NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 V 4.0143 8.0549 120.3708 63.1653 32.0537 175.0087 2 H 4.8485 7.8062 121.5776 53.5983 31.2321 172.6114 3 L 4.5451 8.1427 121.1118 54.6943 43.7295 177.0382 4 T 4.0775 8.4634 113.5071 61.2839 70.6392 175.4414 5 A 3.9485 8.4563 123.1217 55.4548 18.3265 179.5240 6 E 3.8470 8.1233 117.1385 59.6114 29.7243 178.7866 7 E 3.9340 8.3109 118.5390 59.2360 29.4292 179.5048 8 K 3.8976 8.0515 118.7284 59.2635 32.0756 179.3485 9 S 4.0681 8.2461 113.6055 61.3544 62.0211 176.1038 10 L 3.9981 8.0273 121.7655 57.7837 41.2664 179.8581 11 V 3.4982 7.8517 118.2765 66.0586 31.5492 178.3902 12 S 4.4076 8.3212 114.2244 61.2707 62.5704 176.6113 13 G 3.6324 8.0090 108.8495 47.5311 0.0000 175.2115 14 L 3.9187 7.7895 122.5245 57.4211 42.1697 178.5716 15 W 4.2316 8.8311 128.5867 60.6490 30.4313 177.5166 16 A 4.1139 8.0490 119.4501 54.5372 17.7644 178.6437 17 K 4.4434 7.9244 114.3972 55.1753 33.3124 176.7702 18 V 3.5973 7.0448 120.5351 62.4333 32.0459 175.7664 19 N 4.4223 8.3787 124.9823 53.2432 39.0344 176.0244 20 V 3.6821 8.1122 122.0166 63.5768 31.8977 177.5279 21 D 4.5440 8.4622 118.4702 55.8351 41.0616 177.3287 22 E 4.4774 7.9525 117.6134 57.5681 31.4554 178.1654 23 V 3.5113 7.7138 118.3184 65.7200 31.3994 178.3708 24 G 3.7028 8.0080 105.1223 48.0444 0.0000 175.8833 25 G 3.6255 8.0069 108.3180 47.1775 0.0000 175.5533 26 E 3.8405 8.4307 120.8194 59.1258 29.4523 179.2856 27 A 3.9479 8.1400 120.9243 55.0223 18.4250 179.4925 28 L 3.9811 8.1925 119.1446 58.0633 42.1742 179.1399 29 G 3.6577 8.7725 106.7845 48.2400 0.0000 175.9129 30 R 3.9260 8.3909 121.4662 58.2163 29.8867 178.9195 31 L 4.2162 8.3655 120.8382 58.3975 42.2209 179.1971 32 L 4.1657 7.9463 120.0514 56.8683 41.1854 179.5271 33 I 3.7736 7.2620 119.0755 63.9660 37.5007 178.1650 34 V 3.5025 8.1884 118.8583 64.3171 32.6447 175.6302 35 Y 4.0128 7.4872 116.2716 54.3751 38.0301 174.0951 36 P 4.7104 0.0000 0.0000 64.0333 31.8579 177.7648 37 W 4.3799 8.1706 115.8008 59.5898 27.9295 178.0906 38 T 4.3044 7.5242 110.6929 64.6253 67.9403 176.2475 39 Q 4.2732 8.1783 121.0473 58.6086 28.3904 178.2622 40 R 3.7622 7.8585 119.3611 59.2398 29.9996 177.5761 41 F 4.3409 7.5471 114.3129 57.8035 39.4953 175.4256 42 F 4.5104 8.2210 118.8646 56.9197 39.9498 176.9609 43 D 4.4756 8.3968 122.6347 57.2034 40.8434 177.9038 44 S 4.5383 8.1437 111.1959 59.2639 63.5515 174.5326 45 F 4.4778 8.5454 119.4990 57.6307 39.6320 177.3716 46 G 3.7795 8.1224 108.0695 44.3509 0.0000 171.9672 47 D 4.3662 8.7544 120.6819 55.2614 41.1358 176.9565 48 L 4.8521 8.4199 125.6929 54.5696 42.9556 177.4736 49 S 4.5004 8.5589 113.1040 59.3284 63.6547 174.3606 50 T 4.7057 8.2176 112.0304 58.7641 72.9434 172.5676 51 P 4.1833 0.0000 0.0000 66.0977 31.3248 178.7635 52 D 4.3348 8.0138 117.3545 57.2764 40.6202 178.7377 53 S 4.2235 8.1619 115.5838 60.7615 63.3780 176.4016 54 V 3.7196 8.0702 122.1401 66.2036 31.1428 177.9306 55 M 4.2476 8.2033 116.6758 56.9645 32.2314 177.7429 56 S 4.8360 7.8724 113.2002 57.0630 63.6320 172.9799 57 N 4.4250 7.7153 121.7718 53.4649 39.1884 174.8768 58 A 3.9893 8.6490 131.1098 55.3477 18.4449 178.9094 59 K 3.7198 8.0137 117.5036 59.2097 32.1671 179.0568 60 V 3.8354 8.5997 119.2103 66.0496 31.4199 178.2496 61 K 3.9740 8.1208 117.9667 59.3437 31.8724 179.3410 62 A 4.0056 8.3826 121.5248 55.3443 18.3077 179.2079 63 H 4.3415 8.7666 117.4242 59.4307 30.0354 177.6992 64 G 3.7468 8.5548 107.8536 47.6705 0.0000 175.5823 65 K 4.0970 8.0121 121.4685 59.2358 32.2360 179.0953 66 K 4.0134 7.9605 118.5149 59.3934 31.9355 179.4384 67 V 3.6599 8.1900 118.8746 66.0505 31.4579 177.7707 68 L 4.3261 8.6023 120.4948 58.4506 41.8414 178.5005 69 N 4.5218 8.6321 116.9956 56.5394 38.7667 176.9117 70 S 4.3945 8.1151 116.2674 60.6796 62.4430 175.9316 71 F 4.1277 8.6878 120.7049 60.8066 38.6592 177.8138 72 S 4.0744 8.7320 114.8307 61.6371 62.1931 176.3177 73 D 4.4346 8.5345 121.9674 57.3447 40.5869 179.1163 74 G 3.8125 8.2379 106.1419 48.0761 0.0000 175.7822 75 L 3.9381 7.9464 120.5159 56.7960 41.5840 179.1193 76 K 4.2404 7.8512 116.9008 57.2525 33.6700 176.6022 77 N 5.0402 7.8916 116.2553 51.9448 38.9896 175.5980 78 L 4.0454 7.7246 117.5538 57.1348 42.4635 178.3869 79 D 4.5638 7.8458 116.2711 54.1060 41.7212 175.8922 80 N 5.0521 7.8829 118.4819 51.7112 39.4461 175.9179 81 L 4.1771 7.9863 120.5381 57.5786 41.8836 178.8478 82 K 3.9777 8.1098 118.6740 59.5011 32.3443 178.4327 83 G 3.7651 8.0025 105.2100 48.3617 0.0000 175.5347 84 T 3.6578 7.5931 117.1750 65.2359 68.5466 175.0722 85 F 4.6302 7.6990 116.0504 56.9960 39.9932 177.0417 86 A 4.1475 7.8409 124.8292 55.3063 18.0313 179.8772 87 K 3.8202 8.0298 117.1662 59.9019 32.1987 178.8157 88 L 4.0623 7.8931 118.5912 57.6121 41.5213 179.2475 89 S 4.2430 8.8102 115.4809 60.9030 62.3623 176.0654 90 E 4.0184 8.4801 121.4850 59.2658 29.2106 178.8462 91 L 3.9157 8.1452 120.4495 58.8938 42.1011 178.9625 92 H 4.2670 8.7251 116.2268 58.6526 28.2014 177.6187 93 C 4.1943 8.4435 118.6921 62.7220 28.1594 175.8100 94 D 4.4493 8.4707 119.2358 56.2345 41.0086 177.7839 95 K 4.2716 7.9752 116.5742 57.6961 33.3167 177.4397 96 L 4.1562 8.1462 117.4795 55.0085 42.1750 176.3188 97 H 4.2404 7.8030 113.0461 56.1253 25.7872 174.9372 98 V 3.5898 7.9461 119.6659 61.4317 32.1356 175.0266 99 D 4.3055 8.6148 127.1401 53.6520 41.8763 175.2565 100 P 2.9700 0.0000 0.0000 64.8331 31.9200 177.8865 101 E 3.8671 8.3061 118.9384 59.7633 29.2636 178.8536 102 N 4.4234 7.9894 116.0164 55.9023 38.4328 177.3433 103 F 4.5014 7.6116 119.6121 60.6603 38.9016 177.8000 104 K 4.0706 8.0849 117.5505 59.3444 31.8688 179.1946 105 L 3.8544 7.9180 119.2900 57.6996 41.4257 179.3505 106 L 4.1077 8.5770 120.6829 58.1405 41.9848 179.1499 107 G 3.7701 8.5717 105.9821 48.1448 0.0000 175.4411 108 N 4.4461 8.6159 119.1871 55.8327 38.4635 177.8223 109 V 3.6228 8.1137 120.2034 65.6979 31.6315 177.7504 110 L 3.8088 8.2380 120.5769 58.1197 41.7943 179.0097 111 V 3.4894 7.9754 118.2528 66.3010 31.4508 177.6214 112 C 4.0158 8.1733 116.4439 62.9523 27.9950 176.4293 113 V 3.5998 7.8991 119.7592 65.8170 31.0216 178.0007 114 L 3.8590 8.1067 118.9218 57.5839 41.3133 179.2870 115 A 3.6869 7.3406 120.8267 55.3328 18.0953 179.1036 116 H 4.0923 8.1573 115.5888 59.9202 30.0153 176.9060 117 H 3.9666 8.5011 117.0274 57.8623 28.9512 176.8748 118 F 4.5594 8.5102 118.3422 55.8650 40.0557 177.1810 119 G 3.8431 9.0842 107.9591 46.3356 0.0000 177.6893 120 K 4.0105 8.8929 125.2884 58.6350 32.1742 177.3577 121 E 4.1178 8.0495 118.7624 58.8528 29.9756 177.1739 122 F 4.5137 8.1726 122.9101 57.1024 37.7357 175.1936 123 T 4.1676 7.4014 115.6205 60.2765 71.2410 173.3236 124 P 4.0668 0.0000 0.0000 66.2078 31.3495 178.9732 125 Q 3.9176 7.8644 116.0191 58.8572 28.7659 178.6775 126 V 3.5173 7.6613 119.2744 65.7782 31.4875 177.6557 127 Q 3.4377 8.1162 119.5257 59.1101 28.9941 178.0195 128 A 3.9488 8.1856 121.7209 55.3725 18.3236 179.4892 129 A 3.8811 7.8547 118.6318 55.6208 18.4285 179.5526 130 Y 3.8008 8.1087 115.2343 61.1745 37.9026 178.7368 131 Q 4.1738 9.0218 119.5557 58.7943 28.6762 178.9949 132 K 3.9698 7.9194 119.2940 59.3020 32.0536 179.3492 133 V 3.5424 7.6588 118.4478 66.3983 31.4225 178.6233 134 V 3.9528 8.3979 112.1578 64.2442 31.3631 178.4926 135 A 4.1747 8.3855 120.9889 55.0552 18.1036 179.9794 136 G 3.5138 8.3027 104.6028 47.7609 0.0000 176.3044 137 V 2.9433 8.1473 120.8759 65.3473 31.4861 177.9686 138 A 3.8362 8.1937 120.8900 55.3776 18.0638 179.3604 139 N 4.3116 8.4422 113.6880 56.4334 38.7169 177.2373 140 A 4.1666 8.0630 122.4951 54.9163 18.2592 179.4644 141 L 3.6828 8.0321 119.0976 57.7922 41.7537 178.6841 142 A 4.5272 7.9303 119.5198 54.3581 18.5730 178.3768 143 H 4.2757 7.7346 116.5908 58.1081 29.8534 175.0334 144 K 3.9190 7.9290 119.8499 57.4306 31.7714 176.4775 145 Y 3.8136 8.3439 120.9574 58.4860 37.7503 169.9647 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 4.01 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 0.97 0.00 0.00 0.90 0.00 0.00 2 H 7.81 4.85 0.00 3.24 3.21 0.00 5.76 0.00 0.00 0.00 0.00 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3 L 8.14 4.55 0.00 1.56 1.53 0.87 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 4 T 8.46 4.08 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 1.20 0.00 0.00 5 A 8.46 3.95 1.32 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 0.00 0.00 6 E 8.12 3.85 0.00 2.07 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 0.00 2.36 2.44 0.00 7 E 8.31 3.93 0.00 2.15 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 2.28 2.31 0.00 8 K 8.05 3.90 0.00 1.95 1.81 0.00 1.63 0.00 0.00 1.52 0.00 0.00 2.82 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.38 1.52 7.81 9 S 8.25 4.07 0.00 3.87 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 10 L 8.03 4.00 0.00 1.89 1.70 0.88 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 11 V 7.85 3.50 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.78 0.00 0.00 0.31 0.00 0.00 12 S 8.32 4.41 0.00 4.16 4.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 G 8.01 3.63 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 0.00 0.00 0.00 14 L 7.79 3.92 0.00 1.87 1.80 0.43 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 15 W 8.83 4.23 0.00 3.76 3.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 16 A 8.05 4.11 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 17 K 7.92 4.44 0.00 2.10 2.05 0.00 1.82 0.00 0.00 1.70 0.00 0.00 3.22 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.45 1.65 7.81 18 V 7.04 3.60 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 0.17 0.00 0.00 0.64 0.00 0.00 19 N 8.38 4.42 0.00 2.70 2.60 0.00 0.00 7.23 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 8.11 3.68 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 0.79 0.00 0.00 0.90 0.00 0.00 21 D 8.46 4.54 0.00 2.75 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 22 E 7.95 4.48 0.00 1.89 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 0.00 2.25 2.22 0.00 23 V 7.71 3.51 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 0.83 0.00 0.00 0.53 0.00 0.00 24 G 8.01 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 25 G 8.01 3.63 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 0.00 0.00 0.00 26 E 8.43 3.84 0.00 2.18 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.44 0.00 27 A 8.14 3.95 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 28 L 8.19 3.98 0.00 1.85 1.71 0.74 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 0.00 0.00 0.00 0.00 29 G 8.77 3.66 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 0.00 0.00 0.00 30 R 8.39 3.93 0.00 1.79 1.93 0.00 3.18 0.00 0.00 3.03 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.67 0.00 31 L 8.37 4.22 0.00 1.85 1.85 0.98 0.66 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 32 L 7.95 4.17 0.00 1.77 1.61 0.60 0.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 33 I 7.26 3.77 1.77 0.00 0.00 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 1.35 0.52 0.82 0.00 0.00 34 V 8.19 3.50 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 -0.08 0.00 0.00 0.77 0.00 0.00 35 Y 7.49 4.01 0.00 2.52 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 4.71 0.00 2.22 2.09 0.00 3.98 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 2.14 2.08 0.00 37 W 8.17 4.38 0.00 3.60 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 38 T 7.52 4.30 4.45 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 1.04 0.00 0.00 39 Q 8.18 4.27 0.00 2.26 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.09 6.78 0.00 0.00 0.00 0.00 0.00 2.38 2.44 0.00 40 R 7.86 3.76 0.00 1.66 1.56 0.00 3.09 0.00 0.00 2.88 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 1.43 0.00 41 F 7.55 4.34 0.00 2.54 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 42 F 8.22 4.51 0.00 2.79 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 43 D 8.40 4.48 0.00 2.67 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 44 S 8.14 4.54 0.00 4.12 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 45 F 8.55 4.48 0.00 3.27 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 46 G 8.12 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 0.00 0.00 0.00 47 D 8.75 4.37 0.00 2.67 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 48 L 8.42 4.85 0.00 1.65 1.60 0.96 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 49 S 8.56 4.50 0.00 3.98 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 0.00 50 T 8.22 4.71 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 4.18 0.00 2.15 2.11 0.00 3.58 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.15 0.00 52 D 8.01 4.33 0.00 2.75 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 S 8.16 4.22 0.00 4.20 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 54 V 8.07 3.72 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 1.02 0.00 0.00 0.96 0.00 0.00 55 M 8.20 4.25 0.00 2.00 2.09 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 2.60 2.87 0.00 56 S 7.87 4.84 0.00 4.04 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 57 N 7.72 4.42 0.00 3.09 2.93 0.00 0.00 7.05 7.32 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 58 A 8.65 3.99 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 59 K 8.01 3.72 0.00 1.53 1.48 0.00 1.34 0.00 0.00 0.89 0.00 0.00 2.35 0.00 0.00 2.72 0.00 0.00 0.00 0.00 0.30 0.85 7.81 60 V 8.60 3.84 2.29 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 1.06 0.00 0.00 1.02 0.00 0.00 61 K 8.12 3.97 0.00 2.04 1.84 0.00 1.70 0.00 0.00 1.64 0.00 0.00 2.95 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.45 1.64 7.81 62 A 8.38 4.01 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 8.77 4.34 0.00 3.48 3.72 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 8.55 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 65 K 8.01 4.10 0.00 1.94 2.06 0.00 1.65 0.00 0.00 1.66 0.00 0.00 2.97 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.47 1.72 7.81 66 K 7.96 4.01 0.00 2.04 1.90 0.00 1.83 0.00 0.00 1.65 0.00 0.00 2.93 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.51 1.50 7.81 67 V 8.19 3.66 2.38 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 1.30 0.00 0.00 0.96 0.00 0.00 68 L 8.60 4.33 0.00 1.98 1.92 1.06 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 69 N 8.63 4.52 0.00 2.94 3.10 0.00 0.00 6.85 7.20 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 70 S 8.12 4.39 0.00 4.03 4.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 71 F 8.69 4.13 0.00 3.54 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 72 S 8.73 4.07 0.00 4.23 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 73 D 8.53 4.43 0.00 2.73 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 74 G 8.24 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 0.00 0.00 0.00 75 L 7.95 3.94 0.00 1.27 1.42 -0.71 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 76 K 7.85 4.24 0.00 1.82 1.84 0.00 1.66 0.00 0.00 1.74 0.00 0.00 3.13 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.48 1.72 7.81 77 N 7.89 5.04 0.00 2.68 2.62 0.00 0.00 6.85 6.20 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 78 L 7.72 4.05 0.00 1.54 1.63 0.81 1.03 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 79 D 7.85 4.56 0.00 2.59 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 7.88 5.05 0.00 2.71 2.60 0.00 0.00 7.19 6.83 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 81 L 7.99 4.18 0.00 1.80 1.87 0.95 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 82 K 8.11 3.98 0.00 1.64 1.80 0.00 1.63 0.00 0.00 1.47 0.00 0.00 3.07 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.31 1.52 7.81 83 G 8.00 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 84 T 7.59 3.66 3.68 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 0.42 0.00 0.00 85 F 7.70 4.63 0.00 3.15 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 86 A 7.84 4.15 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 K 8.03 3.82 0.00 1.82 1.82 0.00 1.71 0.00 0.00 1.80 0.00 0.00 2.96 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.52 1.55 7.81 88 L 7.89 4.06 0.00 1.96 1.75 1.00 0.88 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 8.81 4.24 0.00 4.04 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 0.00 90 E 8.48 4.02 0.00 2.21 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 2.58 0.00 91 L 8.15 3.92 0.00 1.83 1.89 0.90 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 92 H 8.73 4.27 0.00 3.43 3.65 0.00 5.86 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 C 8.44 4.19 0.00 3.15 3.02 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 94 D 8.47 4.45 0.00 2.80 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 95 K 7.98 4.27 0.00 1.90 1.81 0.00 1.76 0.00 0.00 1.71 0.00 0.00 3.00 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.37 1.38 7.81 96 L 8.15 4.16 0.00 1.60 1.58 0.66 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 97 H 7.80 4.24 0.00 3.45 3.45 0.00 5.76 0.00 0.00 0.00 0.00 8.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 V 7.95 3.59 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.32 0.00 0.00 0.17 0.00 0.00 99 D 8.61 4.31 0.00 2.69 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 0.00 100 P 0.00 2.97 0.00 2.10 2.04 0.00 3.53 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 2.06 1.99 0.00 101 E 8.31 3.87 0.00 2.03 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.43 0.00 102 N 7.99 4.42 0.00 2.77 2.89 0.00 0.00 6.98 8.16 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 0.00 103 F 7.61 4.50 0.00 3.13 2.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 104 K 8.08 4.07 0.00 1.99 1.89 0.00 1.69 0.00 0.00 1.84 0.00 0.00 2.98 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.58 1.60 7.81 105 L 7.92 3.85 0.00 1.65 1.08 0.55 0.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 106 L 8.58 4.11 0.00 1.83 1.97 1.01 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 107 G 8.57 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 0.00 108 N 8.62 4.45 0.00 3.04 2.96 0.00 0.00 6.68 8.44 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 0.00 109 V 8.11 3.62 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 1.15 0.00 0.00 1.18 0.00 0.00 110 L 8.24 3.81 0.00 1.55 1.65 0.82 -0.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 111 V 7.98 3.49 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 1.32 0.00 0.00 1.14 0.00 0.00 112 C 8.17 4.02 0.00 3.18 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 7.90 3.60 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 0.79 0.00 0.00 0.96 0.00 0.00 114 L 8.11 3.86 0.00 0.94 0.96 0.53 0.70 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 0.00 115 A 7.34 3.69 1.32 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 0.00 0.00 116 H 8.16 4.09 0.00 3.15 3.49 0.00 5.77 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 8.50 3.97 0.00 2.84 2.58 0.00 5.69 0.00 0.00 0.00 0.00 7.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 F 8.51 4.56 0.00 3.26 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 0.00 119 G 9.08 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 8.89 4.01 0.00 1.77 1.91 0.00 1.81 0.00 0.00 1.67 0.00 0.00 2.97 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.46 1.46 7.81 121 E 8.05 4.12 0.00 2.21 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 2.39 2.32 0.00 122 F 8.17 4.51 0.00 3.07 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 0.00 123 T 7.40 4.17 4.35 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 1.29 0.00 0.00 124 P 0.00 4.07 0.00 2.15 2.15 0.00 3.57 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 2.12 2.20 0.00 125 Q 7.86 3.92 0.00 2.09 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.91 0.00 0.00 0.00 0.00 0.00 2.42 2.44 0.00 126 V 7.66 3.52 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 1.00 0.00 0.00 0.89 0.00 0.00 127 Q 8.12 3.44 0.00 1.64 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.50 0.00 0.00 0.00 0.00 0.00 2.38 2.53 0.00 128 A 8.19 3.95 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 7.85 3.88 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 0.00 130 Y 8.11 3.80 0.00 3.44 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 0.00 131 Q 9.02 4.17 0.00 2.23 2.21 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 2.75 2.61 0.00 132 K 7.92 3.97 0.00 1.98 1.84 0.00 1.65 0.00 0.00 1.66 0.00 0.00 2.89 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.45 1.65 7.81 133 V 7.66 3.54 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 1.07 0.00 0.00 0.73 0.00 0.00 134 V 8.40 3.95 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 0.84 0.00 0.00 1.14 0.00 0.00 135 A 8.39 4.17 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 136 G 8.30 3.51 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 0.00 137 V 8.15 2.94 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 0.78 0.00 0.00 138 A 8.19 3.84 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 0.00 139 N 8.44 4.31 0.00 2.79 2.93 0.00 0.00 7.08 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 140 A 8.06 4.17 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 0.00 141 L 8.03 3.68 0.00 1.18 0.38 0.39 -0.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.68 0.00 0.00 0.00 0.00 0.00 0.00 142 A 7.93 4.53 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 0.00 143 H 7.73 4.28 0.00 3.25 3.40 0.00 5.96 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 0.00 144 K 7.93 3.92 0.00 1.93 2.04 0.00 1.83 0.00 0.00 1.77 0.00 0.00 3.26 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.66 1.58 7.81 145 Y 8.34 3.81 0.00 3.12 2.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00