NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 T 4.4906 8.1744 117.3775 63.4501 69.8903 172.8022 3 R 4.4839 8.8042 125.8383 54.0959 32.8737 172.5125 4 I 4.3704 9.7089 127.2255 59.7222 39.7668 174.5204 5 N 5.0892 9.2257 122.9330 51.9520 40.5308 174.7413 6 L 4.7886 8.2727 118.0161 54.8834 43.4685 177.6606 7 T 4.2112 7.6891 108.3461 60.5667 69.8632 174.2026 8 L 4.1119 8.3625 122.2721 55.1370 42.4490 179.2318 9 V 3.7722 8.5320 116.4540 64.3715 31.7307 178.2300 10 S 4.9495 8.0254 111.8283 59.5093 63.1357 174.3264 11 E 4.5634 7.9837 119.5739 56.2581 29.9964 176.3134 12 L 4.2984 7.7449 119.1360 54.0654 42.4767 177.5163 13 A 4.7288 8.4854 124.8375 51.5501 20.3707 178.4100 14 D 4.5311 9.5289 122.6843 58.0417 41.0384 179.8759 15 Q 3.9449 8.1602 117.6114 59.3963 28.7676 178.5616 16 H 4.4464 8.1912 116.7654 58.5402 28.7558 177.4892 17 L 4.0606 8.3629 122.4964 58.5414 42.1149 179.0054 18 M 4.1116 8.3472 118.5444 58.2657 31.7786 178.5972 19 A 4.0169 8.1747 120.9581 55.2699 18.5452 179.3801 20 E 3.8774 8.4233 117.8592 59.4088 29.4876 178.0838 21 Y 4.1293 8.1342 119.0466 60.9391 38.8101 178.3103 22 R 3.8603 7.8301 117.6223 58.9676 30.5838 178.2391 23 E 4.1709 8.3798 118.2407 58.4482 29.8132 178.4089 24 L 3.7424 8.1172 120.9266 57.8910 41.9676 177.4684 25 P 4.1064 0.0000 0.0000 65.0208 31.2550 178.5300 26 R 3.9137 7.8061 117.3517 59.1095 29.7894 179.0553 27 V 3.5529 7.4662 118.1437 65.8180 31.4519 177.9188 28 F 4.4551 7.4161 117.5797 60.7652 38.7909 177.9281 29 G 3.5711 8.1651 104.4695 47.6259 0.0000 175.4035 30 A 3.8767 7.9723 123.1557 54.8647 18.4245 179.9055 31 V 3.0015 7.6081 116.7650 65.9814 31.4688 178.2694 32 R 3.8055 7.9044 117.8330 59.1503 29.8120 178.8986 33 K 3.8618 8.0265 119.1979 59.9228 32.1318 178.6463 34 H 4.3585 8.1536 116.4686 58.7653 28.6058 178.0026 35 V 3.6010 8.2608 120.3396 66.0172 31.1702 178.0341 36 A 4.1072 8.0155 119.2621 54.6533 18.2109 178.2906 37 N 4.7556 7.6951 112.7714 53.0069 38.7699 176.0124 38 G 3.9454 7.8883 108.4081 45.6843 0.0000 174.2594 39 K 4.4710 8.1101 118.5922 55.7199 33.0390 176.4455 40 R 4.9810 9.0930 120.0710 54.0798 33.5919 177.5289 41 V 3.7820 8.7577 113.4580 64.5334 31.5048 178.9101 42 R 4.1174 7.7978 114.2807 58.0003 29.4204 176.9358 43 D 4.3361 7.9672 118.1176 55.2959 41.1471 176.1004 44 F 4.8115 7.6728 118.0609 55.4967 40.9339 176.0691 45 K 4.2455 8.4853 125.5655 55.2436 30.7954 174.7099 46 I 4.1626 7.8662 125.4386 59.2417 38.0227 176.2847 47 S 4.2878 8.5736 120.6188 57.6953 62.7804 172.3609 48 P 4.4953 0.0000 0.0000 64.7174 31.6779 175.9719 49 T 4.7912 7.5364 112.0256 59.5101 70.5521 172.9278 50 F 2.4855 8.5344 127.8283 57.8517 39.8595 174.3896 51 I 4.1643 5.9750 118.7523 58.9698 40.5241 174.2078 52 L 4.3232 7.9702 120.8820 54.0243 44.3891 178.0288 53 G 3.7241 8.2705 105.7330 44.4741 0.0000 172.9110 54 A 4.0724 8.3220 125.9608 54.3164 18.7075 177.9513 55 G 3.9260 8.9617 111.8100 45.6563 0.0000 174.4626 56 H 4.0516 8.3168 119.4897 59.3501 30.0681 176.9952 57 V 3.8711 7.7473 119.4518 66.4167 31.4156 177.8818 58 T 2.4800 7.6492 114.9168 66.0547 67.9575 175.9000 59 F 3.8279 7.8141 121.8278 60.6742 39.3816 176.1637 60 F 4.3990 7.9942 115.6505 57.6140 38.7829 177.1190 61 Y 4.5218 8.0414 118.6668 60.0492 37.7954 176.5014 62 D 5.1894 7.8531 117.9053 52.8910 40.1667 176.4857 63 K 5.1941 8.1312 118.8661 56.2590 33.2681 178.7135 64 L 4.3233 8.4449 121.7727 57.8274 41.4799 178.5498 65 E 4.0205 8.4332 119.6942 58.9854 29.5543 178.4320 66 F 4.3400 8.4765 120.3800 61.5615 39.4263 177.0268 67 L 3.8106 8.0834 118.0980 57.5384 41.5008 179.3821 68 R 4.0932 8.5058 118.9496 59.6655 29.9322 178.8230 69 K 4.0111 8.2236 118.2414 59.3781 31.8975 179.4114 70 R 3.7830 7.8114 119.1495 59.1185 29.8247 178.2919 71 Q 3.9713 8.3576 119.8223 59.0026 29.0078 178.1261 72 I 3.7068 7.6442 120.5315 64.6485 37.2327 178.1622 73 E 3.9840 7.9285 119.0159 59.3617 29.2233 179.4871 74 L 4.0462 8.2757 119.2562 57.8436 41.7418 179.5665 75 I 3.6863 8.1281 119.6490 64.5078 37.0295 178.3322 76 A 3.9815 7.9874 121.4886 55.1576 18.0023 179.3403 77 E 3.8110 8.2685 117.8727 59.3402 29.6989 178.6890 78 C 3.9979 8.1370 116.9253 62.8498 28.2262 176.1693 79 L 3.8348 7.8302 120.3675 57.5940 40.9693 179.3060 80 K 3.7922 7.8732 118.6957 59.5239 32.1613 178.1714 81 R 3.5461 7.0421 114.7953 55.7995 29.9552 177.2347 82 G 3.7449 7.3454 107.0173 45.6598 0.0000 173.9285 83 F 4.6532 7.0629 117.6802 57.0495 39.3495 175.6518 84 N 4.6430 8.6439 123.5053 52.2373 37.6680 173.8487 85 I 4.4449 7.7260 117.4625 58.7209 40.0290 176.1549 86 K 4.0493 8.7317 123.2796 58.3099 32.5750 176.2563 87 D 4.7982 7.8252 118.0508 53.1188 41.4929 175.4691 88 T 4.6088 8.6017 116.1086 61.3033 69.2046 173.9424 89 T 4.6298 7.6938 111.3096 59.8704 70.9715 174.0762 90 V 3.7985 8.1524 123.8133 62.2301 32.3260 175.6452 91 Q 3.9365 8.4311 127.9711 56.0606 29.5082 174.8987 92 D 4.4683 8.4243 124.5948 53.7458 41.9819 175.7195 93 I 4.3911 7.9673 118.4329 60.4265 38.0138 177.2910 94 S 4.2328 8.4599 117.4841 61.0633 62.7832 175.3062 95 D 4.4417 7.9045 119.8585 55.5034 39.6108 176.6352 96 I 4.0254 7.3950 121.0993 59.6407 38.0775 174.0232 97 P 4.3998 0.0000 0.0000 62.8446 32.0538 177.1649 98 Q 4.0809 8.9648 122.9037 59.1714 29.1057 178.5087 99 E 3.9828 8.2092 114.5792 58.7549 29.8130 177.7320 100 F 4.3959 8.3667 117.7924 58.8636 39.9902 176.1516 101 R 4.7885 7.8583 122.3629 55.0810 29.0425 175.4115 102 G 4.0521 8.0035 107.1095 45.6635 0.0000 172.3355 103 D 5.5503 8.2040 119.8342 53.4009 43.9004 174.1987 104 Y 4.8947 8.2284 117.2654 56.9618 41.6407 173.9639 105 I 4.1848 8.0381 126.5131 58.4989 39.5113 173.4199 106 P 3.9490 0.0000 0.0000 62.1264 32.2689 176.5010 107 H 4.4107 8.4089 119.7275 55.7979 32.0331 176.1550 108 E 3.9767 8.3237 123.6010 59.3132 29.1001 179.5344 109 A 4.0762 8.2885 120.6239 54.9843 18.5589 179.7717 110 S 4.1793 8.0298 113.4176 61.8934 63.0388 176.6097 111 I 3.5977 7.7748 122.2810 64.3349 36.7058 178.3183 112 A 4.0453 8.2232 121.6264 55.0984 18.0404 179.7507 113 I 3.6961 7.6156 118.5072 64.5993 37.3389 178.5899 114 S 4.2600 8.0723 113.7734 61.4417 62.1610 175.9393 115 Q 3.9426 8.5347 122.4447 59.2080 28.7805 177.9470 116 A 3.9697 8.3426 122.1380 55.2155 18.3360 179.6339 117 R 3.8167 7.8162 117.2488 59.4963 30.2109 178.7662 118 L 3.8372 7.7478 118.2874 57.7978 41.5396 179.1204 119 D 4.2807 8.2444 118.9782 57.4318 40.5849 178.4971 120 E 3.8963 8.0518 118.2950 59.1930 29.7808 178.7672 121 K 4.1651 7.9556 118.3494 59.5866 32.2972 179.3495 122 I 2.8997 7.4232 119.7003 64.1625 36.7286 178.3490 123 A 4.0694 7.9443 120.3180 55.1113 18.1257 179.3455 124 Q 4.2991 7.6831 116.0422 58.3081 29.9838 177.1813 125 R 4.3903 7.8006 117.5261 54.9154 31.9403 172.9561 126 P 4.6181 0.0000 0.0000 64.8958 31.8526 178.7478 127 T 4.1352 7.7813 107.0407 63.5738 68.8403 175.1222 128 W 4.5542 8.2610 121.0569 57.8998 29.3684 175.4332 129 Y 5.0871 7.9012 116.0707 56.1672 40.3809 175.2133 130 K 5.2327 9.7911 120.7735 55.1906 37.6319 174.9299 131 Y 5.2323 8.8589 122.6854 56.2895 41.5131 174.9447 132 Y 3.3418 10.0291 126.9709 59.1743 35.9300 171.8788 133 G 4.0360 9.2147 106.5202 45.6962 0.0000 174.2927 134 K 4.5310 8.0890 119.8216 54.7913 33.6914 176.3704 135 A 4.9030 8.3839 127.1195 51.3663 16.7723 176.9989 136 I 4.1299 7.6265 111.1538 60.3712 38.5500 176.2186 137 Y 4.6862 7.6371 119.8159 56.8284 39.3758 175.4733 138 A 4.2892 8.4346 125.7454 52.5509 19.4289 175.6954 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ 2 T 8.17 4.49 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 1.25 0.00 0.00 3 R 8.80 4.48 0.00 1.70 1.77 0.00 3.24 0.00 0.00 3.21 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.65 0.00 4 I 9.71 4.37 1.41 0.00 0.00 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.15 0.53 0.00 0.00 5 N 9.23 5.09 0.00 2.85 2.78 0.00 0.00 6.88 7.41 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 6 L 8.27 4.79 0.00 1.47 1.61 -0.03 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 7 T 7.69 4.21 4.27 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 1.27 0.00 0.00 8 L 8.36 4.11 0.00 1.77 1.69 1.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 9 V 8.53 3.77 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 0.91 0.00 0.00 1.03 0.00 0.00 10 S 8.03 4.95 0.00 4.11 4.07 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 11 E 7.98 4.56 0.00 2.18 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 0.00 2.31 2.32 0.00 12 L 7.74 4.30 0.00 1.91 1.76 1.01 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 13 A 8.49 4.73 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 14 D 9.53 4.53 0.00 2.73 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 15 Q 8.16 3.94 0.00 2.18 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.92 0.00 0.00 0.00 0.00 0.00 2.19 2.35 0.00 16 H 8.19 4.45 0.00 3.38 3.40 0.00 5.64 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 17 L 8.36 4.06 0.00 1.88 2.06 1.04 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 18 M 8.35 4.11 0.00 2.03 2.04 0.00 0.00 0.00 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 2.66 0.00 19 A 8.17 4.02 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 20 E 8.42 3.88 0.00 2.19 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 0.00 2.30 2.46 0.00 21 Y 8.13 4.13 0.00 3.00 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 22 R 7.83 3.86 0.00 2.02 1.93 0.00 3.22 0.00 0.00 3.27 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 2.03 0.00 23 E 8.38 4.17 0.00 1.97 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 2.27 2.47 0.00 24 L 8.12 3.74 0.00 1.56 1.77 0.77 0.78 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 25 P 0.00 4.11 0.00 2.16 2.20 0.00 3.52 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 1.91 2.10 0.00 26 R 7.81 3.91 0.00 1.98 1.96 0.00 3.08 0.00 0.00 3.06 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.62 0.00 27 V 7.47 3.55 1.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 0.89 0.00 0.00 28 F 7.42 4.46 0.00 3.17 2.79 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 29 G 8.17 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 30 A 7.97 3.88 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 31 V 7.61 3.00 1.77 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 -0.02 0.00 0.00 0.25 0.00 0.00 32 R 7.90 3.81 0.00 1.99 1.91 0.00 3.14 0.00 0.00 3.04 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.75 0.00 33 K 8.03 3.86 0.00 1.83 1.83 0.00 1.57 0.00 0.00 1.58 0.00 0.00 2.93 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.38 1.44 7.81 34 H 8.15 4.36 0.00 3.31 3.54 0.00 5.68 0.00 0.00 0.00 0.00 6.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 V 8.26 3.60 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 1.02 0.00 0.00 0.72 0.00 0.00 36 A 8.02 4.11 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 37 N 7.70 4.76 0.00 2.89 2.89 0.00 0.00 7.07 8.95 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 38 G 7.89 3.95 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 0.00 0.00 0.00 0.00 0.00 0.00 39 K 8.11 4.47 0.00 2.08 1.81 0.00 1.37 0.00 0.00 1.64 0.00 0.00 2.81 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.55 1.71 7.81 40 R 9.09 4.98 0.00 1.73 1.91 0.00 3.38 0.00 0.00 3.21 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.71 0.00 41 V 8.76 3.78 1.91 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 -0.34 0.00 0.00 0.74 0.00 0.00 42 R 7.80 4.12 0.00 1.88 2.02 0.00 3.00 0.00 0.00 3.20 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.60 0.00 43 D 7.97 4.34 0.00 2.13 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 0.00 0.00 0.00 44 F 7.67 4.81 0.00 3.18 2.98 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 0.00 0.00 0.00 45 K 8.49 4.25 0.00 1.72 1.77 0.00 1.76 0.00 0.00 1.70 0.00 0.00 3.01 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.37 1.45 7.81 46 I 7.87 4.16 1.83 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.75 0.74 0.00 0.00 47 S 8.57 4.29 0.00 3.79 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 48 P 0.00 4.50 0.00 2.25 2.18 0.00 3.76 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 1.99 1.95 0.00 49 T 7.54 4.79 4.27 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 1.15 0.00 0.00 50 F 8.53 2.49 0.00 2.76 2.83 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 51 I 5.98 4.16 1.59 0.00 0.00 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.86 0.43 0.73 0.00 0.00 52 L 7.97 4.32 0.00 1.52 1.50 0.99 0.99 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 53 G 8.27 3.72 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 A 8.32 4.07 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 55 G 8.96 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 56 H 8.32 4.05 0.00 3.08 3.40 0.00 5.96 0.00 0.00 0.00 0.00 7.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 V 7.75 3.87 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 1.02 0.00 0.00 58 T 7.65 2.48 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 0.87 0.00 0.00 59 F 7.81 3.83 0.00 2.75 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 60 F 7.99 4.40 0.00 3.29 3.09 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 61 Y 8.04 4.52 0.00 2.58 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 62 D 7.85 5.19 0.00 2.73 2.78 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 63 K 8.13 5.19 0.00 1.97 1.88 0.00 0.61 0.00 0.00 0.61 0.00 0.00 2.13 0.00 0.00 2.46 0.00 0.00 0.00 0.00 1.10 1.01 7.81 64 L 8.44 4.32 0.00 1.90 2.05 1.03 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 65 E 8.43 4.02 0.00 2.31 2.17 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 2.38 2.45 0.00 66 F 8.48 4.34 0.00 3.62 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 67 L 8.08 3.81 0.00 2.03 1.51 0.68 0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 68 R 8.51 4.09 0.00 2.06 2.12 0.00 3.03 0.00 0.00 3.10 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.57 0.00 69 K 8.22 4.01 0.00 1.90 1.81 0.00 1.76 0.00 0.00 1.60 0.00 0.00 2.94 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.47 1.60 7.81 70 R 7.81 3.78 0.00 1.34 1.73 0.00 2.92 0.00 0.00 2.94 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.49 0.00 71 Q 8.36 3.97 0.00 2.29 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.54 0.00 0.00 0.00 0.00 0.00 2.44 2.52 0.00 72 I 7.64 3.71 2.06 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.57 0.92 0.00 0.00 73 E 7.93 3.98 0.00 2.13 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 2.33 2.47 0.00 74 L 8.28 4.05 0.00 1.93 1.89 1.02 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 75 I 8.13 3.69 1.93 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.10 1.00 0.00 0.00 76 A 7.99 3.98 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 77 E 8.27 3.81 0.00 2.17 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 2.47 2.32 0.00 78 C 8.14 4.00 0.00 2.96 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 79 L 7.83 3.83 0.00 1.76 1.64 0.89 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 80 K 7.87 3.79 0.00 1.75 1.90 0.00 2.08 0.00 0.00 1.84 0.00 0.00 3.06 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.47 1.50 7.81 81 R 7.04 3.55 0.00 0.67 0.66 0.00 2.82 0.00 0.00 2.33 7.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.17 0.00 82 G 7.35 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 F 7.06 4.65 0.00 2.91 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 84 N 8.64 4.64 0.00 2.69 2.77 0.00 0.00 6.94 7.94 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 85 I 7.73 4.44 1.67 0.00 0.00 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.74 0.50 0.00 0.00 86 K 8.73 4.05 0.00 1.77 1.92 0.00 1.77 0.00 0.00 1.65 0.00 0.00 2.99 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.42 1.44 7.81 87 D 7.83 4.80 0.00 2.76 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 88 T 8.60 4.61 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 1.22 0.00 0.00 89 T 7.69 4.63 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 90 V 8.15 3.80 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 0.78 0.00 0.00 0.94 0.00 0.00 91 Q 8.43 3.94 0.00 2.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.69 0.00 0.00 0.00 0.00 0.00 2.08 2.24 0.00 92 D 8.42 4.47 0.00 2.61 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 93 I 7.97 4.39 1.62 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.58 -0.06 0.00 0.00 94 S 8.46 4.23 0.00 3.97 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 95 D 7.90 4.44 0.00 2.77 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 96 I 7.39 4.03 1.95 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.45 0.78 0.00 0.00 97 P 0.00 4.40 0.00 2.51 2.12 0.00 3.64 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.18 0.00 98 Q 8.96 4.08 0.00 2.12 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.79 6.89 0.00 0.00 0.00 0.00 0.00 2.45 2.40 0.00 99 E 8.21 3.98 0.00 1.91 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 2.21 1.68 0.00 100 F 8.37 4.40 0.00 3.24 3.25 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 0.00 101 R 7.86 4.79 0.00 1.99 1.98 0.00 3.18 0.00 0.00 3.34 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.69 0.00 102 G 8.00 4.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 D 8.20 5.55 0.00 2.79 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 0.00 104 Y 8.23 4.89 0.00 2.68 2.51 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 0.00 105 I 8.04 4.18 1.79 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 1.48 0.80 0.84 0.00 0.00 106 P 0.00 3.95 0.00 1.97 1.62 0.00 3.52 0.00 0.00 2.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.76 0.00 107 H 8.41 4.41 0.00 3.20 3.20 0.00 5.68 0.00 0.00 0.00 0.00 6.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 108 E 8.32 3.98 0.00 1.95 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 2.34 2.27 0.00 109 A 8.29 4.08 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 0.00 110 S 8.03 4.18 0.00 3.98 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 0.00 111 I 7.77 3.60 1.97 0.00 0.00 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 1.38 0.73 0.90 0.00 0.00 112 A 8.22 4.05 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 0.00 113 I 7.62 3.70 2.30 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.95 1.07 0.00 0.00 114 S 8.07 4.26 0.00 3.83 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 0.00 115 Q 8.53 3.94 0.00 2.25 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.55 0.00 0.00 0.00 0.00 0.00 2.36 2.58 0.00 116 A 8.34 3.97 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 0.00 117 R 7.82 3.82 0.00 1.91 2.13 0.00 3.14 0.00 0.00 3.16 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.70 0.00 118 L 7.75 3.84 0.00 1.94 1.64 0.77 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 119 D 8.24 4.28 0.00 2.83 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 0.00 120 E 8.05 3.90 0.00 1.97 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 0.00 2.33 2.36 0.00 121 K 7.96 4.17 0.00 1.91 1.92 0.00 1.77 0.00 0.00 1.72 0.00 0.00 3.10 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.69 1.63 7.81 122 I 7.42 2.90 1.65 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 -0.20 0.36 0.46 0.00 0.00 123 A 7.94 4.07 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 0.00 124 Q 7.68 4.30 0.00 2.36 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.03 6.97 0.00 0.00 0.00 0.00 0.00 2.44 2.67 0.00 125 R 7.80 4.39 0.00 1.19 0.77 0.00 2.21 0.00 0.00 2.25 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.05 0.00 126 P 0.00 4.62 0.00 2.46 2.23 0.00 3.62 0.00 0.00 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.12 0.00 127 T 7.78 4.14 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 128 W 8.26 4.55 0.00 3.10 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 0.00 129 Y 7.90 5.09 0.00 2.63 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 0.00 130 K 9.79 5.23 0.00 1.89 1.87 0.00 1.74 0.00 0.00 1.75 0.00 0.00 2.90 0.00 0.00 3.24 0.00 0.00 0.00 0.00 1.46 1.60 7.81 131 Y 8.86 5.23 0.00 3.15 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 0.00 132 Y 10.03 3.34 0.00 2.88 2.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 133 G 9.21 4.04 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 0.00 0.00 0.00 134 K 8.09 4.53 0.00 2.09 1.78 0.00 1.81 0.00 0.00 1.88 0.00 0.00 3.04 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.43 1.46 7.81 135 A 8.38 4.90 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 0.00 136 I 7.63 4.13 1.63 0.00 0.00 0.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 -0.36 0.88 0.00 0.00 137 Y 7.64 4.69 0.00 3.30 2.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 138 A 8.43 4.29 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