NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 5 L 4.2648 8.0433 122.7479 54.1150 44.9500 176.1598 6 F 5.4070 7.5866 116.2135 54.3894 41.2423 173.6964 7 K 4.5751 8.3008 120.1733 55.1991 36.3417 171.9475 8 P 5.1639 0.0000 0.0000 61.2489 34.6214 172.8654 9 T 4.6945 7.9467 108.6212 60.5699 71.6971 173.1855 10 H 4.5775 8.8643 116.3328 55.9204 29.0022 175.3458 11 L 4.6366 7.2139 120.1307 52.1502 44.0015 175.6987 12 P 4.5397 0.0000 0.0000 61.7550 29.6570 176.0548 13 I 3.9103 7.0710 121.5294 62.2618 38.1898 177.3677 14 S 4.5063 9.1970 121.5957 57.6039 64.8929 175.5620 15 K 3.9838 8.6495 124.0662 59.6446 31.8949 177.8167 16 P 4.2697 0.0000 0.0000 65.4885 31.1849 178.4895 17 F 4.1416 8.0633 119.1617 61.4859 39.3344 176.8165 18 H 3.9064 8.4938 115.8631 58.7390 28.5421 177.5218 19 A 3.9566 8.4204 122.9498 55.0405 18.2369 179.3814 20 L 3.8441 7.9732 118.7127 58.2314 42.1600 179.2021 21 L 3.7886 7.6399 118.4709 57.7494 41.4919 179.1580 22 A 4.0823 8.9540 121.8290 55.3858 18.3137 179.1422 23 N 4.2235 8.2304 115.2288 57.0934 38.8437 177.2441 24 I 3.7697 7.7187 120.9716 64.3589 37.0971 177.8914 25 L 3.8842 7.9067 120.3754 57.9933 41.5330 179.6954 26 S 4.2835 8.1524 113.6851 61.4897 62.8428 176.2784 27 E 3.9757 8.1329 121.5356 58.9725 29.1601 177.8912 28 H 4.5350 7.4316 115.5030 58.1174 30.7177 176.3685 29 Q 4.1370 8.5868 120.4344 58.5286 28.7327 176.4674 30 A 4.3350 7.4553 120.9929 52.1528 19.0165 176.0987 *40 E 4.5550 8.0903 119.8629 57.6858 30.4813 175.3434 41 V 4.8900 10.0254 126.8156 60.0377 35.7298 174.4675 42 V 4.8398 8.5917 121.9278 61.5847 34.4209 173.9146 43 M 4.9839 9.1632 128.0235 53.8526 34.4564 174.7690 44 N 5.5570 8.9288 120.1279 51.4606 42.5261 173.3129 45 F 4.8746 9.6335 122.0781 55.6638 41.7397 174.6310 46 R 5.0429 9.2142 122.8248 54.4318 34.4173 174.1746 47 D 5.3692 9.2076 123.6169 52.9565 41.5825 177.0603 48 S 4.3482 9.6188 122.8781 60.6929 63.0899 175.6204 49 S 4.4046 8.7671 115.0689 59.2747 63.4330 173.8260 50 Y 4.5608 8.2130 123.8277 58.0718 38.3440 175.0926 51 S 4.4191 8.4104 120.4752 55.7877 66.4720 174.8728 52 A 3.8118 7.7483 123.1826 54.7024 18.0511 178.1347 53 E 4.7509 7.6938 113.4024 56.4749 30.9395 175.9431 54 D 4.7191 8.0271 119.4355 53.1929 43.5930 178.7477 55 G 3.7710 7.6211 106.7503 45.7616 0.0000 170.3504 56 G 3.8415 8.5618 106.0702 44.4553 0.0000 172.2151 57 F 4.4111 8.6853 117.5950 55.8314 40.1486 175.9996 58 H 3.7955 8.4632 122.1479 55.1061 29.3545 173.7626 59 P 4.9115 0.0000 0.0000 62.8880 32.9185 175.3720 60 V 5.2189 9.1141 121.8340 61.2473 35.3025 173.7081 61 E 5.4887 9.9029 128.0250 54.5991 32.6779 174.4705 62 I 5.1781 9.0814 126.5377 59.4345 40.8540 174.0827 63 A 5.1331 8.2552 127.7258 50.0324 21.4163 175.1238 64 L 5.7353 9.5591 121.6015 51.8826 46.3084 175.8440 65 S 4.8499 8.7948 115.6890 56.5915 66.8438 172.8624 66 Q 3.4004 8.0509 120.8477 54.5075 29.2210 175.9826 67 S 4.2448 8.0203 119.7618 57.6057 63.3996 175.2833 68 S 4.1514 8.4947 117.5167 61.3498 62.7052 175.4389 69 D 4.3933 7.8331 118.2435 53.2267 39.5723 175.8241 70 G 3.9321 7.1757 109.6075 45.8116 0.0000 174.5957 71 Q 4.3622 7.8536 117.6014 55.0253 30.5824 175.8866 72 W 4.6251 8.9593 121.6542 56.8814 30.9564 174.9185 73 C 5.2035 9.1328 119.9803 57.9282 31.1054 173.0965 74 I 4.2972 8.5336 124.3255 61.2218 37.8161 175.0818 75 E 4.5690 10.4987 131.0515 58.9445 30.3707 176.1682 76 Y 5.4525 7.3123 115.2101 56.0761 41.9404 172.8436 77 I 5.2316 9.1872 120.9122 59.9747 40.9636 174.7731 78 T 4.6903 9.3242 123.5422 61.5562 72.2079 172.2548 79 D 5.3886 8.6726 125.9950 52.5663 43.4305 174.9186 80 F 5.4405 9.0533 123.9376 56.0188 41.9846 174.5560 81 A 4.8092 8.8186 121.6559 50.6897 23.0915 175.1059 82 Y 5.1109 8.6202 117.7289 57.5995 38.1431 176.3476 83 V 4.0979 8.6511 121.3560 62.5826 33.3947 175.1201 *87 F 4.5586 7.8772 112.9620 56.6288 37.7163 171.9755 88 P 5.0528 0.0000 0.0000 61.1128 33.1350 174.4912 89 E 5.1324 8.4744 119.8150 54.1909 34.4425 174.5874 90 L 4.4185 8.5178 121.2369 54.8335 42.1421 176.5825 91 E 4.9106 9.1583 123.6533 53.9779 33.2929 175.8461 92 R 3.7912 8.6662 120.9537 57.3763 30.2055 175.2006 93 C 4.6368 9.4540 122.9048 60.4210 34.0547 173.4155 94 L 4.9316 7.4826 117.2119 52.8027 45.6420 174.9648 95 D 4.6939 8.3251 121.4501 52.5254 45.1088 173.8317 96 F 4.7967 9.3289 124.7829 55.8447 41.7604 174.0831 97 D 4.9278 9.0388 126.0802 52.6681 41.5818 176.8917 98 F 4.4037 9.0624 126.6193 60.2818 39.5302 177.4199 99 Q 4.2209 8.5526 118.6239 58.8184 28.4754 177.9841 100 R 4.2480 8.1555 114.7830 55.6726 31.0791 176.6320 101 G 3.9625 8.3119 105.8965 46.3713 0.0000 172.3143 102 D 5.7095 7.9597 117.8587 52.0038 45.1495 174.8197 103 F 5.3818 9.0542 115.4667 55.0703 41.6914 173.6890 104 F 5.0626 8.7868 121.6488 55.5654 42.7133 173.7363 105 T 4.7068 6.9673 119.2419 60.0830 72.5376 174.6162 106 A 3.4735 8.0323 124.9720 55.1167 18.4198 178.8379 107 Y 4.2661 7.1837 112.0619 61.1225 38.4030 176.7582 108 H 4.2376 8.0612 114.6423 56.1304 30.0588 177.4448 109 G 3.3440 7.0860 108.6839 45.7065 0.0000 171.7984 110 W 4.9829 8.4100 120.9557 56.0697 30.2640 175.9761 111 N 5.0583 8.2423 120.5390 51.0357 42.9141 172.4791 112 P 5.0270 0.0000 0.0000 62.9414 32.1844 176.8172 113 I 4.1034 9.1547 123.4883 64.7172 37.1611 178.6549 114 V 2.9559 6.6700 112.5465 64.5569 32.4209 175.3891 115 G 4.1524 8.0653 109.2893 45.4748 0.0000 172.7495 116 N 4.8703 8.0976 118.5519 51.9422 40.9758 174.4888 117 R 4.1636 8.4853 126.9242 58.8579 30.5803 178.0818 118 D 4.3443 8.1624 118.3576 57.0795 40.7087 178.4414 119 A 2.9240 7.8387 120.7716 54.7028 18.3459 179.5239 120 R 3.7510 7.4452 115.6941 59.5977 30.2711 178.3968 121 E 3.9144 7.8911 118.9930 59.0514 29.5658 178.3491 122 L 3.9915 7.9009 120.4146 58.4377 42.1485 178.3840 123 Y 3.5393 8.1861 119.5284 60.6312 38.6571 177.9657 124 Q 3.9065 8.2483 118.9944 58.7732 28.7881 178.8235 125 L 3.8482 7.9404 119.9302 57.4632 41.6508 179.0281 126 W 4.0697 8.2562 128.5285 60.7196 30.5186 177.6282 127 E 3.0647 8.1575 119.3320 58.8015 28.9532 178.5405 128 S 3.8776 7.6783 113.2354 61.3061 62.4003 175.8537 129 N 3.7105 7.6210 118.9397 56.0514 38.1997 176.9323 130 F 3.7876 7.3086 122.0034 61.3299 39.3009 177.1647 131 L 3.6279 7.7343 118.2051 57.5029 41.3189 179.3158 132 A 3.8498 7.5160 120.6361 55.2640 18.2222 179.2799 133 Y 3.8555 7.3701 115.0382 61.1201 37.8954 178.9010 134 V 3.5281 7.5679 118.9497 66.1285 31.4019 178.0072 135 A 4.0184 7.8172 118.8205 54.2756 18.1465 178.5878 136 T 4.2585 7.2470 106.0193 60.4583 69.8402 174.4674 137 E 3.6713 8.1024 118.7285 57.8311 27.3450 175.6649 138 A 3.3982 7.9017 122.1439 53.8420 18.6340 178.1406 139 F 4.8901 7.4768 114.4462 55.9637 39.0978 175.1831 140 D 4.6380 8.7262 124.4647 54.4844 39.9425 176.4952 141 D 4.5536 8.4262 120.6297 53.4854 43.4400 172.8146 142 I 4.8212 8.2388 125.4529 59.1443 39.3353 175.0333 143 S 4.8027 8.6947 121.7692 56.1925 66.3140 172.7535 144 L 5.0659 8.2508 122.2733 53.5860 44.9928 176.2046 145 T 4.3244 8.6578 121.0048 63.7981 69.5544 173.7519 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 5 L 8.04 4.26 0.00 1.70 1.53 0.91 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 6 F 7.59 5.41 0.00 2.82 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 7 K 8.30 4.58 0.00 1.60 1.66 0.00 1.69 0.00 0.00 1.76 0.00 0.00 2.96 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.30 1.39 7.81 8 P 0.00 5.16 0.00 1.99 2.01 0.00 3.71 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 1.91 0.00 9 T 7.95 4.69 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 0.71 0.00 0.00 10 H 8.86 4.58 0.00 3.22 3.41 0.00 5.66 0.00 0.00 0.00 0.00 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 L 7.21 4.64 0.00 1.22 0.79 0.69 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 12 P 0.00 4.54 0.00 2.19 2.08 0.00 3.67 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 1.99 0.00 13 I 7.07 3.91 1.71 0.00 0.00 0.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 0.16 0.76 0.00 0.00 14 S 9.20 4.51 0.00 4.03 3.81 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 15 K 8.65 3.98 0.00 1.83 1.93 0.00 1.71 0.00 0.00 1.85 0.00 0.00 2.96 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.61 1.61 7.81 16 P 0.00 4.27 0.00 2.18 2.11 0.00 3.57 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.15 0.00 17 F 8.06 4.14 0.00 3.15 3.12 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 18 H 8.49 3.91 0.00 3.45 3.51 0.00 5.70 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 19 A 8.42 3.96 1.41 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 20 L 7.97 3.84 0.00 1.67 1.62 0.96 0.37 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 21 L 7.64 3.79 0.00 1.44 1.45 0.20 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 22 A 8.95 4.08 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 23 N 8.23 4.22 0.00 3.02 2.93 0.00 0.00 7.27 7.27 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 24 I 7.72 3.77 1.84 0.00 0.00 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 1.48 1.07 0.80 0.00 0.00 25 L 7.91 3.88 0.00 1.69 1.40 -0.32 0.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 26 S 8.15 4.28 0.00 4.02 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 0.00 27 E 8.13 3.98 0.00 2.11 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 2.34 2.41 0.00 28 H 7.43 4.53 0.00 3.29 3.36 0.00 5.77 0.00 0.00 0.00 0.00 7.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 Q 8.59 4.14 0.00 2.18 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 7.25 0.00 0.00 0.00 0.00 0.00 2.41 2.45 0.00 30 A 7.46 4.34 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 *40 E 8.09 4.55 0.00 2.06 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 2.28 2.40 0.00 41 V 10.03 4.89 2.34 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 0.82 0.00 0.00 1.03 0.00 0.00 42 V 8.59 4.84 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 1.08 0.00 0.00 1.01 0.00 0.00 43 M 9.16 4.98 0.00 1.88 2.09 0.00 0.00 0.00 0.00 0.00 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.51 2.40 0.00 44 N 8.93 5.56 0.00 2.62 2.68 0.00 0.00 6.59 8.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 F 9.63 4.87 0.00 2.33 1.62 0.00 0.00 0.00 0.00 0.00 0.00 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 9.21 5.04 0.00 1.79 1.92 0.00 3.18 0.00 0.00 3.12 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.61 0.00 47 D 9.21 5.37 0.00 3.12 3.04 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 48 S 9.62 4.35 0.00 4.09 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 0.00 49 S 8.77 4.40 0.00 4.02 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 50 Y 8.21 4.56 0.00 3.14 3.24 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 51 S 8.41 4.42 0.00 3.79 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 52 A 7.75 3.81 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 53 E 7.69 4.75 0.00 1.83 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.24 0.00 54 D 8.03 4.72 0.00 2.62 2.66 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 0.00 0.00 0.00 0.00 55 G 7.62 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 56 G 8.56 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 F 8.69 4.41 0.00 2.77 2.62 0.00 0.00 0.00 0.00 0.00 0.00 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 H 8.46 3.80 0.00 3.25 3.53 0.00 5.72 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 P 0.00 4.91 0.00 2.24 2.09 0.00 3.84 0.00 0.00 3.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 2.25 0.00 60 V 9.11 5.22 2.16 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 0.78 0.00 0.00 1.30 0.00 0.00 61 E 9.90 5.49 0.00 2.41 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 0.00 2.51 2.60 0.00 62 I 9.08 5.18 2.04 0.00 0.00 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 1.34 0.79 1.01 0.00 0.00 63 A 8.26 5.13 0.49 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 64 L 9.56 5.74 0.00 1.81 1.98 0.89 0.81 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 65 S 8.79 4.85 0.00 3.85 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 66 Q 8.05 3.40 0.00 1.38 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.60 7.06 0.00 0.00 0.00 0.00 0.00 1.16 1.91 0.00 67 S 8.02 4.24 0.00 3.73 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 68 S 8.49 4.15 0.00 3.97 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 69 D 7.83 4.39 0.00 2.77 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 70 G 7.18 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 71 Q 7.85 4.36 0.00 2.32 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 7.02 0.00 0.00 0.00 0.00 0.00 2.55 2.37 0.00 72 W 8.96 4.63 0.00 2.91 3.30 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 73 C 9.13 5.20 0.00 2.94 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 74 I 8.53 4.30 1.86 0.00 0.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.88 0.41 0.00 0.00 75 E 10.50 4.57 0.00 1.91 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 0.00 2.64 2.46 0.00 76 Y 7.31 5.45 0.00 3.02 3.07 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 77 I 9.19 5.23 1.93 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 1.46 1.27 0.37 0.00 0.00 78 T 9.32 4.69 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 0.24 0.00 0.00 79 D 8.67 5.39 0.00 2.84 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 80 F 9.05 5.44 0.00 2.90 2.94 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 81 A 8.82 4.81 1.02 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 82 Y 8.62 5.11 0.00 2.94 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 83 V 8.65 4.10 2.22 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 0.90 0.00 0.00 0.95 0.00 0.00 *87 F 7.88 4.56 0.00 3.21 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 88 P 0.00 5.05 0.00 2.09 2.03 0.00 3.74 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.84 0.00 89 E 8.47 5.13 0.00 2.00 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 2.39 2.44 0.00 90 L 8.52 4.42 0.00 1.39 1.48 0.77 0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 91 E 9.16 4.91 0.00 1.89 1.82 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 2.24 2.29 0.00 92 R 8.67 3.79 0.00 1.39 1.56 0.00 2.83 0.00 0.00 2.85 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 1.55 0.00 93 C 9.45 4.64 0.00 2.97 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 94 L 7.48 4.93 0.00 1.33 0.89 1.07 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 95 D 8.33 4.69 0.00 2.46 2.22 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 96 F 9.33 4.80 0.00 2.61 2.32 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 97 D 9.04 4.93 0.00 2.85 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 98 F 9.06 4.40 0.00 3.47 3.12 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 99 Q 8.55 4.22 0.00 2.36 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.89 0.00 0.00 0.00 0.00 0.00 2.49 2.60 0.00 100 R 8.16 4.25 0.00 1.93 1.92 0.00 3.21 0.00 0.00 3.07 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.51 0.00 101 G 8.31 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 0.00 102 D 7.96 5.71 0.00 2.66 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 0.00 103 F 9.05 5.38 0.00 2.93 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 0.00 104 F 8.79 5.06 0.00 1.69 2.26 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 0.00 105 T 6.97 4.71 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 1.23 0.00 0.00 106 A 8.03 3.47 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 107 Y 7.18 4.27 0.00 2.88 2.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 108 H 8.06 4.24 0.00 2.90 3.23 0.00 5.85 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 0.00 109 G 7.09 3.34 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 0.00 110 W 8.41 4.98 0.00 3.21 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 0.00 111 N 8.24 5.06 0.00 1.94 2.64 0.00 0.00 6.67 7.96 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 0.00 112 P 0.00 5.03 0.00 2.00 2.02 0.00 3.74 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.14 0.00 113 I 9.15 4.10 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 1.38 1.08 1.00 0.00 0.00 114 V 6.67 2.96 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 0.79 0.00 0.00 0.70 0.00 0.00 115 G 8.07 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 0.00 0.00 0.00 116 N 8.10 4.87 0.00 2.90 2.99 0.00 0.00 6.87 7.37 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 0.00 117 R 8.49 4.16 0.00 1.93 1.91 0.00 3.24 0.00 0.00 3.35 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.71 0.00 118 D 8.16 4.34 0.00 3.06 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 0.00 119 A 7.84 2.92 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 120 R 7.45 3.75 0.00 1.91 2.04 0.00 3.09 0.00 0.00 3.09 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.62 0.00 121 E 7.89 3.91 0.00 2.07 1.92 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 2.31 2.36 0.00 122 L 7.90 3.99 0.00 1.96 1.84 1.00 0.54 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 0.00 123 Y 8.19 3.54 0.00 2.64 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 0.00 124 Q 8.25 3.91 0.00 2.27 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.59 0.00 0.00 0.00 0.00 0.00 2.42 2.64 0.00 125 L 7.94 3.85 0.00 1.73 1.71 1.00 0.57 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 0.00 126 W 8.26 4.07 0.00 3.51 3.22 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 0.00 127 E 8.16 3.06 0.00 1.19 1.47 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 2.12 1.79 0.00 128 S 7.68 3.88 0.00 3.82 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 0.00 129 N 7.62 3.71 0.00 2.58 2.22 0.00 0.00 6.67 8.18 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 0.00 130 F 7.31 3.79 0.00 1.74 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 0.00 0.00 0.00 0.00 131 L 7.73 3.63 0.00 1.61 1.57 0.95 0.66 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 0.00 132 A 7.52 3.85 1.19 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 0.00 133 Y 7.37 3.86 0.00 2.84 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 0.00 0.00 0.00 134 V 7.57 3.53 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 0.96 0.00 0.00 0.13 0.00 0.00 135 A 7.82 4.02 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 0.00 136 T 7.25 4.26 4.18 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 1.21 0.00 0.00 137 E 8.10 3.67 0.00 2.07 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 2.24 2.20 0.00 138 A 7.90 3.40 -0.55 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 0.00 139 F 7.48 4.89 0.00 3.15 3.22 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 0.00 140 D 8.73 4.64 0.00 2.73 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 0.00 141 D 8.43 4.55 0.00 2.74 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 0.00 142 I 8.24 4.82 1.73 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 1.26 0.81 0.23 0.00 0.00 143 S 8.69 4.80 0.00 3.81 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 0.00 144 L 8.25 5.07 0.00 1.36 1.03 0.77 0.79 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 0.00 145 T 8.66 4.32 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 * Residues marked with a * may have inaccurate shift predictions.