NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.3750 8.3044 120.3201 55.8997 33.8242 174.9212 2 H 4.6870 8.3981 118.7760 54.8430 29.2654 172.6199 3 L 4.6850 8.0169 120.5713 53.5417 44.7951 177.4757 4 T 4.1322 8.0993 120.3537 62.2941 70.4136 174.1446 5 P 4.0326 0.0000 0.0000 66.5466 31.0113 178.6500 6 E 3.9446 8.0473 117.4707 59.1878 29.5593 179.0307 7 E 3.9561 7.9157 118.1852 59.0338 29.5748 179.3273 8 K 3.8646 8.6254 119.7184 59.5219 32.1811 179.5571 9 S 4.1235 8.4174 114.6574 61.2466 62.6686 176.3933 10 A 3.9633 7.9298 124.2653 54.9585 18.1707 179.5507 11 V 3.3681 7.5323 116.3958 66.4193 31.1442 178.0020 12 T 3.9355 7.8779 115.0532 66.9633 68.1930 176.3836 13 A 4.0669 7.9654 120.9400 55.0535 18.6720 179.1437 14 L 3.9399 7.9710 119.0344 57.8548 42.1886 178.7980 15 W 4.4528 8.7133 128.6357 60.5625 30.3793 178.0838 16 G 3.7577 7.8699 104.4059 47.4215 0.0000 174.8422 17 K 4.3658 7.7330 117.7713 55.6728 32.7254 176.8905 18 V 3.7416 7.0576 120.5346 61.9091 32.2364 175.6246 19 N 4.5285 8.2526 125.3912 52.3271 39.0932 175.5266 20 V 3.4734 8.0751 128.7183 65.8014 31.5926 177.2998 21 D 4.3216 8.0388 118.2475 57.5317 40.9150 178.5225 22 E 3.9329 8.5422 118.9397 59.4026 29.5750 179.6330 23 V 3.5800 7.9576 118.6217 65.6075 31.4898 178.4173 24 G 3.6529 8.3604 106.1426 47.7310 0.0000 176.0304 25 G 3.5750 7.8279 108.4060 47.3852 0.0000 175.4530 26 E 3.9259 8.1048 121.4406 58.7286 29.6277 178.8349 27 A 3.9045 8.0158 120.8391 55.0409 18.6383 179.3787 28 L 3.9523 7.7453 118.6198 58.1317 42.0404 179.3289 29 G 3.5800 8.0753 105.5743 48.0612 0.0000 175.8147 30 R 3.8866 8.1106 121.1966 58.4898 30.1080 178.7800 31 L 3.9869 7.8903 120.1681 58.4669 42.0298 179.2878 32 L 4.0638 7.8193 117.8054 56.9247 41.2078 179.5297 33 V 3.6849 7.0341 117.6294 65.4304 31.8958 177.8739 34 V 3.4744 7.8090 116.8748 64.4693 32.8048 175.7615 35 Y 3.7080 6.9155 116.1237 54.1075 37.6302 174.1023 36 P 4.5157 0.0000 0.0000 64.7386 31.3796 178.3778 37 W 4.4075 8.1585 115.8582 59.1088 27.9886 177.7435 38 T 4.2535 7.8450 110.7168 63.9186 68.3322 176.0200 39 Q 4.3566 8.1527 121.3757 57.8429 28.4684 178.0309 40 R 3.7761 7.4463 116.7937 58.7080 29.2342 177.9095 41 F 4.2677 7.1332 116.5172 57.3312 39.8202 175.6893 42 F 4.5414 7.4868 118.0086 56.6474 39.7653 177.1888 43 E 4.0977 8.0947 122.5201 59.4614 29.8157 179.6089 44 S 4.5303 8.0262 110.8118 59.7967 63.4023 174.9132 45 F 4.5207 7.9931 118.9028 58.7850 39.7798 175.0668 46 G 3.9601 7.1317 104.9840 44.3119 0.0000 173.4395 47 D 4.6395 8.7450 124.4889 53.8385 40.5072 176.3886 48 L 4.9093 8.2976 126.5031 54.6650 43.0177 178.8498 49 S 4.3730 8.1151 117.7511 60.9938 63.0932 175.1389 50 T 4.7363 7.3418 109.9784 58.1563 72.9278 172.7495 51 P 4.1922 0.0000 0.0000 66.1555 31.3888 178.4650 52 D 4.3359 8.1310 116.4999 57.5897 40.5893 178.8408 53 A 4.0610 8.1912 119.9960 54.6848 18.6014 179.7534 54 V 3.7033 7.9771 117.3811 66.5180 31.5670 178.1842 55 M 4.0455 8.6758 117.8479 58.1156 31.9495 178.0513 56 G 3.6873 7.9268 106.1123 46.7960 0.0000 173.7964 57 N 4.3089 7.8695 119.1579 53.1700 39.6343 173.4703 58 P 4.2399 0.0000 0.0000 66.0264 31.4488 178.5913 59 K 3.7129 8.2780 118.1919 58.7160 31.7142 179.6550 60 V 3.6883 7.7620 118.2551 65.9723 31.5776 177.9792 61 K 3.8860 8.0619 118.0021 59.6099 31.4593 179.2544 62 A 4.0308 7.9548 120.9013 55.1910 18.2133 179.1720 63 H 4.4057 8.2479 117.0778 59.1159 29.9657 177.6581 64 G 3.5981 8.2794 107.8735 47.7300 0.0000 175.6179 65 K 4.0400 7.9315 121.7252 58.8612 32.1993 179.0015 66 K 3.9938 7.7001 119.6548 59.2494 32.1620 179.0419 67 V 3.5897 7.9107 118.5723 66.2384 31.5441 178.1766 68 L 4.3476 8.2440 118.5836 57.7037 41.4001 179.0954 69 G 3.7887 8.1347 106.0961 47.8431 0.0000 175.2795 70 A 4.1553 8.1909 123.9881 54.4332 18.9825 179.2518 71 F 4.3254 8.5925 118.9736 61.5358 39.6738 176.9503 72 S 4.2875 9.0521 113.1919 62.0604 62.3252 176.1578 73 D 4.5488 8.3267 121.1610 57.1863 40.5237 178.9876 74 G 3.5047 7.9487 105.8248 47.1627 0.0000 175.1719 75 L 3.9570 7.2905 118.6462 55.9284 41.7177 177.8702 76 A 4.4685 7.4566 119.3736 52.2655 19.9250 176.5118 77 H 4.8153 8.0162 115.4139 54.9257 29.9132 175.0005 78 L 4.0609 8.1427 121.2576 57.0949 42.0835 176.5229 79 D 4.7651 7.6170 115.8290 54.7262 42.2154 176.4426 80 N 4.8633 8.1288 116.5377 51.9005 40.8245 174.8936 81 L 3.9618 7.7332 122.9735 57.5294 42.1328 179.0804 82 K 3.9701 8.1530 118.2295 59.8291 31.8381 179.4371 83 G 3.5666 7.9012 103.6575 47.9337 0.0000 175.5897 84 T 3.7695 7.4767 117.2177 65.5665 68.6194 175.8108 85 F 4.8552 8.1975 117.4454 56.9781 39.3231 177.2488 86 A 4.0737 7.7085 122.9140 55.9397 18.2920 180.3627 87 T 3.8565 7.8781 113.4458 66.7167 68.5761 176.6023 88 L 4.1323 7.9668 121.8317 57.8760 42.3253 178.8365 89 S 4.4709 8.4834 115.1815 61.0042 62.3337 176.0142 90 E 3.9368 8.2510 121.3877 59.0718 29.1294 179.0676 91 L 3.9094 7.8813 120.1976 58.6127 42.2038 178.8374 92 H 4.1574 8.2615 116.1129 59.1797 28.7337 176.9540 93 C 3.5885 7.7102 120.4408 62.1316 31.1416 175.2922 94 D 4.4049 8.4086 121.5966 56.0094 40.6175 177.3518 95 K 4.3118 7.6294 116.2542 57.9691 33.6880 177.5808 96 L 4.0785 7.8181 116.6665 55.5364 42.1474 176.6570 97 H 4.1586 7.1426 113.7629 56.6034 26.6274 175.1584 98 V 3.7729 7.8068 118.0280 61.1792 32.5793 174.8851 99 D 4.4506 8.7519 127.2969 53.9007 41.9254 177.0734 100 G 3.1469 8.3756 112.7502 47.6153 0.0000 175.2268 101 E 3.9355 8.3276 121.2884 59.1880 29.4524 178.5844 102 N 4.2829 7.9130 116.7646 56.0680 38.4374 177.2292 103 F 4.4438 7.4148 119.3928 60.5535 38.9502 177.9432 104 R 3.9435 7.8944 117.2416 59.1304 30.0270 178.8308 105 L 3.7648 7.6299 118.2980 57.6561 41.6039 179.1244 106 L 4.0380 8.1108 120.4755 58.1862 41.9711 178.9381 107 G 3.8275 8.0618 105.4671 48.3081 0.0000 175.2430 108 N 4.4351 8.0126 118.9679 55.7455 38.5129 177.7502 109 V 3.6091 7.9306 119.6579 65.7724 31.5642 177.5868 110 L 3.8464 8.4601 120.4366 58.4180 41.8895 179.1252 111 V 3.5271 7.8619 117.8458 66.3394 31.4175 177.7907 112 C 4.1668 8.0809 116.2891 62.5264 27.8788 176.2741 113 V 3.5392 7.7990 119.9408 66.0259 31.1116 178.0112 114 L 3.8380 7.8474 118.6508 57.7081 41.4293 179.4854 115 A 3.7488 7.3586 120.5497 55.1661 18.0815 179.0769 116 H 4.0938 7.8986 115.7013 59.7660 30.0044 177.0346 117 H 3.9559 8.0573 116.5300 58.5942 28.9362 177.2044 118 F 4.6269 8.4642 117.5875 55.5319 39.4100 178.5124 119 G 3.9011 8.7702 108.6357 45.6532 0.0000 175.1662 120 K 3.8623 9.3701 121.6126 59.7869 31.9701 177.3557 121 E 4.0485 8.3651 119.2034 58.4011 29.9394 177.1452 122 F 4.5724 8.1046 123.1459 56.9540 37.9686 175.4683 123 T 4.1864 7.3453 115.3363 60.1931 71.3877 173.5049 124 P 4.1527 0.0000 0.0000 65.6253 31.4016 177.1484 125 P 4.2267 0.0000 0.0000 65.5113 31.3071 178.8921 126 V 3.5422 7.2893 115.7186 65.7832 31.3478 177.7978 127 Q 3.5150 8.0674 119.4034 58.9785 28.7310 177.9623 128 A 3.9832 8.3368 121.9112 55.4100 18.4739 179.5341 129 A 3.8996 7.9259 118.9043 55.5227 18.3775 179.5335 130 Y 3.8876 8.2335 115.2814 61.1639 37.9069 178.6257 131 Q 4.1822 8.7065 119.6469 58.9118 28.8011 178.9571 132 K 4.0351 7.9333 119.6897 59.1898 31.9634 179.7195 133 V 3.5047 7.6246 118.3763 66.1168 31.4352 178.5633 134 V 3.8110 8.3788 112.4308 64.2592 31.2842 178.3929 135 A 4.0956 8.1692 120.6982 55.1984 18.2394 179.8402 136 G 3.5550 8.1004 104.1700 47.9159 0.0000 175.9604 137 V 3.4194 8.1426 120.8935 65.6279 31.1410 177.8200 138 A 3.9256 8.1664 120.6561 55.3708 17.9610 179.4017 139 N 4.2945 8.1927 113.7443 56.3644 38.5582 177.2298 140 A 4.1759 8.1499 122.2874 55.2476 18.3950 179.7497 141 L 3.7938 7.9801 117.0523 56.7789 41.5962 178.4566 142 A 4.5414 7.5463 118.5280 52.0631 19.2126 178.0306 143 H 4.1290 7.8244 117.2822 58.9805 29.9750 176.0661 144 K 4.4089 8.2074 115.6504 56.2669 32.0275 176.3859 145 Y 4.1138 7.9709 117.7744 58.3658 38.3609 175.7990 146 H 4.4821 8.2764 118.1402 56.0543 28.4789 173.1519 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 M 8.30 4.37 0.00 1.96 2.09 0.00 0.00 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.42 2.51 0.00 2 H 8.40 4.69 0.00 3.14 3.22 0.00 5.71 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 3 L 8.02 4.68 0.00 1.57 1.47 0.80 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 4 T 8.10 4.13 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 1.26 0.00 0.00 5 P 0.00 4.03 0.00 2.23 2.30 0.00 3.65 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 2.05 2.05 0.00 6 E 8.05 3.94 0.00 2.04 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 2.38 2.44 0.00 7 E 7.92 3.96 0.00 2.17 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 0.00 2.34 2.34 0.00 8 K 8.63 3.86 0.00 1.80 1.79 0.00 1.61 0.00 0.00 1.63 0.00 0.00 2.93 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.37 1.48 7.81 9 S 8.42 4.12 0.00 4.01 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 0.00 10 A 7.93 3.96 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 11 V 7.53 3.37 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 0.50 0.00 0.00 0.52 0.00 0.00 12 T 7.88 3.94 4.51 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 1.28 0.00 0.00 13 A 7.97 4.07 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 14 L 7.97 3.94 0.00 1.82 2.08 0.56 0.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 15 W 8.71 4.45 0.00 3.80 3.36 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 16 G 7.87 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 0.00 0.00 0.00 17 K 7.73 4.37 0.00 2.04 2.16 0.00 1.81 0.00 0.00 1.77 0.00 0.00 3.01 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.52 1.47 7.81 18 V 7.06 3.74 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 -0.09 0.00 0.00 0.78 0.00 0.00 19 N 8.25 4.53 0.00 2.70 2.59 0.00 0.00 6.85 7.71 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 20 V 8.08 3.47 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 1.20 0.00 0.00 0.88 0.00 0.00 21 D 8.04 4.32 0.00 3.03 2.67 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 22 E 8.54 3.93 0.00 1.94 1.95 0.00 0.00 0.00 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 2.39 0.00 23 V 7.96 3.58 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 0.88 0.00 0.00 0.59 0.00 0.00 24 G 8.36 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 G 7.83 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 26 E 8.10 3.93 0.00 2.19 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 2.28 2.31 0.00 27 A 8.02 3.90 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 28 L 7.75 3.95 0.00 1.73 1.63 0.88 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 29 G 8.08 3.58 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 0.00 0.00 0.00 0.00 0.00 0.00 30 R 8.11 3.89 0.00 1.83 1.94 0.00 3.10 0.00 0.00 3.03 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.71 0.00 31 L 7.89 3.99 0.00 1.91 1.92 0.98 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 32 L 7.82 4.06 0.00 1.85 1.70 0.83 0.81 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 33 V 7.03 3.68 2.02 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 0.72 0.00 0.00 0.89 0.00 0.00 34 V 7.81 3.47 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 0.77 0.00 0.00 35 Y 6.92 3.71 0.00 2.63 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 36 P 0.00 4.52 0.00 2.33 2.33 0.00 3.72 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 1.94 0.00 37 W 8.16 4.41 0.00 3.56 3.49 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 38 T 7.85 4.25 4.43 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 1.09 0.00 0.00 39 Q 8.15 4.36 0.00 2.23 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.80 0.00 0.00 0.00 0.00 0.00 2.44 2.49 0.00 40 R 7.45 3.78 0.00 1.60 1.95 0.00 2.96 0.00 0.00 2.55 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.50 0.00 41 F 7.13 4.27 0.00 1.62 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 0.00 0.00 0.00 0.00 42 F 7.49 4.54 0.00 2.90 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 0.00 0.00 0.00 43 E 8.09 4.10 0.00 1.99 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 2.20 0.00 44 S 8.03 4.53 0.00 4.11 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 45 F 7.99 4.52 0.00 3.21 3.18 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 46 G 7.13 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 47 D 8.74 4.64 0.00 2.67 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 48 L 8.30 4.91 0.00 1.72 1.60 1.05 1.02 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 49 S 8.12 4.37 0.00 3.82 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 50 T 7.34 4.74 4.23 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 1.21 0.00 0.00 51 P 0.00 4.19 0.00 2.15 2.13 0.00 3.59 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 2.09 2.17 0.00 52 D 8.13 4.34 0.00 2.67 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 53 A 8.19 4.06 1.40 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 0.00 0.00 54 V 7.98 3.70 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 1.06 0.00 0.00 0.96 0.00 0.00 55 M 8.68 4.05 0.00 1.98 2.10 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.78 0.00 56 G 7.93 3.69 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 0.00 0.00 0.00 57 N 7.87 4.31 0.00 3.05 2.92 0.00 0.00 6.76 8.22 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 58 P 0.00 4.24 0.00 2.24 2.26 0.00 3.73 0.00 0.00 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.03 0.00 59 K 8.28 3.71 0.00 1.67 0.74 0.00 1.44 0.00 0.00 0.97 0.00 0.00 2.77 0.00 0.00 2.98 0.00 0.00 0.00 0.00 0.94 1.17 7.81 60 V 7.76 3.69 2.30 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 1.05 0.00 0.00 1.06 0.00 0.00 61 K 8.06 3.89 0.00 2.00 1.82 0.00 1.69 0.00 0.00 1.81 0.00 0.00 3.08 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.44 1.48 7.81 62 A 7.95 4.03 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 H 8.25 4.41 0.00 3.53 3.45 0.00 5.79 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 64 G 8.28 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 K 7.93 4.04 0.00 1.98 1.93 0.00 1.64 0.00 0.00 1.59 0.00 0.00 2.93 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.45 1.44 7.81 66 K 7.70 3.99 0.00 1.92 1.99 0.00 1.77 0.00 0.00 1.64 0.00 0.00 3.07 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.50 1.50 7.81 67 V 7.91 3.59 2.14 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 1.00 0.00 0.00 0.89 0.00 0.00 68 L 8.24 4.35 0.00 1.98 1.85 1.12 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 69 G 8.13 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 70 A 8.19 4.16 1.54 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 0.00 0.00 71 F 8.59 4.33 0.00 3.20 3.29 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 72 S 9.05 4.29 0.00 4.61 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 73 D 8.33 4.55 0.00 2.77 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 74 G 7.95 3.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 7.29 3.96 0.00 1.58 1.44 -0.36 -0.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 76 A 7.46 4.47 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 77 H 8.02 4.82 0.00 3.01 3.13 0.00 5.82 0.00 0.00 0.00 0.00 7.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 L 8.14 4.06 0.00 1.47 1.60 0.72 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.00 0.00 0.00 0.00 0.00 0.00 79 D 7.62 4.77 0.00 2.64 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 80 N 8.13 4.86 0.00 2.66 2.60 0.00 0.00 7.18 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 81 L 7.73 3.96 0.00 1.76 1.87 0.89 1.02 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 82 K 8.15 3.97 0.00 1.77 1.79 0.00 1.48 0.00 0.00 1.72 0.00 0.00 2.82 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.06 1.41 7.81 83 G 7.90 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 84 T 7.48 3.77 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 0.45 0.00 0.00 85 F 8.20 4.86 0.00 3.16 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 86 A 7.71 4.07 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 T 7.88 3.86 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 88 L 7.97 4.13 0.00 1.91 1.91 1.03 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 89 S 8.48 4.47 0.00 4.15 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 0.00 90 E 8.25 3.94 0.00 2.06 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 2.33 2.53 0.00 91 L 7.88 3.91 0.00 1.94 1.90 0.91 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 92 H 8.26 4.16 0.00 3.65 3.80 0.00 5.86 0.00 0.00 0.00 0.00 6.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 C 7.71 3.59 0.00 1.50 2.52 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 94 D 8.41 4.40 0.00 2.72 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 95 K 7.63 4.31 0.00 1.89 1.78 0.00 1.59 0.00 0.00 1.69 0.00 0.00 3.05 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.33 1.46 7.81 96 L 7.82 4.08 0.00 1.71 1.64 0.73 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 97 H 7.14 4.16 0.00 3.51 3.41 0.00 5.64 0.00 0.00 0.00 0.00 8.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 V 7.81 3.77 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 0.13 0.00 0.00 0.55 0.00 0.00 99 D 8.75 4.45 0.00 2.83 2.60 0.00 0.00 0.00 0.00 0.00 0.00 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 8.38 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 0.00 0.00 0.00 101 E 8.33 3.94 0.00 2.05 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 2.38 0.00 102 N 7.91 4.28 0.00 2.42 2.63 0.00 0.00 6.88 7.76 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 0.00 103 F 7.41 4.44 0.00 3.10 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 0.00 104 R 7.89 3.94 0.00 2.03 1.96 0.00 3.29 0.00 0.00 3.34 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.75 0.00 105 L 7.63 3.76 0.00 1.68 1.30 0.58 -0.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 106 L 8.11 4.04 0.00 1.78 1.73 0.92 1.23 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 0.00 107 G 8.06 3.83 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 108 N 8.01 4.44 0.00 2.92 2.95 0.00 0.00 6.75 8.39 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 0.00 109 V 7.93 3.61 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 1.06 0.00 0.00 1.15 0.00 0.00 110 L 8.46 3.85 0.00 1.73 1.83 0.86 0.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 111 V 7.86 3.53 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 1.29 0.00 0.00 1.17 0.00 0.00 112 C 8.08 4.17 0.00 3.23 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 0.00 113 V 7.80 3.54 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 0.98 0.00 0.00 0.95 0.00 0.00 114 L 7.85 3.84 0.00 0.78 1.09 0.62 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 115 A 7.36 3.75 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 H 7.90 4.09 0.00 3.21 3.56 0.00 5.95 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 0.00 117 H 8.06 3.96 0.00 2.73 2.58 0.00 5.70 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 0.00 118 F 8.46 4.63 0.00 3.32 3.11 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 0.00 119 G 8.77 3.90 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 0.00 0.00 0.00 120 K 9.37 3.86 0.00 1.92 2.05 0.00 1.63 0.00 0.00 1.66 0.00 0.00 3.00 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.49 1.53 7.81 121 E 8.37 4.05 0.00 2.36 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 2.33 2.32 0.00 122 F 8.10 4.57 0.00 3.08 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 0.00 123 T 7.35 4.19 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 1.32 0.00 0.00 124 P 0.00 4.15 0.00 2.15 2.15 0.00 3.58 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.20 0.00 125 P 0.00 4.23 0.00 2.11 2.06 0.00 3.45 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.11 0.00 126 V 7.29 3.54 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 0.98 0.00 0.00 0.89 0.00 0.00 127 Q 8.07 3.51 0.00 1.64 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.52 0.00 0.00 0.00 0.00 0.00 2.40 2.54 0.00 128 A 8.34 3.98 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 0.00 129 A 7.93 3.90 1.23 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 0.00 0.00 130 Y 8.23 3.89 0.00 3.47 3.29 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 0.00 131 Q 8.71 4.18 0.00 2.23 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.81 0.00 0.00 0.00 0.00 0.00 2.74 2.62 0.00 132 K 7.93 4.04 0.00 1.89 1.83 0.00 1.62 0.00 0.00 1.55 0.00 0.00 2.90 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.46 1.61 7.81 133 V 7.62 3.50 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 0.75 0.00 0.00 134 V 8.38 3.81 2.19 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 1.04 0.00 0.00 1.11 0.00 0.00 135 A 8.17 4.10 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 0.00 136 G 8.10 3.56 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 0.00 0.00 0.00 137 V 8.14 3.42 2.24 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 0.68 0.00 0.00 0.77 0.00 0.00 138 A 8.17 3.93 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 N 8.19 4.29 0.00 2.84 2.90 0.00 0.00 7.04 7.77 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 0.00 140 A 8.15 4.18 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 0.00 141 L 7.98 3.79 0.00 1.10 0.41 -0.04 0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.65 0.00 0.00 0.00 0.00 0.00 0.00 142 A 7.55 4.54 1.21 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 0.00 0.00 143 H 7.82 4.13 0.00 3.30 3.70 0.00 5.75 0.00 0.00 0.00 0.00 6.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 144 K 8.21 4.41 0.00 1.82 1.81 0.00 1.65 0.00 0.00 1.71 0.00 0.00 3.00 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.45 1.76 7.81 145 Y 7.97 4.11 0.00 3.15 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 0.00 146 H 8.28 4.48 0.00 3.21 3.23 0.00 5.75 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00