NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 V 3.8665 8.0549 114.0294 61.4602 32.8547 174.7936 2 H 4.4294 8.6203 122.3589 53.8896 28.5102 172.7578 3 L 4.6670 8.0234 125.7094 52.7958 43.6350 177.0165 4 T 4.0143 8.8284 115.0690 60.7629 69.4958 173.2157 5 P 4.1321 0.0000 0.0000 66.6191 30.8446 178.4327 6 E 3.9415 8.1177 116.3370 58.8440 29.5034 178.7860 7 E 3.9219 8.7990 120.5106 58.8107 29.5035 178.9428 8 K 3.8095 7.8085 119.3109 59.5404 32.3343 178.6420 9 S 4.0610 8.2676 115.3292 61.7008 62.8483 176.4153 10 A 4.0006 8.0577 123.2141 55.2741 18.1601 179.8182 11 V 3.2752 7.8523 116.5495 66.5829 31.7476 178.4921 12 T 4.0115 7.9654 115.1966 66.4696 67.9960 176.7091 13 A 4.0747 8.3598 122.5691 55.1217 18.3520 179.2116 14 L 3.9966 8.2167 118.9010 57.8054 42.2647 178.8853 15 W 4.1976 8.6295 128.5438 60.0483 30.4608 178.2468 16 G 3.8878 8.2466 104.8133 46.2733 0.0000 173.9528 17 K 4.6263 7.5121 119.5821 56.4851 33.1622 175.8881 18 V 4.0283 7.1987 118.6056 62.1041 33.0341 175.5904 19 N 4.4641 8.0846 125.1312 52.4407 38.8582 175.5193 20 V 3.4283 7.9996 128.3688 65.9084 31.3320 177.2071 21 D 4.3953 8.0457 118.2355 56.8749 40.6344 178.0736 22 E 3.9754 8.5474 120.1731 58.9503 29.5803 178.8809 23 V 3.6196 7.9539 118.6573 65.4181 31.4951 178.2967 24 G 3.6697 7.9479 105.2535 47.8374 0.0000 175.9039 25 G 3.5940 7.6513 107.6278 47.2523 0.0000 175.3243 26 E 3.9013 7.8989 121.5150 58.8701 29.6622 178.8924 27 A 3.9036 8.1449 120.9230 55.1601 18.5449 179.4345 28 L 4.0058 8.1893 119.2564 57.9437 42.0814 179.3050 29 G 3.5468 8.4807 106.1765 48.0939 0.0000 176.0180 30 R 3.9474 8.1732 121.3575 58.2622 29.9578 179.0889 31 L 4.0445 7.9678 120.5255 58.1331 42.0843 178.8905 32 L 4.0230 7.8036 120.3168 57.0741 41.2735 179.8336 33 V 3.4849 7.3388 117.1404 65.9979 31.6781 178.0537 34 V 3.4494 7.7017 116.8926 64.6911 32.9232 175.7368 35 Y 3.8517 7.1669 115.1124 54.0896 37.7635 174.2164 36 P 5.2431 0.0000 0.0000 64.9184 31.5412 178.2369 37 W 4.3286 8.0308 115.7617 59.0401 28.2209 177.7546 38 T 4.3262 8.0839 111.0718 64.0726 68.2123 176.0874 39 Q 4.4546 8.3732 121.6958 58.0306 28.4432 178.1880 40 R 3.8038 7.7405 116.8008 58.6397 29.3078 177.7945 41 F 4.4564 7.4774 115.8313 57.2524 39.4121 175.7280 42 F 4.6855 7.9878 118.3652 57.2608 39.7844 176.3016 43 E 4.3079 8.5233 115.9340 57.3430 28.6475 177.5371 44 S 4.7611 8.0622 112.6843 58.4048 63.4719 174.7641 45 F 4.4015 8.7769 118.3515 59.0139 40.0626 175.8063 46 G 4.0988 8.1020 104.1938 44.0016 0.0000 175.2116 47 D 4.5474 8.6984 126.1917 54.0887 41.2343 176.0006 48 L 4.7933 8.2795 125.3929 54.9404 43.6120 177.3481 49 S 4.3653 8.2636 115.1658 60.3329 63.4685 174.6119 50 T 4.7179 7.4180 110.8395 58.3932 73.0033 172.3770 51 P 4.1833 0.0000 0.0000 66.3677 31.3373 178.6987 52 D 4.3520 8.0643 116.6222 57.1023 40.5843 178.3845 53 A 3.9925 7.9360 120.8439 55.3184 18.6382 179.5773 54 V 3.6511 8.1331 117.0626 66.4198 31.5069 178.1653 55 M 4.0659 8.1646 118.3349 57.8852 32.1392 178.0832 56 G 3.6412 7.8812 106.6528 46.9978 0.0000 172.8217 57 N 4.1364 7.9439 118.9421 53.2799 39.5539 173.0753 58 P 4.1915 0.0000 0.0000 65.9381 31.0897 178.5436 59 K 3.6550 8.4487 118.3827 59.3277 32.0160 179.3953 60 V 3.9899 8.1666 117.9446 65.9724 31.1057 178.1399 61 K 3.9310 7.9968 117.3603 59.3768 31.7561 178.8479 62 A 4.1268 8.0386 121.0501 55.4784 18.2771 179.1834 63 H 4.3721 8.9219 117.2706 59.4254 30.0092 177.6929 64 G 3.6382 8.0769 107.0973 47.6779 0.0000 175.5248 65 K 4.0403 7.8308 120.7787 59.0750 32.1124 179.2530 66 K 3.9922 8.1551 119.0966 59.3316 32.0786 179.2469 67 V 3.6535 7.7670 117.9478 66.3776 31.4042 177.9940 68 L 4.3998 8.1214 118.5975 57.5917 41.1911 179.7881 69 G 3.7189 7.9749 104.8169 47.7569 0.0000 175.3534 70 A 4.2263 8.2377 123.3491 54.8134 18.5200 179.4588 71 F 4.1425 8.5286 119.2533 61.7287 39.0010 177.4884 72 S 4.3351 8.9027 115.1812 61.8911 62.4329 176.4252 73 D 4.5062 7.8344 120.6415 57.2453 40.7768 178.8334 74 G 3.5695 7.6920 105.8270 47.6084 0.0000 175.5875 75 L 4.0719 7.3403 119.2481 56.4049 41.5990 178.3112 76 A 4.4346 7.3023 118.1032 52.1519 20.1605 176.5305 77 H 4.8503 8.5410 115.3300 54.2896 29.7622 175.1977 78 L 3.9204 7.9481 119.6841 57.8219 42.0414 179.2444 79 D 4.4903 7.9482 117.3254 56.6535 41.1877 176.2505 80 N 4.9401 8.0756 117.4937 51.2406 39.6577 174.2072 81 L 4.1427 8.0104 122.8459 56.7935 42.0650 178.5919 82 K 4.0954 7.9754 117.5648 59.4857 32.0291 179.2024 83 G 3.6886 8.0437 106.1342 47.8168 0.0000 175.9137 84 T 3.7091 7.3519 117.2395 66.1069 68.6595 175.8434 85 F 4.6901 7.8154 116.8339 57.2501 39.2013 177.4903 86 A 4.0560 7.6091 122.3156 55.7157 18.0094 180.4939 87 T 4.0032 7.8580 113.5701 66.9129 68.5407 176.8144 88 L 4.1328 7.9681 120.3827 57.6113 41.5807 179.3504 89 S 4.2873 8.4079 113.6340 61.5401 62.3674 176.1010 90 E 3.9275 8.1553 121.1286 59.1678 29.1095 179.1194 91 L 3.9082 7.7535 120.2726 58.6592 42.1568 178.7993 92 H 4.1551 8.6097 116.3176 59.2357 28.2825 176.9429 93 C 3.6109 7.7348 120.5691 61.9631 31.0818 175.3387 94 D 4.3131 8.3703 121.1303 57.2835 40.7576 178.0748 95 K 4.1215 7.7497 116.4894 58.3773 32.6743 177.9250 96 L 4.2727 7.9123 116.5256 54.5143 42.5137 176.0662 97 H 4.1636 7.2192 113.5393 56.6379 26.6479 175.0992 98 V 3.9786 7.9934 118.3815 60.9680 32.7518 174.8370 99 D 4.3905 8.7268 127.0698 53.8349 41.7212 175.2412 100 P 2.9700 0.0000 0.0000 64.5884 31.1785 178.2084 101 E 3.8705 8.4936 118.7147 58.9610 29.3105 178.3967 102 N 4.3509 7.6238 115.9823 55.8447 38.4364 177.2931 103 F 4.5301 7.5123 119.7472 60.6032 39.0862 177.8891 104 R 4.0002 7.9368 117.3412 59.0662 30.0507 178.7520 105 L 3.8060 7.6406 118.4742 57.7832 41.5773 179.4456 106 L 4.1229 7.8697 120.1448 57.9778 41.8979 179.1454 107 G 3.7448 8.2154 105.8544 47.9438 0.0000 175.2578 108 N 4.5384 8.2008 117.9087 55.2918 38.5482 177.7999 109 V 3.6744 7.5913 119.8639 65.7222 31.6559 177.7296 110 L 3.8506 8.3990 120.5701 58.0111 41.8276 179.2318 111 V 3.5682 7.6235 118.5747 66.0888 31.5151 177.8804 112 C 4.1542 7.8095 116.6013 62.6540 27.8898 176.3046 113 V 3.5697 7.9758 120.2124 65.8832 31.0271 178.1637 114 L 3.9252 7.6960 118.6119 57.5079 41.2573 179.4051 115 A 3.6275 7.3396 120.7520 55.0928 18.0899 179.0078 116 H 4.0977 7.9233 115.7055 59.8080 29.9842 176.6955 117 H 4.0900 8.0296 118.5320 59.0282 30.1505 176.6741 118 F 4.3520 8.6585 118.6220 58.3417 39.5727 177.1589 119 G 3.8364 8.9983 109.1672 45.7289 0.0000 175.6795 120 K 4.1811 8.9715 119.7102 59.5983 32.4767 178.0234 121 E 4.0858 8.0380 119.5679 58.8631 29.8918 177.1165 122 F 4.4761 8.5759 122.9374 57.0136 37.7865 175.1948 123 T 4.1957 7.4426 115.9984 60.1476 71.2481 173.4408 124 P 4.1883 0.0000 0.0000 65.5628 31.2965 177.2709 125 P 4.2045 0.0000 0.0000 65.2580 31.2765 178.8660 126 V 3.4941 7.2954 117.2904 65.7143 31.3435 177.7916 127 Q 3.5289 7.8615 119.4761 59.1035 29.0257 178.0263 128 A 3.9727 8.0907 121.5611 55.2490 18.4242 179.5249 129 A 3.9598 7.9820 118.9948 55.6379 18.5635 179.4899 130 Y 4.0514 8.0992 114.6349 60.6238 38.0468 178.3929 131 Q 4.1800 8.3225 119.7826 58.6293 28.6841 178.6687 132 K 3.9644 7.7184 118.3946 59.3025 32.0842 179.4080 133 V 3.4760 7.5495 117.9565 66.3049 31.4929 178.4842 134 V 3.7989 8.0892 111.7597 64.3705 31.3107 178.5403 135 A 4.1081 8.1093 120.5429 55.1330 18.3759 179.9574 136 G 3.4562 8.3761 104.6413 47.7461 0.0000 176.2098 137 V 3.1389 7.8661 120.3839 65.5694 31.3780 178.0261 138 A 3.8314 7.9515 120.5293 55.2855 18.1885 179.4277 139 N 4.3078 8.3988 114.9005 56.1637 38.3368 177.6163 140 A 3.9863 7.5218 121.2877 55.1380 18.5951 179.4069 141 L 3.9580 7.7170 115.8299 56.8034 41.8284 178.6473 142 A 4.2534 7.6428 120.3435 53.5933 18.7299 178.4566 143 H 3.9085 7.7478 116.6275 59.0429 29.9050 175.8559 144 K 4.5233 8.2975 116.0743 56.2181 32.0632 176.2720 145 Y 4.2047 8.3363 117.9144 58.5891 38.4430 175.7637 146 H 4.4307 8.3175 116.1199 56.3289 28.1443 173.5016 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 3.87 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 0.88 0.00 0.00 0.84 0.00 0.00 2 H 8.62 4.43 0.00 3.21 3.26 0.00 5.69 0.00 0.00 0.00 0.00 6.69 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 4.67 0.00 1.57 1.54 0.81 0.85 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 4 T 8.83 4.01 4.36 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 1.24 0.00 0.00 5 P 0.00 4.13 0.00 2.26 2.37 0.00 3.68 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 2.07 2.05 0.00 6 E 8.12 3.94 0.00 2.16 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 0.00 2.34 2.32 0.00 7 E 8.80 3.92 0.00 2.23 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 2.27 0.00 8 K 7.81 3.81 0.00 1.77 1.86 0.00 1.69 0.00 0.00 1.78 0.00 0.00 2.89 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.45 1.47 7.81 9 S 8.27 4.06 0.00 4.05 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 10 A 8.06 4.00 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 11 V 7.85 3.28 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 0.68 0.00 0.00 0.45 0.00 0.00 12 T 7.97 4.01 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 1.27 0.00 0.00 13 A 8.36 4.07 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 14 L 8.22 4.00 0.00 1.96 1.94 0.33 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.41 0.00 0.00 0.00 0.00 0.00 0.00 15 W 8.63 4.20 0.00 3.86 3.20 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 0.00 0.00 0.00 0.00 16 G 8.25 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 K 7.51 4.63 0.00 1.92 1.97 0.00 2.09 0.00 0.00 1.84 0.00 0.00 3.03 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.74 1.79 7.81 18 V 7.20 4.03 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 0.09 0.00 0.00 0.99 0.00 0.00 19 N 8.08 4.46 0.00 2.66 2.59 0.00 0.00 6.84 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 8.00 3.43 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 1.08 0.00 0.00 0.90 0.00 0.00 21 D 8.05 4.40 0.00 2.88 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 22 E 8.55 3.98 0.00 2.04 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 2.18 2.22 0.00 23 V 7.95 3.62 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 0.91 0.00 0.00 0.68 0.00 0.00 24 G 7.95 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 25 G 7.65 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 26 E 7.90 3.90 0.00 2.12 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.25 2.33 0.00 27 A 8.14 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 28 L 8.19 4.01 0.00 1.74 1.63 0.89 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 29 G 8.48 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 30 R 8.17 3.95 0.00 1.89 1.94 0.00 3.09 0.00 0.00 3.04 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.69 0.00 31 L 7.97 4.04 0.00 1.90 1.84 0.96 0.55 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 32 L 7.80 4.02 0.00 2.00 1.65 0.81 0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 33 V 7.34 3.48 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 0.72 0.00 0.00 0.93 0.00 0.00 34 V 7.70 3.45 1.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.08 0.00 0.00 0.80 0.00 0.00 35 Y 7.17 3.85 0.00 2.34 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 5.24 0.00 2.31 2.33 0.00 3.71 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 1.97 0.00 37 W 8.03 4.33 0.00 3.59 3.54 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 38 T 8.08 4.33 4.40 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 1.07 0.00 0.00 39 Q 8.37 4.45 0.00 2.28 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.81 0.00 0.00 0.00 0.00 0.00 2.41 2.55 0.00 40 R 7.74 3.80 0.00 1.75 2.07 0.00 3.02 0.00 0.00 2.65 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.68 0.50 0.00 41 F 7.48 4.46 0.00 2.11 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 7.99 4.69 0.00 2.84 2.11 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 43 E 8.52 4.31 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 2.31 2.28 0.00 44 S 8.06 4.76 0.00 3.94 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 45 F 8.78 4.40 0.00 3.20 3.13 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 46 G 8.10 4.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 D 8.70 4.55 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 8.28 4.79 0.00 1.65 1.60 1.00 1.00 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 49 S 8.26 4.37 0.00 3.99 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 50 T 7.42 4.72 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 2.14 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 2.10 2.17 0.00 52 D 8.06 4.35 0.00 2.68 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 7.94 3.99 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 54 V 8.13 3.65 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 1.05 0.00 0.00 0.95 0.00 0.00 55 M 8.16 4.07 0.00 2.03 2.11 0.00 0.00 0.00 0.00 0.00 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.83 0.00 56 G 7.88 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.94 4.14 0.00 3.08 2.98 0.00 0.00 6.81 7.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 P 0.00 4.19 0.00 2.25 2.28 0.00 3.73 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.05 0.00 59 K 8.45 3.65 0.00 1.86 0.74 0.00 1.40 0.00 0.00 1.60 0.00 0.00 3.06 0.00 0.00 2.91 0.00 0.00 0.00 0.00 0.70 1.01 7.81 60 V 8.17 3.99 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 1.04 0.00 0.00 1.11 0.00 0.00 61 K 8.00 3.93 0.00 1.93 1.83 0.00 1.74 0.00 0.00 1.68 0.00 0.00 3.08 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.45 1.57 7.81 62 A 8.04 4.13 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 63 H 8.92 4.37 0.00 3.46 3.61 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 8.08 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.83 4.04 0.00 1.88 2.04 0.00 1.65 0.00 0.00 1.66 0.00 0.00 3.29 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.47 1.67 7.81 66 K 8.16 3.99 0.00 2.12 1.90 0.00 1.92 0.00 0.00 1.69 0.00 0.00 2.96 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.52 1.65 7.81 67 V 7.77 3.65 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 1.16 0.00 0.00 0.95 0.00 0.00 68 L 8.12 4.40 0.00 2.00 1.85 1.12 0.84 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 7.97 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 70 A 8.24 4.23 1.59 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 71 F 8.53 4.14 0.00 3.52 3.42 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 72 S 8.90 4.34 0.00 4.33 4.31 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 73 D 7.83 4.51 0.00 2.64 2.55 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 74 G 7.69 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 75 L 7.34 4.07 0.00 1.50 1.46 -0.56 0.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 76 A 7.30 4.43 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 H 8.54 4.85 0.00 3.01 3.14 0.00 5.83 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 L 7.95 3.92 0.00 1.53 1.67 0.81 1.06 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 79 D 7.95 4.49 0.00 2.64 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 80 N 8.08 4.94 0.00 2.70 2.59 0.00 0.00 7.10 6.26 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 81 L 8.01 4.14 0.00 1.73 1.77 0.86 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 82 K 7.98 4.10 0.00 1.65 1.76 0.00 1.57 0.00 0.00 1.61 0.00 0.00 2.87 0.00 0.00 2.60 0.00 0.00 0.00 0.00 1.17 1.42 7.81 83 G 8.04 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 84 T 7.35 3.71 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 0.52 0.00 0.00 85 F 7.82 4.69 0.00 3.07 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 86 A 7.61 4.06 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 87 T 7.86 4.00 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 1.23 0.00 0.00 88 L 7.97 4.13 0.00 1.96 1.83 1.09 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 89 S 8.41 4.29 0.00 4.06 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 8.16 3.93 0.00 2.22 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 2.34 2.53 0.00 91 L 7.75 3.91 0.00 1.73 1.93 0.92 1.36 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 92 H 8.61 4.16 0.00 3.47 3.72 0.00 5.86 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 93 C 7.73 3.61 0.00 1.45 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 94 D 8.37 4.31 0.00 2.71 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 7.75 4.12 0.00 1.82 1.82 0.00 1.74 0.00 0.00 1.69 0.00 0.00 2.96 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.38 1.38 7.81 96 L 7.91 4.27 0.00 1.70 1.65 0.71 1.15 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 7.22 4.16 0.00 3.44 3.42 0.00 5.64 0.00 0.00 0.00 0.00 8.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 V 7.99 3.98 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 0.17 0.00 0.00 0.61 0.00 0.00 99 D 8.73 4.39 0.00 2.81 2.55 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 0.00 100 P 0.00 2.97 0.00 1.81 1.72 0.00 3.34 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.44 0.00 101 E 8.49 3.87 0.00 1.96 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 2.29 2.36 0.00 102 N 7.62 4.35 0.00 2.54 2.72 0.00 0.00 6.86 8.08 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 0.00 103 F 7.51 4.53 0.00 3.09 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 4.00 0.00 1.97 1.97 0.00 3.40 0.00 0.00 3.33 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.73 0.00 105 L 7.64 3.81 0.00 1.67 1.28 0.58 0.18 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 0.00 106 L 7.87 4.12 0.00 1.77 1.90 0.93 1.57 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 0.00 107 G 8.22 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 0.00 108 N 8.20 4.54 0.00 2.95 2.94 0.00 0.00 6.66 7.00 0.00 0.00 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 7.59 3.67 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 1.11 0.00 0.00 1.15 0.00 0.00 110 L 8.40 3.85 0.00 1.73 1.85 0.84 0.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 111 V 7.62 3.57 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 1.28 0.00 0.00 1.13 0.00 0.00 112 C 7.81 4.15 0.00 3.14 2.93 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 0.00 113 V 7.98 3.57 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 0.94 0.00 0.00 0.94 0.00 0.00 114 L 7.70 3.93 0.00 1.11 1.12 0.53 0.97 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 0.00 115 A 7.34 3.63 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 7.92 4.10 0.00 3.25 3.43 0.00 5.78 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 H 8.03 4.09 0.00 2.92 3.20 0.00 5.99 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 8.66 4.35 0.00 3.35 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 0.00 119 G 9.00 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 8.97 4.18 0.00 1.92 2.04 0.00 1.61 0.00 0.00 1.66 0.00 0.00 2.99 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.47 1.50 7.81 121 E 8.04 4.09 0.00 2.11 2.42 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 2.36 2.31 0.00 122 F 8.58 4.48 0.00 3.02 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 0.00 123 T 7.44 4.20 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 1.30 0.00 0.00 124 P 0.00 4.19 0.00 2.16 2.14 0.00 3.58 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.19 0.00 125 P 0.00 4.20 0.00 2.10 2.05 0.00 3.54 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 2.10 0.00 126 V 7.30 3.49 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 0.97 0.00 0.00 0.87 0.00 0.00 127 Q 7.86 3.53 0.00 1.91 2.12 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 2.53 0.00 128 A 8.09 3.97 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 0.00 129 A 7.98 3.96 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 130 Y 8.10 4.05 0.00 3.34 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 0.00 131 Q 8.32 4.18 0.00 2.28 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.82 0.00 0.00 0.00 0.00 0.00 2.70 2.60 0.00 132 K 7.72 3.96 0.00 2.06 1.80 0.00 1.71 0.00 0.00 1.68 0.00 0.00 2.87 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.44 1.56 7.81 133 V 7.55 3.48 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 0.96 0.00 0.00 0.72 0.00 0.00 134 V 8.09 3.80 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 1.19 0.00 0.00 135 A 8.11 4.11 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 8.38 3.46 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 0.00 137 V 7.87 3.14 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 0.49 0.00 0.00 0.34 0.00 0.00 138 A 7.95 3.83 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 8.40 4.31 0.00 2.70 2.87 0.00 0.00 6.92 7.43 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 0.00 140 A 7.52 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 0.00 141 L 7.72 3.96 0.00 0.93 0.77 -0.11 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 142 A 7.64 4.25 1.29 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 0.00 0.00 143 H 7.75 3.91 0.00 3.36 3.50 0.00 5.74 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 8.30 4.52 0.00 1.86 1.86 0.00 1.83 0.00 0.00 1.76 0.00 0.00 3.11 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.53 1.79 7.81 145 Y 8.34 4.20 0.00 3.08 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 8.32 4.43 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