NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 V 3.9586 8.0544 114.0487 61.6369 32.5447 177.1585 2 H 4.4304 8.8935 132.2604 55.5398 29.7052 172.4205 3 L 4.7410 7.8950 127.0915 52.7686 45.2193 176.8347 4 T 4.1643 8.2430 113.1311 60.6316 70.9999 174.0304 5 P 4.2085 0.0000 0.0000 65.9830 31.4742 178.7904 6 E 4.0037 8.0902 115.6930 59.4307 29.6148 178.9353 7 E 3.9645 7.9711 119.1889 58.9356 29.4143 179.3818 8 K 3.8819 8.1503 118.6836 59.5565 32.0663 179.5401 9 S 4.1022 8.0695 115.2191 61.4825 62.7000 176.6972 10 A 3.9935 7.9000 123.1225 55.0217 18.1310 179.8109 11 V 3.4232 7.5880 116.4790 66.4250 31.7104 178.1432 12 T 3.9272 8.1745 115.5004 66.6999 68.1390 176.1443 13 A 4.0263 8.0986 121.2918 55.3128 18.7384 179.0953 14 L 3.8810 8.0085 118.6618 58.0764 42.1041 178.9379 15 W 4.3496 8.7907 128.4896 60.3917 30.4140 177.9546 16 G 3.7591 8.1487 104.3433 46.5994 0.0000 174.0771 17 K 4.4633 7.7166 118.7262 56.0434 32.5817 176.2486 18 V 3.7846 7.4037 119.9591 61.7560 32.3336 176.0809 19 N 4.5131 8.0787 125.1270 51.9208 38.5969 175.3946 20 V 3.4822 8.0584 127.4052 66.2059 31.6364 177.2152 21 D 4.3333 8.0635 117.7004 57.2244 40.7430 178.2567 22 E 3.8296 8.3021 119.7221 59.4474 29.6522 179.1425 23 V 3.6336 8.1514 118.8258 65.5812 31.5300 178.2114 24 G 3.6881 8.4663 106.2346 47.8422 0.0000 176.0074 25 G 3.6002 8.0890 108.7150 47.1653 0.0000 175.4495 26 E 3.8907 8.1392 121.3963 58.9623 29.6659 178.8704 27 A 3.9187 8.1738 121.0107 55.1568 18.5070 179.4191 28 L 3.9950 7.9109 119.0067 58.0081 42.2361 179.3948 29 G 3.5348 8.1307 105.7112 48.0341 0.0000 176.0031 30 R 3.9253 8.0931 121.0709 58.4167 29.9854 178.9836 31 L 4.0079 8.0417 120.3772 58.2997 41.6852 179.1426 32 L 4.1268 7.9119 119.8298 56.4482 41.2187 179.5514 33 V 3.6570 7.1609 117.4342 65.5907 31.8308 177.9142 34 V 3.5516 7.9158 116.8558 64.2535 32.7125 175.4764 35 Y 3.7853 7.2327 116.4248 53.8252 37.9702 173.8311 36 P 4.4810 0.0000 0.0000 64.2557 31.7115 177.5512 37 W 4.3856 7.9586 114.9479 59.0874 27.5806 177.7311 38 T 4.2685 7.6514 110.3541 63.7539 68.2603 176.1385 39 Q 4.3734 8.2459 121.6561 58.1984 28.4733 177.9547 40 R 3.6827 7.4225 116.0281 58.8826 29.1647 177.5564 41 F 4.2298 7.3534 114.3537 57.9491 39.4490 175.9296 42 F 4.4648 7.5681 120.1983 56.6846 39.6580 177.4673 43 E 3.9606 8.4253 123.5163 59.7144 29.3030 179.0085 44 S 4.5379 8.0308 109.8852 59.2284 63.3777 174.5811 45 F 4.5823 8.5611 120.1162 58.5530 39.9115 176.3474 46 G 4.0181 7.5624 105.5467 44.1351 0.0000 174.2497 47 D 4.5224 8.5663 124.9431 54.3713 41.3571 175.9267 48 L 4.9362 8.3160 126.5546 54.4833 43.3302 177.9990 49 S 4.2865 8.6418 116.7829 60.8831 63.2260 174.4358 50 T 4.7307 7.4231 109.9729 58.3174 73.0077 172.6852 51 P 4.1960 0.0000 0.0000 65.9398 31.2349 178.7465 52 D 4.3229 8.0569 116.8813 57.2397 40.5846 178.4534 53 A 3.9764 7.6913 120.1330 55.0676 18.7056 179.6620 54 V 3.6791 8.0594 116.8736 66.6078 31.4987 178.2375 55 M 4.1765 8.2789 117.4850 57.8919 31.8711 178.1224 56 G 3.9684 8.1123 103.4238 43.7474 0.0000 173.2508 57 N 4.4790 7.6298 121.9010 52.5105 39.4694 173.9750 58 P 4.2857 0.0000 0.0000 65.7525 31.2888 178.7482 59 K 3.6371 8.5473 119.0340 58.9576 31.7871 179.4305 60 V 3.7115 7.8456 118.0522 66.0154 31.5528 178.0524 61 K 3.9110 8.1009 117.9776 59.3996 32.0007 179.1934 62 A 3.9693 8.0571 121.0532 55.4414 18.2337 179.2326 63 H 4.3887 8.5683 117.0649 59.2901 29.9107 177.6638 64 G 3.6667 8.3750 107.7927 47.7127 0.0000 175.8302 65 K 3.9986 8.0862 120.7402 59.0161 31.9503 179.2679 66 K 3.9203 7.9106 119.4353 59.5203 32.1535 178.9323 67 V 3.6144 8.0563 118.6860 66.2390 31.4799 178.1125 68 L 4.3629 8.3305 118.6814 57.4379 41.3928 179.8113 69 G 3.6988 8.3512 106.1125 47.7005 0.0000 175.7718 70 A 4.1471 7.8355 122.2939 54.7865 18.8056 179.1909 71 F 4.2983 8.4980 119.3746 61.4119 39.4590 177.2140 72 S 4.0643 8.7893 113.1295 61.7737 61.9085 176.0533 73 D 4.5491 8.3990 121.2848 56.9865 40.3832 178.9112 74 G 3.5500 7.8398 105.9363 47.1880 0.0000 175.4754 75 L 3.7793 7.2457 119.1609 56.4515 41.5813 178.2861 76 A 4.2242 7.3128 119.1956 52.8070 19.6115 176.8202 77 H 4.9094 8.0323 115.4997 54.7481 29.5892 175.7941 78 L 3.8448 7.9877 120.3902 57.9433 41.8166 178.5082 79 D 4.6154 7.9152 115.3510 54.8929 41.8450 176.3468 80 N 4.9822 8.1249 118.4550 51.5201 39.9513 175.2378 81 L 4.0709 7.9313 123.1074 57.9306 42.1145 179.3593 82 K 4.0909 8.1292 118.0634 59.6127 31.8453 179.4644 83 G 3.5939 8.0907 103.9216 48.1210 0.0000 175.3652 84 T 3.8174 7.6576 117.0382 65.4615 68.5797 175.8189 85 F 4.7202 8.0294 117.0291 56.9474 39.4022 177.1803 86 A 4.0755 7.6373 123.0990 56.0163 18.1071 180.6832 87 T 3.8990 7.8546 113.4003 66.7423 68.5824 176.9713 88 L 4.1111 7.9783 120.4702 57.5101 41.7648 179.3880 89 S 4.3289 8.3334 113.5578 61.4454 62.3216 175.9094 90 E 3.9134 8.1176 121.1464 59.3311 29.2190 179.1077 91 L 3.9008 8.1098 120.2697 58.6896 42.1687 178.8659 92 H 4.2060 8.5290 116.0230 58.6097 28.1878 177.2710 93 C 3.4792 7.6554 120.4403 62.2089 31.2275 175.4106 94 D 4.2490 8.0908 119.7370 56.3848 40.4926 177.3932 95 K 4.2876 7.6844 116.5346 57.5853 33.7758 177.3717 96 L 4.0903 7.6985 116.9805 55.1551 42.2983 176.3087 97 H 4.0204 7.0625 114.4154 56.6449 26.4820 175.4498 98 V 4.0465 7.8987 118.4213 60.9453 32.4007 174.7846 99 D 4.3778 8.8964 127.3574 54.0088 41.5533 175.1771 100 P 3.1352 0.0000 0.0000 64.6152 31.2420 178.2275 101 E 3.9578 8.2519 117.8472 59.2075 29.2168 178.8702 102 N 4.3587 8.0495 116.8743 56.1542 38.4769 177.3869 103 F 4.4933 7.3738 119.3481 60.5438 38.9594 177.9673 104 R 3.9659 7.9413 117.3369 59.1726 29.9961 178.8520 105 L 3.7744 7.7631 118.7075 57.6973 41.5337 179.3503 106 L 4.1010 8.2208 120.4540 58.0187 42.1203 179.1457 107 G 3.7008 8.3018 105.7764 48.0743 0.0000 175.4549 108 N 4.4870 8.2111 118.9340 55.9234 38.5424 177.8272 109 V 3.6726 8.0405 119.8612 65.6625 31.5311 177.8526 110 L 3.8761 8.3345 120.7151 58.1180 41.9223 179.1278 111 V 3.5568 7.7272 117.8102 66.2446 31.4099 177.7811 112 C 4.1249 8.0908 116.4916 62.7600 27.9202 176.2863 113 V 3.5109 7.8890 119.8807 65.9828 31.0448 178.1340 114 L 3.9341 7.9216 118.6318 57.4679 41.2955 179.4354 115 A 3.6885 7.3465 120.8532 55.1974 18.1070 179.1703 116 H 4.0981 8.0527 115.8825 59.5927 29.9947 176.7384 117 H 3.8780 8.3227 119.4580 58.5686 30.0432 176.4223 118 F 4.6986 8.5507 117.7281 56.3022 39.7833 177.2677 119 G 3.8403 8.8123 109.4257 45.9569 0.0000 177.2872 120 K 3.9604 8.8977 122.3807 59.1909 32.3003 177.6953 121 E 4.0998 8.1463 119.8011 58.2885 30.0858 176.9704 122 F 4.5824 8.1431 123.5526 57.0109 37.9135 175.3497 123 T 4.1300 7.3388 115.4058 60.4247 71.1700 173.4252 124 P 4.1637 0.0000 0.0000 65.5905 31.4182 177.2702 125 P 4.1908 0.0000 0.0000 65.3368 31.2594 178.9081 126 V 3.5459 7.3032 117.2305 65.8030 31.3438 177.8497 127 Q 3.5344 7.9623 119.4972 59.0029 28.8992 177.9601 128 A 3.9906 8.1640 121.7292 55.2747 18.4908 179.4819 129 A 3.9033 7.9216 118.8953 55.6392 18.4112 179.5723 130 Y 3.9043 8.2340 115.2056 61.0544 37.9219 178.5909 131 Q 4.1449 8.6779 119.7272 58.8733 28.7200 178.9256 132 K 3.9856 7.9535 119.1019 59.3119 31.9977 179.5612 133 V 3.4808 7.5368 118.0376 66.2560 31.5275 178.6321 134 V 3.7952 8.3800 112.2489 64.2342 31.3372 178.5385 135 A 4.1459 8.2697 121.0225 54.9394 18.2488 179.8956 136 G 3.5191 8.4358 104.7463 47.8793 0.0000 176.1717 137 V 3.3050 8.0289 120.7647 65.5543 31.4240 177.9588 138 A 3.9242 8.0232 120.5098 55.2360 18.1066 179.4113 139 N 4.2933 8.3173 114.7734 56.4195 38.4024 177.5618 140 A 4.0510 7.7978 121.1522 55.0756 18.5536 179.3494 141 L 4.0058 7.7586 115.9313 56.6134 42.0709 178.3261 142 A 4.4645 7.5966 119.7903 52.5203 19.2862 178.1411 143 H 4.1508 7.9635 116.8394 58.8481 29.9634 175.9597 144 K 4.4437 8.1361 115.7995 56.1910 32.2250 176.3871 145 Y 4.1869 7.9874 117.7859 58.5150 38.4013 175.8278 146 H 4.4626 8.4084 117.5837 56.1784 28.2868 173.2851 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 V 8.05 3.96 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 0.85 0.00 0.00 0.91 0.00 0.00 2 H 8.89 4.43 0.00 3.17 3.21 0.00 5.68 0.00 0.00 0.00 0.00 6.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3 L 7.89 4.74 0.00 1.53 1.42 0.79 0.86 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 4 T 8.24 4.16 4.21 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 1.22 0.00 0.00 5 P 0.00 4.21 0.00 2.16 2.14 0.00 3.58 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.14 0.00 6 E 8.09 4.00 0.00 2.14 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 0.00 2.33 2.32 0.00 7 E 7.97 3.96 0.00 2.25 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 2.28 2.30 0.00 8 K 8.15 3.88 0.00 1.92 1.79 0.00 1.62 0.00 0.00 1.57 0.00 0.00 3.04 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.37 1.56 7.81 9 S 8.07 4.10 0.00 4.02 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 10 A 7.90 3.99 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 11 V 7.59 3.42 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 0.58 0.00 0.00 0.44 0.00 0.00 12 T 8.17 3.93 4.38 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 1.26 0.00 0.00 13 A 8.10 4.03 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 14 L 8.01 3.88 0.00 2.08 1.90 0.66 -0.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 15 W 8.79 4.35 0.00 3.80 3.31 0.00 0.00 0.00 0.00 0.00 0.00 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 8.15 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 7.72 4.46 0.00 2.02 2.02 0.00 1.85 0.00 0.00 1.70 0.00 0.00 2.92 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.45 1.61 7.81 18 V 7.40 3.78 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 -0.01 0.00 0.00 0.76 0.00 0.00 19 N 8.08 4.51 0.00 2.70 2.59 0.00 0.00 6.80 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 8.06 3.48 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 1.25 0.00 0.00 0.93 0.00 0.00 21 D 8.06 4.33 0.00 2.70 2.68 0.00 0.00 0.00 0.00 0.00 0.00 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 8.30 3.83 0.00 2.11 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 2.25 2.26 0.00 23 V 8.15 3.63 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 0.95 0.00 0.00 0.69 0.00 0.00 24 G 8.47 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 25 G 8.09 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 26 E 8.14 3.89 0.00 2.16 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 0.00 2.26 2.32 0.00 27 A 8.17 3.92 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 7.91 3.99 0.00 1.87 1.63 0.93 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 29 G 8.13 3.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.09 3.93 0.00 1.95 1.94 0.00 3.08 0.00 0.00 3.02 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.58 0.00 31 L 8.04 4.01 0.00 1.87 1.88 0.98 0.59 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 32 L 7.91 4.13 0.00 1.85 1.70 0.75 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 33 V 7.16 3.66 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 0.72 0.00 0.00 0.94 0.00 0.00 34 V 7.92 3.55 1.53 0.00 0.00 0.00 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 7.23 3.79 0.00 2.60 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 4.48 0.00 2.25 2.13 0.00 3.76 0.00 0.00 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.09 0.00 37 W 7.96 4.39 0.00 3.53 3.43 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 38 T 7.65 4.27 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 1.12 0.00 0.00 39 Q 8.25 4.37 0.00 2.32 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.74 0.00 0.00 0.00 0.00 0.00 2.45 2.44 0.00 40 R 7.42 3.68 0.00 1.58 2.00 0.00 2.93 0.00 0.00 2.48 7.35 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 7.35 4.23 0.00 1.53 2.48 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 42 F 7.57 4.46 0.00 2.78 1.83 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 43 E 8.43 3.96 0.00 2.02 2.04 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 2.39 2.26 0.00 44 S 8.03 4.54 0.00 4.11 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 45 F 8.56 4.58 0.00 3.21 3.17 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 46 G 7.56 4.02 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 0.00 47 D 8.57 4.52 0.00 2.65 2.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 L 8.32 4.94 0.00 1.65 1.61 1.01 1.04 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 49 S 8.64 4.29 0.00 3.99 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 50 T 7.42 4.73 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 4.20 0.00 2.15 2.11 0.00 3.58 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 2.15 0.00 52 D 8.06 4.32 0.00 2.67 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 53 A 7.69 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 54 V 8.06 3.68 2.20 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 1.06 0.00 0.00 0.98 0.00 0.00 55 M 8.28 4.18 0.00 1.97 2.09 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.89 0.00 56 G 8.11 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 57 N 7.63 4.48 0.00 2.98 2.83 0.00 0.00 6.87 7.70 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 58 P 0.00 4.29 0.00 2.24 2.25 0.00 3.72 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 2.01 2.02 0.00 59 K 8.55 3.64 0.00 1.43 0.74 0.00 1.20 0.00 0.00 1.37 0.00 0.00 2.81 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.26 1.57 7.81 60 V 7.85 3.71 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 1.11 0.00 0.00 1.06 0.00 0.00 61 K 8.10 3.91 0.00 1.97 1.82 0.00 1.70 0.00 0.00 1.62 0.00 0.00 2.93 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.43 1.52 7.81 62 A 8.06 3.97 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.57 4.39 0.00 3.61 3.44 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 8.38 3.67 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 0.00 0.00 0.00 65 K 8.09 4.00 0.00 2.01 1.99 0.00 1.68 0.00 0.00 1.96 0.00 0.00 2.89 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.46 1.77 7.81 66 K 7.91 3.92 0.00 2.06 1.97 0.00 1.79 0.00 0.00 1.68 0.00 0.00 2.98 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.51 1.52 7.81 67 V 8.06 3.61 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 1.01 0.00 0.00 0.89 0.00 0.00 68 L 8.33 4.36 0.00 2.00 1.86 1.27 0.79 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 69 G 8.35 3.70 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 0.00 0.00 0.00 70 A 7.84 4.15 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 71 F 8.50 4.30 0.00 3.14 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 8.79 4.06 0.00 4.60 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 73 D 8.40 4.55 0.00 2.86 2.68 0.00 0.00 0.00 0.00 0.00 0.00 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 7.84 3.55 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 0.00 75 L 7.25 3.78 0.00 1.43 1.43 -0.46 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 76 A 7.31 4.22 1.10 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 0.00 0.00 77 H 8.03 4.91 0.00 3.08 3.16 0.00 5.83 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 L 7.99 3.84 0.00 1.53 1.66 0.73 1.01 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 79 D 7.92 4.62 0.00 2.64 2.68 0.00 0.00 0.00 0.00 0.00 0.00 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 8.12 4.98 0.00 2.71 2.61 0.00 0.00 7.17 7.44 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 81 L 7.93 4.07 0.00 1.75 1.80 0.89 0.91 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 82 K 8.13 4.09 0.00 1.77 1.83 0.00 1.17 0.00 0.00 1.49 0.00 0.00 2.85 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.48 1.46 7.81 83 G 8.09 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.66 3.82 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 0.37 0.00 0.00 85 F 8.03 4.72 0.00 3.03 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 86 A 7.64 4.08 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 87 T 7.85 3.90 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 1.22 0.00 0.00 88 L 7.98 4.11 0.00 2.01 1.87 1.14 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 89 S 8.33 4.33 0.00 4.21 4.16 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 90 E 8.12 3.91 0.00 2.31 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 0.00 2.33 2.48 0.00 91 L 8.11 3.90 0.00 1.76 1.87 0.90 0.97 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 92 H 8.53 4.21 0.00 3.59 3.75 0.00 5.86 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 93 C 7.66 3.48 0.00 1.23 2.39 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 94 D 8.09 4.25 0.00 2.70 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 7.68 4.29 0.00 1.80 1.78 0.00 1.75 0.00 0.00 1.68 0.00 0.00 2.97 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.31 1.35 7.81 96 L 7.70 4.09 0.00 1.70 1.59 0.70 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 97 H 7.06 4.02 0.00 3.26 3.42 0.00 5.64 0.00 0.00 0.00 0.00 8.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 V 7.90 4.05 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 0.31 0.00 0.00 0.35 0.00 0.00 99 D 8.90 4.38 0.00 2.79 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 P 0.00 3.14 0.00 1.88 1.73 0.00 3.40 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.44 0.00 101 E 8.25 3.96 0.00 2.04 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 2.27 2.47 0.00 102 N 8.05 4.36 0.00 2.51 2.84 0.00 0.00 6.88 7.65 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 0.00 103 F 7.37 4.49 0.00 3.11 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 7.94 3.97 0.00 2.07 1.96 0.00 3.30 0.00 0.00 3.32 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.81 0.00 105 L 7.76 3.77 0.00 1.72 1.30 0.76 -0.22 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 0.00 106 L 8.22 4.10 0.00 1.82 1.89 0.93 0.93 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 0.00 107 G 8.30 3.70 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 0.00 0.00 0.00 108 N 8.21 4.49 0.00 2.94 2.95 0.00 0.00 6.69 7.69 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 0.00 109 V 8.04 3.67 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 1.17 0.00 0.00 110 L 8.33 3.88 0.00 1.74 1.80 0.88 0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 111 V 7.73 3.56 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 1.30 0.00 0.00 1.18 0.00 0.00 112 C 8.09 4.12 0.00 3.19 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 7.89 3.51 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 0.96 0.00 0.00 0.89 0.00 0.00 114 L 7.92 3.93 0.00 1.00 1.09 0.65 1.03 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 0.00 115 A 7.35 3.69 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 0.00 116 H 8.05 4.10 0.00 3.16 3.41 0.00 5.78 0.00 0.00 0.00 0.00 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 H 8.32 3.88 0.00 2.94 2.95 0.00 5.98 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 8.55 4.70 0.00 3.25 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 0.00 119 G 8.81 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 0.00 120 K 8.90 3.96 0.00 1.92 2.02 0.00 1.60 0.00 0.00 1.66 0.00 0.00 3.01 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.46 1.49 7.81 121 E 8.15 4.10 0.00 2.10 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 2.34 2.29 0.00 122 F 8.14 4.58 0.00 3.06 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 7.34 4.13 4.21 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 1.28 0.00 0.00 124 P 0.00 4.16 0.00 2.15 2.14 0.00 3.57 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 2.11 2.19 0.00 125 P 0.00 4.19 0.00 2.11 2.06 0.00 3.47 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 2.08 2.11 0.00 126 V 7.30 3.55 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 0.95 0.00 0.00 0.90 0.00 0.00 127 Q 7.96 3.53 0.00 1.64 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.54 0.00 0.00 0.00 0.00 0.00 2.40 2.54 0.00 128 A 8.16 3.99 1.36 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 0.00 0.00 129 A 7.92 3.90 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 3.90 0.00 3.35 3.28 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 0.00 131 Q 8.68 4.14 0.00 2.26 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.81 0.00 0.00 0.00 0.00 0.00 2.74 2.62 0.00 132 K 7.95 3.99 0.00 1.97 1.82 0.00 1.63 0.00 0.00 1.53 0.00 0.00 2.89 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.45 1.56 7.81 133 V 7.54 3.48 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 0.94 0.00 0.00 0.74 0.00 0.00 134 V 8.38 3.80 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 1.08 0.00 0.00 1.14 0.00 0.00 135 A 8.27 4.15 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 0.00 136 G 8.44 3.52 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 0.00 137 V 8.03 3.30 2.04 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 0.52 0.00 0.00 0.68 0.00 0.00 138 A 8.02 3.92 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 0.00 0.00 139 N 8.32 4.29 0.00 2.91 2.87 0.00 0.00 6.90 7.06 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 0.00 140 A 7.80 4.05 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 0.00 141 L 7.76 4.01 0.00 1.14 0.88 -0.11 0.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 142 A 7.60 4.46 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 0.00 143 H 7.96 4.15 0.00 3.28 3.54 0.00 5.76 0.00 0.00 0.00 0.00 7.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 144 K 8.14 4.44 0.00 1.88 1.85 0.00 1.76 0.00 0.00 1.69 0.00 0.00 3.04 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.51 1.75 7.81 145 Y 7.99 4.19 0.00 3.12 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 0.00 146 H 8.41 4.46 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