NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 N 4.6407 8.4244 119.2043 53.7014 39.0392 171.9990 3 T 3.7746 7.9668 117.0982 60.5037 68.2433 172.2791 4 K 4.3587 9.0291 129.2622 55.1516 34.6550 175.1053 5 Y 4.7920 8.2682 120.6474 56.1826 40.2401 175.9725 6 N 4.6515 8.5849 119.7715 53.7127 41.1312 175.9079 7 K 4.0923 8.5690 125.1329 59.3935 32.5938 179.0191 8 E 3.9391 8.1329 118.4402 58.8109 29.4638 178.9098 9 F 4.2375 8.1667 120.6281 61.3179 39.6221 177.1628 10 L 3.7794 8.0927 118.6787 57.4406 41.1613 179.3988 11 L 3.5659 7.4837 118.2308 58.1081 41.8007 178.4770 12 Y 4.0264 7.7683 118.7803 60.4357 38.6530 177.5251 13 L 3.9062 8.0431 120.6327 58.4512 42.1615 178.9917 14 A 4.0704 8.3863 120.8567 55.4712 18.3829 179.9598 15 G 3.4577 8.1392 104.1507 47.7331 0.0000 175.7839 16 F 4.0227 7.7675 122.3811 60.6306 39.4692 177.4988 17 V 3.5736 8.5687 118.6984 66.0642 31.2102 177.8268 18 D 4.5006 8.0565 117.4415 57.4670 40.6418 177.7244 19 G 3.4282 7.7687 106.2560 44.8105 0.0000 173.1625 20 D 4.5237 7.2492 120.1125 53.1990 42.9973 177.0008 21 G 3.8573 7.4742 106.7651 46.2035 0.0000 173.2173 22 S 4.5222 8.3092 113.0769 57.2698 66.1735 173.3628 23 I 4.5906 8.3726 128.5370 59.7629 36.8620 174.7866 24 I 4.2546 8.5052 126.6776 60.7943 39.0325 174.8912 25 A 4.9854 8.3187 126.2933 51.0438 21.7618 175.4091 26 Q 4.6258 9.8350 121.3367 54.3378 33.7692 174.9740 27 I 4.8061 8.2942 120.9694 59.7199 38.8001 174.8208 28 K 4.5542 9.1204 128.1818 53.9527 33.6996 174.6476 29 P 4.7244 0.0000 0.0000 62.9881 32.1878 175.5167 30 N 4.9663 9.3295 123.5722 52.2132 42.1189 175.3465 31 Q 4.1305 9.1352 125.6831 58.7178 29.1206 177.9646 32 S 4.2499 8.0337 110.8188 59.4087 63.5177 173.5347 33 Y 4.5211 7.5058 119.4377 55.8866 39.6978 176.2552 34 K 3.5712 8.6339 124.7453 59.4652 31.8340 177.5352 35 F 4.9000 7.5995 114.8079 56.9507 39.1625 177.2222 36 K 4.4362 8.5919 118.5787 56.9259 30.5339 174.8880 37 H 5.3095 7.8391 114.3632 54.1265 33.1022 172.4405 38 Q 3.9851 9.5250 123.6070 54.3394 31.2807 174.7082 39 L 4.9124 8.5029 126.2259 53.7059 41.9067 175.2134 40 S 4.6910 8.7702 119.6292 56.9554 64.2217 172.6992 41 L 5.1727 8.5045 125.8667 53.3078 44.7473 175.7390 42 T 4.8617 8.9141 118.0244 60.3078 71.5085 172.1408 43 F 5.1269 8.9863 130.3677 56.9962 41.2360 174.5113 44 Q 4.7122 8.4986 125.4729 53.6960 32.1706 175.7058 45 V 4.0614 7.8708 120.8214 62.5276 33.9907 173.4233 46 T 5.0479 7.7212 124.3404 62.8669 70.2662 174.3822 47 Q 4.5585 8.1936 119.8562 55.1080 34.3090 173.8829 48 K 4.2144 8.2741 120.9485 56.8309 32.8803 178.3628 49 T 3.5769 8.6875 121.1013 66.8361 68.5749 176.2734 50 Q 4.3771 8.1703 117.5615 58.2850 28.9545 177.0661 51 R 4.6031 8.7469 118.8562 55.9222 30.6838 177.7754 52 R 3.9220 8.5071 122.5003 59.2105 29.8480 178.1673 53 W 4.5017 8.4393 116.2236 59.9078 27.4398 177.9637 54 F 3.3201 6.5899 120.1250 60.5166 38.8683 176.9257 55 L 4.0999 7.6146 118.1126 58.0469 41.3391 178.8610 56 D 4.4194 8.3576 119.0461 57.5131 40.7839 179.0153 57 K 3.9378 8.1117 119.7303 59.1863 32.0786 178.9182 58 L 3.7821 7.7374 119.8375 57.5240 41.3106 179.3151 59 V 3.9032 7.4519 118.0494 65.9262 31.1340 177.7332 60 D 4.2694 7.8514 116.5048 57.4106 41.4069 177.6474 61 E 3.9085 7.9083 117.6252 59.4088 29.5209 179.1089 62 I 4.0425 8.0818 118.9998 62.3133 37.2496 176.6773 63 G 4.3948 8.0789 114.2607 45.2601 0.0000 174.0886 64 V 4.2008 7.4608 117.3595 59.1217 33.8339 174.3966 65 G 3.8183 10.1423 105.9018 45.1720 0.0000 171.0536 66 Y 4.9305 7.6449 115.4242 56.1901 41.9037 173.6252 67 V 4.8943 8.6106 119.1769 61.0756 34.0762 174.6700 68 R 4.8544 8.9949 124.4954 54.6851 32.4208 174.2652 69 D 5.2693 8.6615 120.1192 51.9404 43.0730 176.7135 70 R 4.6919 8.1817 121.9947 54.7558 30.0509 175.1771 71 G 4.0481 7.6202 116.7804 46.6659 0.0000 176.5224 72 S 3.8776 8.8216 120.5801 59.8938 63.2144 173.5085 73 V 4.9840 7.3173 120.1605 61.1588 35.3111 174.3754 74 S 5.2051 9.0635 119.4113 56.9547 67.2716 172.9501 75 D 5.4473 8.8140 122.0976 52.6825 44.7909 174.3121 76 Y 4.8641 8.6257 122.1548 56.1582 40.9170 174.3505 77 I 4.2077 7.6074 128.0909 59.3389 40.2873 175.0302 78 L 4.7058 8.2513 127.3666 53.9222 43.7489 176.2992 79 S 4.7687 8.6880 121.4893 58.5926 64.9479 174.9831 80 E 4.0088 8.2209 120.2295 56.5050 29.8302 177.1426 81 I 3.7437 8.5459 125.6801 64.4496 37.3355 178.0370 82 K 3.9297 8.0883 119.4527 59.3218 32.0026 176.8974 83 P 4.3663 0.0000 0.0000 65.3732 31.3087 178.3451 84 L 4.0386 8.4254 119.7331 58.5571 42.1121 178.5719 85 H 4.1845 8.7449 118.5645 59.1954 29.2450 176.8031 86 N 4.4036 8.1679 118.6882 56.4647 38.7390 176.6323 87 F 4.4772 8.5896 122.3756 61.5517 39.5579 177.2446 88 L 3.6461 8.1928 118.4420 57.6178 41.0834 179.8927 89 T 3.7482 7.3724 114.8924 66.7468 68.4945 176.4112 90 Q 4.1184 7.5128 117.2744 58.0653 28.9998 177.9188 91 L 4.0493 7.7739 121.7032 57.8655 41.7829 178.4383 92 Q 3.7332 7.9200 120.2628 58.7561 28.8166 177.4798 93 P 4.1134 0.0000 0.0000 64.6371 31.3668 176.6039 94 F 4.8753 7.6055 115.8423 57.2582 39.8629 175.9692 95 L 4.4045 7.3448 120.6239 54.3147 42.2376 176.7166 96 K 4.4664 9.1822 119.8263 56.9612 34.6590 177.5255 97 L 4.3847 8.4329 116.6085 55.8252 43.0383 177.3667 98 K 4.9269 8.4210 115.6192 55.6057 32.4913 177.9379 99 Q 4.0710 7.8727 121.6155 58.2028 28.8956 178.2259 100 K 4.0189 7.8578 119.6413 59.6321 32.3598 178.9233 101 Q 3.9880 8.0088 117.2242 59.1265 28.5107 178.0723 102 A 3.9890 7.8906 122.4513 55.2326 18.5512 179.3499 103 N 4.3908 7.7602 113.3524 55.6448 38.5136 177.8543 104 L 3.8625 7.6512 120.9482 57.5708 41.8160 179.3356 105 V 3.6301 8.4020 118.5204 66.0444 31.5766 178.0235 106 L 4.0501 7.9451 118.7473 57.6033 41.2026 179.4171 107 K 3.9088 7.6096 118.4408 59.5074 32.5136 178.6151 108 I 4.1351 8.0410 120.1423 64.6142 37.0007 178.2903 109 I 3.7725 7.9269 120.6041 64.6108 36.7372 178.0037 110 E 4.0061 8.0281 118.4839 58.8387 29.2874 177.9283 111 Q 4.5379 7.8525 115.1596 55.7017 29.2971 177.3775 112 L 3.9745 7.6630 122.2796 57.3387 41.6056 177.5624 113 P 4.3005 0.0000 0.0000 65.8321 31.3677 177.6957 114 S 4.5599 7.6925 110.1087 58.3524 62.9207 174.1505 115 A 4.7159 7.7319 122.5657 52.3199 19.9084 177.6499 116 K 4.3219 7.8825 116.1632 57.5725 32.4514 177.3967 117 E 4.2908 8.0244 117.3425 58.6266 30.5013 176.3061 118 S 4.6943 7.7507 112.4201 56.9460 64.7240 173.3740 119 P 3.2957 0.0000 0.0000 65.0186 31.0224 178.6776 120 D 4.2799 7.9215 117.8638 56.6958 40.6338 178.6478 121 K 3.8684 7.7821 119.8995 59.2520 32.3121 178.2323 122 F 4.0270 8.0496 121.0371 61.5103 38.9622 176.9301 123 L 3.7338 7.3312 118.5091 57.9834 42.1328 178.2547 124 E 3.6312 7.5247 119.5329 58.9248 29.3913 178.9159 125 V 2.3364 7.5257 118.5248 65.2562 31.3339 177.3416 126 C 4.0106 7.4551 115.0862 61.5606 28.1090 175.0870 127 T 4.1555 7.1623 117.8276 65.2266 68.4234 176.7269 128 W 4.7285 7.3441 121.1711 60.3914 29.1756 178.9792 129 V 3.6795 7.9621 111.3323 64.5232 31.0704 178.2361 130 D 4.4110 8.0965 118.8138 57.2657 40.5615 178.8309 131 Q 4.1326 8.3669 118.9828 58.9079 28.7987 178.5065 132 I 3.6935 7.8237 120.1555 64.4058 36.9741 178.0795 133 A 4.0040 7.8333 120.1931 55.0737 18.2268 179.3093 134 A 4.0743 7.4211 117.0754 55.3906 18.6028 179.6107 135 L 4.0610 7.7410 116.2086 58.1618 41.9530 178.0848 136 N 4.7826 7.9665 115.2771 52.0547 43.0689 174.7681 137 D 4.8754 8.1046 118.5599 53.3863 40.1167 176.5402 138 S 4.4420 7.5583 114.6659 58.4585 64.4102 174.8057 139 K 4.6789 8.3486 117.5066 57.0649 38.1200 176.9070 140 T 4.5731 7.7284 107.6107 61.0200 69.0967 173.9398 141 R 4.1201 7.9170 121.5055 56.9561 30.2755 174.3321 142 K 4.3382 7.9046 120.3933 58.2038 35.1410 176.8517 143 T 3.9351 7.6994 124.9757 64.0312 67.9810 174.5714 144 T 4.4792 7.9427 121.4696 60.0180 70.8654 174.5478 145 S 4.1196 8.2601 117.1084 60.8108 63.0735 175.9302 146 E 4.0034 7.8836 123.4795 59.6212 29.2348 178.6350 147 T 3.8825 7.7568 111.2799 64.8972 67.3479 175.7116 148 V 3.6411 7.6286 119.4592 64.4668 32.0068 175.9250 149 R 4.6707 7.7593 118.4972 56.3687 28.8125 176.3039 150 A 4.6259 7.4150 118.0459 51.9562 20.0818 178.5649 151 V 3.6675 7.1904 117.8215 65.7634 31.6588 176.2534 152 L 4.1755 7.7793 118.6870 55.0311 40.0539 176.5765 153 D 4.5151 8.2863 122.2436 54.2503 41.5534 176.1948 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 N 8.42 4.64 0.00 2.71 2.83 0.00 0.00 6.97 6.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3 T 7.97 3.77 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 1.16 0.00 0.00 4 K 9.03 4.36 0.00 1.71 1.69 0.00 1.76 0.00 0.00 1.70 0.00 0.00 3.05 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.37 1.40 7.81 5 Y 8.27 4.79 0.00 3.24 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 6 N 8.58 4.65 0.00 2.93 2.88 0.00 0.00 6.61 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 7 K 8.57 4.09 0.00 1.90 1.78 0.00 1.72 0.00 0.00 1.62 0.00 0.00 3.00 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.35 1.60 7.81 8 E 8.13 3.94 0.00 2.10 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 2.39 2.38 0.00 9 F 8.17 4.24 0.00 3.16 3.34 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 10 L 8.09 3.78 0.00 1.78 1.92 1.32 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 11 L 7.48 3.57 0.00 1.61 1.57 0.70 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.60 0.00 0.00 0.00 0.00 0.00 0.00 12 Y 7.77 4.03 0.00 3.01 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 13 L 8.04 3.91 0.00 1.48 1.58 1.08 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 14 A 8.39 4.07 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 0.00 0.00 0.00 0.00 0.00 0.00 15 G 8.14 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 16 F 7.77 4.02 0.00 2.76 3.16 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 17 V 8.57 3.57 2.36 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 1.13 0.00 0.00 1.35 0.00 0.00 18 D 8.06 4.50 0.00 2.77 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 19 G 7.77 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 0.00 0.00 0.00 20 D 7.25 4.52 0.00 1.76 2.50 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 21 G 7.47 3.86 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 S 8.31 4.52 0.00 3.82 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 23 I 8.37 4.59 1.92 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 1.63 0.90 1.00 0.00 0.00 24 I 8.51 4.25 1.88 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 1.15 0.60 0.91 0.00 0.00 25 A 8.32 4.99 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 26 Q 9.84 4.63 0.00 1.93 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.57 6.68 0.00 0.00 0.00 0.00 0.00 2.26 2.31 0.00 27 I 8.29 4.81 1.81 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.55 0.85 0.00 0.00 28 K 9.12 4.55 0.00 1.61 1.73 0.00 1.68 0.00 0.00 1.71 0.00 0.00 2.92 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.39 1.35 7.81 29 P 0.00 4.72 0.00 2.08 2.16 0.00 3.77 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 2.01 2.01 0.00 30 N 9.33 4.97 0.00 2.69 3.02 0.00 0.00 6.78 6.62 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 31 Q 9.14 4.13 0.00 2.15 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.79 6.76 0.00 0.00 0.00 0.00 0.00 2.46 2.30 0.00 32 S 8.03 4.25 0.00 3.84 4.03 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 0.00 0.00 0.00 33 Y 7.51 4.52 0.00 3.29 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 34 K 8.63 3.57 0.00 1.34 1.37 0.00 1.32 0.00 0.00 1.37 0.00 0.00 2.83 0.00 0.00 2.36 0.00 0.00 0.00 0.00 0.30 0.59 7.81 35 F 7.60 4.90 0.00 2.21 2.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 K 8.59 4.44 0.00 1.96 1.77 0.00 1.64 0.00 0.00 1.78 0.00 0.00 2.91 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.35 1.37 7.81 37 H 7.84 5.31 0.00 3.26 3.23 0.00 5.82 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 38 Q 9.53 3.99 0.00 0.93 1.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.84 0.00 0.00 0.00 0.00 0.00 2.15 2.16 0.00 39 L 8.50 4.91 0.00 1.64 1.64 0.85 0.63 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 40 S 8.77 4.69 0.00 3.92 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 L 8.50 5.17 0.00 1.56 1.60 0.96 0.86 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 42 T 8.91 4.86 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 1.24 0.00 0.00 43 F 8.99 5.13 0.00 3.31 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 44 Q 8.50 4.71 0.00 1.86 1.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.48 0.00 0.00 0.00 0.00 0.00 2.17 2.01 0.00 45 V 7.87 4.06 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 1.22 0.00 0.00 0.81 0.00 0.00 46 T 7.72 5.05 4.18 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 1.23 0.00 0.00 47 Q 8.19 4.56 0.00 1.95 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.99 0.00 0.00 0.00 0.00 0.00 2.24 2.40 0.00 48 K 8.27 4.21 0.00 1.77 1.75 0.00 1.71 0.00 0.00 1.82 0.00 0.00 3.01 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.52 1.40 7.81 49 T 8.69 3.58 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 1.30 0.00 0.00 50 Q 8.17 4.38 0.00 2.22 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 7.39 0.00 0.00 0.00 0.00 0.00 2.37 2.46 0.00 51 R 8.75 4.60 0.00 1.87 1.74 0.00 3.02 0.00 0.00 2.99 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.59 0.00 52 R 8.51 3.92 0.00 1.88 2.13 0.00 3.18 0.00 0.00 3.29 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.74 0.00 53 W 8.44 4.50 0.00 3.65 3.39 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 54 F 6.59 3.32 0.00 1.51 2.59 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 55 L 7.61 4.10 0.00 2.06 1.77 1.05 1.18 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 56 D 8.36 4.42 0.00 2.92 2.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 K 8.11 3.94 0.00 1.98 1.57 0.00 1.56 0.00 0.00 1.63 0.00 0.00 2.98 0.00 0.00 3.20 0.00 0.00 0.00 0.00 1.46 1.78 7.81 58 L 7.74 3.78 0.00 1.56 0.80 0.65 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 0.00 0.00 0.00 0.00 59 V 7.45 3.90 2.33 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 1.18 0.00 0.00 1.23 0.00 0.00 60 D 7.85 4.27 0.00 2.69 2.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 61 E 7.91 3.91 0.00 1.85 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 2.20 2.55 0.00 62 I 8.08 4.04 1.91 0.00 0.00 0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.52 0.60 0.00 0.00 63 G 8.08 4.39 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 0.00 64 V 7.46 4.20 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 0.84 0.00 0.00 1.01 0.00 0.00 65 G 10.14 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 66 Y 7.64 4.93 0.00 3.08 3.03 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 0.00 0.00 0.00 67 V 8.61 4.89 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 0.99 0.00 0.00 1.09 0.00 0.00 68 R 8.99 4.85 0.00 2.06 2.20 0.00 2.86 0.00 0.00 3.14 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.60 0.00 69 D 8.66 5.27 0.00 2.71 2.61 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.18 4.69 0.00 1.92 1.89 0.00 3.17 0.00 0.00 3.23 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.63 0.00 71 G 7.62 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 72 S 8.82 3.88 0.00 4.02 4.15 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 73 V 7.32 4.98 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 1.03 0.00 0.00 0.92 0.00 0.00 74 S 9.06 5.21 0.00 3.77 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 75 D 8.81 5.45 0.00 2.60 2.45 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 76 Y 8.63 4.86 0.00 3.06 2.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 I 7.61 4.21 0.79 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 0.94 0.49 0.70 0.00 0.00 78 L 8.25 4.71 0.00 1.52 1.64 0.80 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 79 S 8.69 4.77 0.00 3.96 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 80 E 8.22 4.01 0.00 2.07 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 2.46 2.48 0.00 81 I 8.55 3.74 1.93 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.78 0.97 0.00 0.00 82 K 8.09 3.93 0.00 1.90 1.86 0.00 1.62 0.00 0.00 1.83 0.00 0.00 3.05 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.54 1.64 7.81 83 P 0.00 4.37 0.00 2.27 2.16 0.00 3.94 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 2.17 2.19 0.00 84 L 8.43 4.04 0.00 1.84 2.01 1.05 0.91 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 85 H 8.74 4.18 0.00 3.27 3.60 0.00 5.64 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 86 N 8.17 4.40 0.00 3.00 3.07 0.00 0.00 6.79 8.34 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 87 F 8.59 4.48 0.00 3.06 3.14 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 0.00 0.00 0.00 0.00 88 L 8.19 3.65 0.00 1.67 1.61 0.98 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 89 T 7.37 3.75 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 1.17 0.00 0.00 90 Q 7.51 4.12 0.00 2.19 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.13 6.94 0.00 0.00 0.00 0.00 0.00 2.46 2.73 0.00 91 L 7.77 4.05 0.00 0.92 1.06 0.74 0.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 92 Q 7.92 3.73 0.00 2.09 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 6.58 0.00 0.00 0.00 0.00 0.00 2.22 2.56 0.00 93 P 0.00 4.11 0.00 1.55 1.84 0.00 3.46 0.00 0.00 3.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 1.67 0.00 94 F 7.61 4.88 0.00 3.01 3.01 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 95 L 7.34 4.40 0.00 1.61 1.57 0.87 0.85 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 96 K 9.18 4.47 0.00 1.79 1.78 0.00 1.59 0.00 0.00 1.71 0.00 0.00 3.07 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.35 1.41 7.81 97 L 8.43 4.38 0.00 1.80 1.67 0.87 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 98 K 8.42 4.93 0.00 1.80 1.80 0.00 1.68 0.00 0.00 1.65 0.00 0.00 3.01 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.35 1.38 7.81 99 Q 7.87 4.07 0.00 2.12 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.18 6.93 0.00 0.00 0.00 0.00 0.00 2.36 2.58 0.00 100 K 7.86 4.02 0.00 1.78 1.79 0.00 1.69 0.00 0.00 1.83 0.00 0.00 2.95 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.49 1.40 7.81 101 Q 8.01 3.99 0.00 2.26 2.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.89 0.00 0.00 0.00 0.00 0.00 2.58 2.38 0.00 102 A 7.89 3.99 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 0.00 103 N 7.76 4.39 0.00 3.07 2.79 0.00 0.00 7.09 6.62 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 0.00 104 L 7.65 3.86 0.00 1.84 1.70 0.98 0.48 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 0.00 105 V 8.40 3.63 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 1.10 0.00 0.00 1.03 0.00 0.00 106 L 7.95 4.05 0.00 2.02 1.69 0.94 0.57 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 0.00 107 K 7.61 3.91 0.00 1.74 1.84 0.00 1.45 0.00 0.00 1.18 0.00 0.00 2.13 0.00 0.00 2.20 0.00 0.00 0.00 0.00 1.04 1.33 7.81 108 I 8.04 4.14 2.14 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 1.20 0.99 0.00 0.00 109 I 7.93 3.77 2.12 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 1.48 1.62 0.96 0.00 0.00 110 E 8.03 4.01 0.00 2.28 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 0.00 2.35 2.43 0.00 111 Q 7.85 4.54 0.00 2.32 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.56 0.00 0.00 0.00 0.00 0.00 2.46 2.79 0.00 112 L 7.66 3.97 0.00 1.96 1.80 1.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 113 P 0.00 4.30 0.00 2.25 2.35 0.00 3.76 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 1.99 0.00 114 S 7.69 4.56 0.00 3.90 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 0.00 115 A 7.73 4.72 1.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 116 K 7.88 4.32 0.00 1.91 1.86 0.00 1.88 0.00 0.00 1.80 0.00 0.00 3.04 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.42 1.47 7.81 117 E 8.02 4.29 0.00 2.05 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 2.30 2.37 0.00 118 S 7.75 4.69 0.00 3.93 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 0.00 119 P 0.00 3.30 0.00 2.02 1.68 0.00 3.64 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.30 0.00 120 D 7.92 4.28 0.00 2.77 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 0.00 121 K 7.78 3.87 0.00 1.82 1.84 0.00 1.73 0.00 0.00 1.69 0.00 0.00 2.94 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.51 1.59 7.81 122 F 8.05 4.03 0.00 3.27 2.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 123 L 7.33 3.73 0.00 1.72 1.54 0.84 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 124 E 7.52 3.63 0.00 1.74 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 1.88 1.47 0.00 125 V 7.53 2.34 1.87 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 0.85 0.00 0.00 0.80 0.00 0.00 126 C 7.46 4.01 0.00 2.74 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 0.00 127 T 7.16 4.16 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 1.30 0.00 0.00 128 W 7.34 4.73 0.00 3.30 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 0.00 129 V 7.96 3.68 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 0.80 0.00 0.00 0.95 0.00 0.00 130 D 8.10 4.41 0.00 2.91 2.73 0.00 0.00 0.00 0.00 0.00 0.00 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 8.37 4.13 0.00 2.37 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.80 0.00 0.00 0.00 0.00 0.00 2.44 2.72 0.00 132 I 7.82 3.69 2.02 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.18 0.93 0.00 0.00 133 A 7.83 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 0.00 134 A 7.42 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 0.00 135 L 7.74 4.06 0.00 1.83 1.74 0.90 1.07 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 0.00 136 N 7.97 4.78 0.00 2.87 2.78 0.00 0.00 6.88 7.34 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 0.00 137 D 8.10 4.88 0.00 2.61 2.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 138 S 7.56 4.44 0.00 3.97 3.85 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 0.00 139 K 8.35 4.68 0.00 1.70 1.81 0.00 1.68 0.00 0.00 1.74 0.00 0.00 3.00 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.46 1.41 7.81 140 T 7.73 4.57 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 0.00 141 R 7.92 4.12 0.00 1.79 1.85 0.00 3.16 0.00 0.00 3.22 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.64 0.00 142 K 7.90 4.34 0.00 1.73 1.70 0.00 1.80 0.00 0.00 1.71 0.00 0.00 2.98 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.32 1.41 7.81 143 T 7.70 3.94 4.37 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 1.22 0.00 0.00 144 T 7.94 4.48 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 1.24 0.00 0.00 145 S 8.26 4.12 0.00 3.89 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 0.00 146 E 7.88 4.00 0.00 2.03 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 2.29 2.34 0.00 147 T 7.76 3.88 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 1.28 0.00 0.00 148 V 7.63 3.64 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 1.10 0.00 0.00 0.85 0.00 0.00 149 R 7.76 4.67 0.00 2.08 1.89 0.00 3.14 0.00 0.00 3.19 7.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.59 0.00 150 A 7.42 4.63 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 0.00 151 V 7.19 3.67 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 0.72 0.00 0.00 0.96 0.00 0.00 152 L 7.78 4.18 0.00 1.67 1.64 0.95 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 153 D 8.29 4.52 0.00 2.62 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