675 63.2357 33.0539 175.9059 101 R 3.9201 7.6100 114.9965 57.6027 31.5965 176.0266 102 E 3.8775 8.8649 117.4505 56.6244 27.9476 173.5648 103 P 4.7271 0.0000 0.0000 65.4434 31.9225 178.4839 104 Q 4.0498 8.0717 118.3229 58.7956 28.8495 178.0950 105 V 3.6521 7.7064 119.4032 65.8350 31.4179 177.9610 106 F 4.4371 8.2844 119.6289 61.5313 39.4604 176.3956 107 A 3.8770 8.2410 120.3389 55.6778 18.0623 179.1085 108 E 3.8473 8.0795 115.6953 59.6484 29.3222 179.8621 109 L 3.8870 7.3097 117.6508 58.0877 41.7311 179.2007 110 V 3.1384 7.3740 117.9491 66.1494 31.3441 177.5368 111 E 3.8207 8.2530 117.7659 59.6489 29.1816 179.6910 112 R 3.8205 8.1627 117.9074 59.9340 30.4541 177.5351 113 A 3.7867 8.9984 121.7497 53.4969 17.9356 179.0765 114 K 3.7308 8.0167 116.3226 59.8000 32.9084 178.3919 115 A 3.8458 7.8012 120.5620 55.4814 18.0117 179.1802 116 A 4.0012 7.8215 118.7073 53.9670 19.2860 177.7850 117 Q 4.6041 8.0405 116.5365 55.0201 29.2838 176.0140 118 G 3.7253 7.8777 110.9959 45.8198 0.0000 173.5625 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 2 P 0.00 4.25 0.00 2.06 2.09 0.00 3.63 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 2.08 0.00 3 R 8.42 3.97 0.00 1.84 1.85 0.00 3.23 0.00 0.00 3.23 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.69 0.00 4 A 9.13 4.30 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 5 K 8.19 4.27 0.00 1.76 1.76 0.00 1.76 0.00 0.00 1.70 0.00 0.00 2.99 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.44 1.46 7.81 6 T 8.58 3.94 4.24 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 1.21 0.00 0.00 7 G 8.40 3.88 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 0.00 0.00 0.00 8 V 8.33 3.88 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 0.99 0.00 0.00 0.93 0.00 0.00 9 V 6.49 2.52 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 0.96 0.00 0.00 0.98 0.00 0.00 10 R 7.94 3.77 0.00 1.90 1.90 0.00 3.30 0.00 0.00 3.30 7.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.69 0.00 11 R 8.07 3.86 0.00 1.97 2.04 0.00 3.16 0.00 0.00 3.17 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.74 0.00 12 R 8.11 3.89 0.00 2.11 1.96 0.00 3.22 0.00 0.00 3.33 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.73 0.00 13 K 8.27 3.91 0.00 1.79 1.85 0.00 1.65 0.00 0.00 1.63 0.00 0.00 2.94 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.64 1.64 7.81 14 H 8.20 4.69 0.00 3.35 3.28 0.00 5.66 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 15 K 8.22 3.84 0.00 1.96 2.11 0.00 1.33 0.00 0.00 1.65 0.00 0.00 2.93 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.72 1.51 7.81 16 K 8.11 3.83 0.00 1.99 1.86 0.00 1.68 0.00 0.00 1.65 0.00 0.00 2.97 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.47 1.72 7.81 17 I 7.35 3.73 2.01 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 1.66 0.76 0.90 0.00 0.00 18 L 8.46 4.05 0.00 1.84 1.66 0.90 0.73 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 19 K 8.47 4.04 0.00 1.90 1.85 0.00 1.69 0.00 0.00 1.63 0.00 0.00 2.94 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.45 1.73 7.81 20 L 7.47 3.86 0.00 1.78 1.77 0.94 0.89 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 21 A 8.56 3.95 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 22 K 7.33 4.06 0.00 1.68 1.64 0.00 1.67 0.00 0.00 1.63 0.00 0.00 2.99 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.59 1.46 7.81 23 G 8.71 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 24 Y 6.82 4.90 0.00 2.95 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 25 W 9.10 4.30 0.00 3.40 2.93 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 26 G 8.51 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 0.00 0.00 0.00 27 L 8.93 3.58 0.00 1.75 1.76 0.94 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 28 R 8.30 4.13 0.00 2.09 2.07 0.00 3.22 0.00 0.00 3.43 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.81 0.00 29 S 9.04 5.03 0.00 3.89 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 30 K 8.62 4.48 0.00 1.65 1.78 0.00 1.63 0.00 0.00 1.59 0.00 0.00 2.79 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.60 1.46 7.81 31 S 7.98 4.55 0.00 3.81 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 *32 F 8.58 3.88 0.00 2.33 2.23 0.00 0.00 0.00 0.00 0.00 0.00 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 R 7.64 4.55 0.00 1.89 2.11 0.00 2.94 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 1.53 1.59 0.00 34 K 9.23 3.95 0.00 1.73 1.92 0.00 1.74 0.00 0.00 1.72 0.00 0.00 2.96 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.47 1.61 7.81 35 A 8.75 4.80 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 36 R 7.78 3.23 0.00 1.74 1.71 0.00 3.19 0.00 0.00 3.36 7.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.74 1.62 0.00 37 E 8.18 3.55 0.00 2.10 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 0.00 2.31 2.54 0.00 38 T 7.95 3.75 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 0.62 0.00 0.00 39 L 7.93 4.02 0.00 1.67 1.85 1.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 40 F 7.76 4.66 0.00 3.30 2.90 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 0.00 0.00 0.00 41 A 7.61 3.58 0.92 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 0.00 0.00 42 A 8.15 4.10 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 43 G 8.63 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 44 N 8.14 4.46 0.00 2.74 3.01 0.00 0.00 6.82 7.48 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 45 Y 8.20 4.44 0.00 3.16 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 46 A 8.24 4.01 1.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Y 8.19 4.16 0.00 3.10 3.19 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 48 A 9.83 3.99 1.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 H 8.44 4.22 0.00 3.45 3.33 0.00 5.84 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 50 R 8.48 3.55 0.00 1.78 1.97 0.00 3.16 0.00 0.00 3.21 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.73 0.00 51 K 7.53 4.00 0.00 1.99 1.73 0.00 1.55 0.00 0.00 1.51 0.00 0.00 2.65 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.12 1.19 7.81 52 R 7.68 3.70 0.00 1.87 1.85 0.00 3.21 0.00 0.00 3.01 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.70 0.00 53 R 8.64 3.79 0.00 1.85 2.01 0.00 3.29 0.00 0.00 3.27 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 1.96 0.00 54 K 7.76 3.93 0.00 2.12 1.83 0.00 1.72 0.00 0.00 1.72 0.00 0.00 3.07 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.51 1.74 7.81 55 R 7.79 4.18 0.00 2.18 2.15 0.00 2.73 0.00 0.00 3.06 7.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.56 0.00 56 D 8.11 4.12 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 57 F 7.83 3.19 0.00 2.34 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 58 R 7.33 3.99 0.00 1.93 2.02 0.00 3.14 0.00 0.00 3.21 7.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.95 0.00 59 R 7.65 3.77 0.00 1.88 1.84 0.00 3.04 0.00 0.00 3.06 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.73 0.00 60 L 7.29 3.74 0.00 1.10 1.45 -0.20 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 61 W 8.01 4.70 0.00 3.65 3.26 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 62 I 7.53 3.67 1.87 0.00 0.00 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 1.09 -0.07 0.34 0.00 0.00 63 V 7.48 3.48 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 1.00 0.00 0.00 0.89 0.00 0.00 64 R 8.07 3.92 0.00 2.07 1.97 0.00 3.45 0.00 0.00 3.24 7.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.93 0.00 65 I 7.90 3.51 2.28 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.08 0.81 0.00 0.00 66 N 9.46 4.53 0.00 2.86 3.00 0.00 0.00 7.26 7.86 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 67 A 9.27 4.26 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 68 A 8.55 4.54 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 69 C 9.12 4.78 0.00 3.32 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 70 R 7.88 4.63 0.00 2.19 2.03 0.00 3.27 0.00 0.00 3.27 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.64 0.00 71 Q 7.84 4.14 0.00 2.13 2.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 7.22 0.00 0.00 0.00 0.00 0.00 2.49 2.40 0.00 72 H 7.67 4.88 0.00 3.22 3.21 0.00 5.88 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 73 G 7.75 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 0.00 0.00 0.00 74 L 7.23 4.60 0.00 1.85 1.72 1.08 0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 75 N 8.62 4.75 0.00 2.90 2.94 0.00 0.00 6.59 7.48 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 76 Y 8.93 3.96 0.00 3.26 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 77 S 8.55 4.26 0.00 4.18 4.20 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 78 T 8.07 3.90 4.42 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 1.23 0.00 0.00 79 F 8.97 3.70 0.00 3.03 2.90 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 0.00 0.00 0.00 80 I 8.26 3.59 1.81 0.00 0.00 0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.44 0.09 0.84 0.00 0.00 81 H 8.37 4.42 0.00 3.26 3.56 0.00 5.80 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 G 8.43 3.75 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 0.00 0.00 0.00 83 L 9.07 4.39 0.00 2.01 1.75 1.16 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 84 K 8.04 4.10 0.00 1.88 1.86 0.00 1.62 0.00 0.00 1.75 0.00 0.00 2.99 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.55 1.61 7.81 85 K 7.78 4.29 0.00 1.67 1.67 0.00 1.80 0.00 0.00 1.65 0.00 0.00 3.07 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.41 1.43 7.81 86 A 7.12 4.60 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 87 G 8.46 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 0.00 0.00 0.00 88 I 7.90 4.81 1.89 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.52 0.93 0.00 0.00 89 E 8.13 4.35 0.00 1.96 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 2.32 2.36 0.00 90 V 8.68 4.41 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 0.74 0.00 0.00 0.93 0.00 0.00 91 D 9.12 4.47 0.00 2.94 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 92 R 7.66 3.52 0.00 1.88 1.74 0.00 3.15 0.00 0.00 3.12 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 1.52 0.00 93 K 8.11 4.45 0.00 1.97 2.11 0.00 1.71 0.00 0.00 1.69 0.00 0.00 3.12 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.64 1.73 7.81 94 N 7.49 3.14 0.00 1.44 2.03 0.00 0.00 7.24 6.66 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 95 L 7.84 4.03 0.00 1.71 1.59 0.83 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 96 A 7.25 4.41 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 97 D 7.61 4.48 0.00 2.77 2.55 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 98 L 7.71 4.42 0.00 1.77 1.75 0.99 0.82 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 99 A 7.58 3.42 0.42 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 0.00 100 V 7.35 3.87 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 0.89 0.00 0.00 0.88 0.00 0.00 101 R 7.61 3.92 0.00 1.90 1.84 0.00 3.31 0.00 0.00 3.38 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.61 0.00 102 E 8.86 3.88 0.00 2.23 2.15 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 2.29 2.23 0.00 103 P 0.00 4.73 0.00 2.39 2.52 0.00 3.89 0.00 0.00 4.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 1.95 0.00 104 Q 8.07 4.05 0.00 2.16 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.10 6.93 0.00 0.00 0.00 0.00 0.00 2.48 2.45 0.00 105 V 7.71 3.65 2.28 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 1.04 0.00 0.00 0.98 0.00 0.00 106 F 8.28 4.44 0.00 3.11 3.35 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 0.00 107 A 8.24 3.88 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 0.00 0.00 0.00 0.00 0.00 108 E 8.08 3.85 0.00 2.00 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 2.32 2.56 0.00 109 L 7.31 3.89 0.00 1.85 1.73 1.17 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 110 V 7.37 3.14 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 0.79 0.00 0.00 0.12 0.00 0.00 111 E 8.25 3.82 0.00 2.06 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 2.40 2.41 0.00 112 R 8.16 3.82 0.00 1.78 1.89 0.00 3.39 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 1.60 1.76 0.00 113 A 9.00 3.79 0.80 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 0.00 114 K 8.02 3.73 0.00 1.90 2.04 0.00 1.30 0.00 0.00 1.50 0.00 0.00 2.85 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.53 1.56 7.81 115 A 7.80 3.85 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 0.00 116 A 7.82 4.00 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 0.00 117 Q 8.04 4.60 0.00 2.07 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.85 0.00 0.00 0.00 0.00 0.00 2.24 2.41 0.00 118 G 7.88 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 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.