NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 N 4.7061 8.4093 119.2056 53.5104 40.1878 174.5721 3 T 3.6677 7.6711 108.1314 61.1546 69.7529 172.2338 4 K 4.4204 8.9174 124.3854 55.0918 34.5397 176.8609 5 Y 4.7285 8.7971 122.2640 56.4268 39.7040 175.7582 6 N 4.5853 8.6954 121.4036 53.3120 40.8822 176.0105 7 K 3.9787 8.7883 127.8666 59.7950 32.4120 178.8922 8 E 3.9201 8.1731 118.3965 59.2308 29.4032 178.9284 9 F 4.2474 8.2280 120.2273 61.3517 39.5285 177.0546 10 L 3.7321 8.0499 118.6391 57.5269 41.5190 179.4254 11 L 3.6136 7.8638 119.2529 57.8215 41.4792 178.9929 12 Y 3.9331 7.8055 119.1147 60.7001 38.7290 177.7284 13 L 3.9710 8.0919 121.1112 57.9616 42.0457 178.6984 14 A 4.1106 8.4041 121.3219 55.0915 18.2984 179.7148 15 G 3.4922 7.7933 103.6765 48.0337 0.0000 175.6047 16 F 3.7599 8.1773 123.8102 60.6943 39.3180 177.3803 17 V 3.6604 8.6989 118.7164 66.1893 31.1948 177.7886 18 D 4.4597 8.4225 117.9523 57.6326 40.6095 177.7306 19 G 3.5493 7.5850 106.1231 44.9810 0.0000 174.0152 20 D 4.6995 8.0312 118.2104 52.3588 41.5430 176.5975 21 G 4.2736 7.4062 108.0169 45.2940 0.0000 173.3725 22 S 4.6895 8.8044 113.7155 56.8264 66.2945 172.8227 23 I 4.8767 8.5016 127.3928 59.9508 38.8602 174.7056 24 I 4.6715 8.9546 128.5393 59.2692 40.1949 174.8889 25 A 5.1612 8.5366 126.3935 50.4126 21.6245 175.2917 26 Q 4.6153 9.6526 120.8414 54.1328 33.7300 174.8344 27 I 4.7895 8.3955 121.8148 59.8231 39.2283 175.3613 28 K 4.5239 9.0115 129.0777 53.6860 33.3380 174.6847 29 P 4.4547 0.0000 0.0000 63.4558 32.0169 175.7491 30 N 4.5156 9.0521 120.8707 53.0547 41.6091 175.0868 31 Q 4.1145 9.1579 126.9969 58.8182 28.9787 178.0348 32 S 4.3257 8.3998 110.8020 59.5102 63.6082 173.6583 33 Y 4.3961 8.0112 120.1904 56.1932 39.2862 176.1331 34 K 3.4965 8.5755 125.2921 59.5046 32.2592 177.6414 35 F 4.7053 7.6406 114.9806 56.8476 39.2029 176.5379 36 K 4.1643 8.7812 118.0713 57.3757 30.2002 174.4130 37 H 5.2583 7.8265 112.7931 54.4342 33.1870 172.5125 38 Q 4.2907 8.7759 123.2256 54.3104 31.2537 174.2960 39 L 4.8999 8.6727 126.1012 53.9038 42.7703 175.7145 40 S 4.8991 9.3626 119.8099 56.3580 64.9603 172.7158 41 L 5.3673 8.5449 125.4886 53.4532 45.0706 176.0733 42 T 4.8694 9.1681 118.9049 62.1665 73.5576 172.3438 43 F 5.4209 9.2250 128.9355 56.5844 41.5119 174.3869 44 Q 5.3890 8.2989 122.8758 53.8275 32.8421 173.8976 45 V 4.5793 8.1076 119.0082 61.6874 34.6372 174.1311 46 T 5.0382 8.1366 124.5532 62.5969 70.3474 174.0414 47 Q 4.5625 8.9007 123.5442 54.5828 33.2881 173.1733 48 K 4.1878 8.7073 125.9809 57.3603 32.8662 177.5519 49 T 3.9249 9.0531 124.3564 66.7872 68.5775 176.3515 50 Q 4.3127 8.2000 117.5750 58.1566 28.8393 176.8132 51 R 4.7350 8.2080 119.4871 55.9979 30.4953 177.5414 52 R 4.0356 8.5350 117.3265 58.3738 29.0647 178.1981 53 W 4.5075 8.5328 117.5043 59.9641 27.5594 177.8630 54 F 3.3347 6.9302 120.9083 60.6903 38.7705 177.1794 55 L 4.0158 7.6908 118.2118 57.7423 41.4829 178.8930 56 D 4.4570 8.6892 119.3579 57.2714 40.7218 178.7471 57 K 3.9457 8.2587 120.2570 59.4170 32.1541 178.9124 58 L 3.9837 7.3304 119.5005 57.3143 41.3460 179.5699 59 V 3.7543 7.4803 117.9787 66.1224 31.2914 177.6787 60 D 4.3049 7.6308 116.1695 57.4431 41.1798 177.7397 61 E 3.9017 8.2702 118.4677 59.1951 29.5081 178.9013 62 I 4.0739 8.0574 119.0138 61.7009 37.3862 177.3660 63 G 4.0144 9.3835 106.9753 45.3689 0.0000 173.0416 64 V 4.3141 7.5795 116.8800 61.1919 33.9110 173.5601 65 G 3.7894 10.4094 107.4189 45.1336 0.0000 171.3315 66 Y 4.8799 7.3557 114.9662 56.1317 41.8127 173.5832 67 V 4.9062 8.5516 119.9985 61.1448 33.4441 174.7240 68 R 4.8477 9.1655 124.5348 54.5027 32.1925 174.1380 69 D 5.1499 8.7140 121.6540 52.1964 42.6572 176.7069 70 R 4.7300 8.2899 122.5926 55.2384 30.3898 175.1404 71 G 4.0803 7.9107 113.0230 46.1566 0.0000 177.0637 72 S 4.0483 8.8000 120.6811 59.5230 63.3986 173.4088 73 V 4.9417 7.3844 120.8972 61.2896 34.9660 174.2568 74 S 5.2891 9.1670 120.6980 56.9994 67.7271 172.6460 75 D 5.2483 8.9513 120.0939 52.9371 45.4266 174.0122 76 Y 4.7808 9.1455 124.5020 56.6144 40.4824 174.1639 77 I 4.5710 7.7769 127.1429 59.1587 41.1022 174.6201 78 L 4.5380 8.5839 127.2522 54.0472 44.3220 176.4399 79 S 4.6689 8.8217 121.6662 58.4842 65.6773 174.4164 80 E 3.9668 8.3747 119.7498 56.7774 29.9782 177.2583 81 I 3.7695 8.6513 125.8503 64.5459 37.2455 178.1133 82 K 3.9903 8.0355 119.3303 59.3036 32.1911 177.0515 83 P 4.3957 0.0000 0.0000 65.3312 31.1648 178.4309 84 L 4.1035 8.2360 119.5457 58.3031 42.0335 178.5317 85 H 4.0909 8.3872 118.2403 59.2631 29.5182 176.6695 86 N 4.3987 8.4416 118.9253 56.6937 38.7142 176.6124 87 F 4.4271 8.7187 122.1892 61.5633 39.6279 177.2459 88 L 3.4966 8.2395 118.9020 57.7578 41.0689 179.6416 89 T 3.7582 7.5737 115.1325 66.7632 68.4601 176.2165 90 Q 4.1372 7.4316 117.3192 58.2903 29.1463 178.0044 91 L 3.9589 7.8343 121.7051 58.1307 42.1370 178.7201 92 Q 3.7228 8.1131 120.4414 58.6786 28.8650 177.6278 93 P 4.0936 0.0000 0.0000 64.8234 31.2645 176.5868 94 F 4.8354 7.3922 115.4169 57.3160 39.7006 176.0396 95 L 4.3359 7.5212 121.0854 54.4262 42.0405 176.8845 96 K 4.5213 9.4252 120.4940 56.2426 34.5494 177.2405 97 L 4.5461 8.3805 116.6033 54.9431 43.5953 177.1313 98 K 5.0532 7.9445 116.2592 55.2215 33.0176 178.2213 99 Q 3.8559 8.1956 121.9614 59.2001 29.0265 177.4889 100 K 3.8309 8.0481 119.3224 59.7360 32.0539 179.1217 101 Q 3.9796 8.0463 116.8953 59.0159 28.5076 178.1694 102 A 3.9732 7.8700 122.6961 55.1760 18.4655 179.3423 103 N 4.1957 8.4450 115.3704 56.3868 38.4593 177.7197 104 L 3.8268 7.9324 120.5112 57.4981 41.6007 179.6341 105 V 3.6116 8.0295 118.4406 66.0444 31.5206 177.9226 106 L 3.9730 8.0418 118.8290 57.8204 41.2401 179.5127 107 K 3.9429 7.8752 118.1974 59.4547 32.4078 178.6226 108 I 4.0985 8.1912 120.4044 64.5716 37.1298 178.2197 109 I 3.7897 8.1347 120.9597 64.8130 36.8133 178.3876 110 E 4.1461 8.1934 117.3815 58.5218 29.5754 178.2993 111 Q 4.5493 7.9667 116.5744 55.7082 29.2507 177.1496 112 L 4.0416 7.6941 121.5189 57.5656 41.5324 177.3504 113 P 4.3347 0.0000 0.0000 66.1614 29.8244 178.0543 114 S 4.2260 8.0926 111.8814 61.3359 62.5677 175.9386 115 A 4.2933 8.6725 123.5292 54.4334 17.7746 178.0951 116 K 4.5943 8.0396 117.3432 57.0741 32.9789 177.2453 117 E 4.7892 8.5707 115.9523 54.4136 33.7752 176.1340 118 S 4.7928 7.7276 111.1700 55.3597 65.0128 172.9161 119 P 3.8113 0.0000 0.0000 65.0264 31.0550 177.9389 120 D 4.4645 7.8441 116.8751 55.8953 41.3744 178.5248 121 K 3.8426 7.6216 120.5362 59.2235 32.2314 178.6983 122 F 3.9312 8.5060 121.4187 61.1265 39.0078 176.9262 123 L 3.7815 7.1628 118.0137 57.7420 42.0887 178.2875 124 E 3.5674 7.9056 119.5373 58.9841 29.4538 178.8723 125 V 2.5069 7.1173 118.1262 65.9315 31.5869 177.7424 126 C 3.8256 7.4275 116.1249 62.9289 27.6710 176.2682 127 T 3.9044 7.4585 117.4202 65.9943 67.8810 176.8845 128 W 4.5994 8.1015 121.6386 59.8274 29.1200 178.4942 129 V 3.6426 7.9306 117.7515 66.1487 30.7882 177.3401 130 D 4.3969 7.9969 118.2169 57.7424 40.7722 178.8763 131 Q 4.0175 7.9169 118.1313 59.1089 28.7554 179.2049 132 I 3.6759 7.8672 120.3359 64.4161 36.9797 178.2223 133 A 3.9931 7.8755 119.8055 55.2754 18.2580 179.1705 134 A 4.0798 8.0583 118.3114 55.3639 18.4910 179.6050 135 L 4.1073 7.7688 116.6597 56.8766 41.9028 177.5087 136 N 4.6775 7.6446 115.5992 52.7230 39.9821 175.5493 137 D 4.6227 8.0789 120.1521 53.1041 39.3945 176.7383 138 S 4.2521 7.6892 114.1210 58.3197 63.3773 173.6514 139 K 4.6316 8.6456 124.8139 56.1064 34.3016 176.5324 140 T 4.6474 7.6882 108.1777 61.0188 69.2398 173.8250 141 R 4.1908 8.0818 121.4878 57.1266 30.7174 174.1636 142 K 4.3917 8.2053 120.8072 58.2526 34.8269 176.4950 143 T 4.0911 7.7866 116.6660 63.5112 68.8556 174.6598 144 T 4.7118 8.5130 117.0877 59.0535 73.3209 174.9223 145 S 4.0408 8.6648 115.7925 61.4314 62.4560 176.1350 146 E 3.9065 8.0879 121.9134 59.4626 29.4832 178.5609 147 T 4.0315 7.4398 108.0913 64.7184 69.1226 176.5336 148 V 3.6913 7.8062 120.8566 65.1079 31.1794 177.8471 149 R 4.3218 7.5070 116.1710 56.5372 29.5808 176.4219 150 A 4.4969 8.4997 119.4277 51.6068 19.5091 180.2887 151 V 3.6744 7.6462 116.0640 65.0271 31.8147 175.7319 152 L 4.1213 7.1121 116.6449 58.0913 39.5579 176.6507 153 D 4.4175 8.7211 122.8095 53.2201 38.6878 176.7331 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 8.41 4.71 0.00 2.69 2.85 0.00 0.00 7.03 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 7.67 3.67 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 1.15 0.00 0.00 4 K 8.92 4.42 0.00 1.68 1.74 0.00 1.69 0.00 0.00 1.68 0.00 0.00 2.92 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.33 1.35 7.81 5 Y 8.80 4.73 0.00 3.19 3.22 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 6 N 8.70 4.59 0.00 2.89 2.81 0.00 0.00 6.73 6.15 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 7 K 8.79 3.98 0.00 1.93 1.80 0.00 1.85 0.00 0.00 1.81 0.00 0.00 2.89 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.25 1.53 7.81 8 E 8.17 3.92 0.00 2.10 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 2.40 2.39 0.00 9 F 8.23 4.25 0.00 3.10 3.36 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 10 L 8.05 3.73 0.00 1.91 1.88 1.23 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 11 L 7.86 3.61 0.00 1.69 1.55 0.67 0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.00 0.00 0.00 0.00 0.00 0.00 12 Y 7.81 3.93 0.00 3.06 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 13 L 8.09 3.97 0.00 1.42 1.36 1.05 0.84 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 14 A 8.40 4.11 1.48 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 0.00 0.00 15 G 7.79 3.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.18 3.76 0.00 2.79 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 17 V 8.70 3.66 2.41 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 1.18 0.00 0.00 1.44 0.00 0.00 18 D 8.42 4.46 0.00 2.83 2.67 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 19 G 7.59 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 20 D 8.03 4.70 0.00 2.09 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 21 G 7.41 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 0.00 0.00 0.00 22 S 8.80 4.69 0.00 3.76 3.56 0.00 0.00 0.00 0.00 0.00 0.00 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 8.50 4.88 1.93 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.94 1.00 0.00 0.00 24 I 8.95 4.67 1.88 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.80 0.92 0.00 0.00 25 A 8.54 5.16 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 9.65 4.62 0.00 1.92 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 6.68 0.00 0.00 0.00 0.00 0.00 2.26 2.31 0.00 27 I 8.40 4.79 1.86 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 1.24 0.56 0.92 0.00 0.00 28 K 9.01 4.52 0.00 1.57 1.71 0.00 1.67 0.00 0.00 1.69 0.00 0.00 2.91 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.37 1.35 7.81 29 P 0.00 4.45 0.00 2.00 1.99 0.00 3.81 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 1.98 1.99 0.00 30 N 9.05 4.52 0.00 2.56 2.39 0.00 0.00 6.90 6.63 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 31 Q 9.16 4.11 0.00 2.10 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.82 0.00 0.00 0.00 0.00 0.00 2.37 2.31 0.00 32 S 8.40 4.33 0.00 3.92 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 33 Y 8.01 4.40 0.00 3.25 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 34 K 8.58 3.50 0.00 1.35 1.22 0.00 1.40 0.00 0.00 0.89 0.00 0.00 2.89 0.00 0.00 2.63 0.00 0.00 0.00 0.00 0.30 1.01 7.81 35 F 7.64 4.71 0.00 2.21 2.43 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 K 8.78 4.16 0.00 2.01 1.81 0.00 1.75 0.00 0.00 1.65 0.00 0.00 2.97 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.37 1.43 7.81 37 H 7.83 5.26 0.00 3.26 3.28 0.00 5.82 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 Q 8.78 4.29 0.00 0.93 1.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.87 0.00 0.00 0.00 0.00 0.00 2.23 2.37 0.00 39 L 8.67 4.90 0.00 1.69 1.64 0.73 0.59 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 40 S 9.36 4.90 0.00 3.84 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 41 L 8.54 5.37 0.00 1.59 1.59 0.97 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 42 T 9.17 4.87 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 1.17 0.00 0.00 43 F 9.22 5.42 0.00 3.31 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 44 Q 8.30 5.39 0.00 2.02 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.53 0.00 0.00 0.00 0.00 0.00 2.21 1.97 0.00 45 V 8.11 4.58 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 1.30 0.00 0.00 0.95 0.00 0.00 46 T 8.14 5.04 4.20 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 1.25 0.00 0.00 47 Q 8.90 4.56 0.00 2.17 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.92 0.00 0.00 0.00 0.00 0.00 2.09 2.26 0.00 48 K 8.71 4.19 0.00 1.87 1.69 0.00 1.79 0.00 0.00 1.84 0.00 0.00 2.89 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.54 1.51 7.81 49 T 9.05 3.92 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 8.20 4.31 0.00 2.23 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 7.36 0.00 0.00 0.00 0.00 0.00 2.41 2.48 0.00 51 R 8.21 4.73 0.00 1.90 1.76 0.00 3.19 0.00 0.00 3.32 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 1.69 0.00 52 R 8.54 4.04 0.00 2.09 2.33 0.00 2.92 0.00 0.00 3.30 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.89 0.00 53 W 8.53 4.51 0.00 3.67 3.44 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 54 F 6.93 3.33 0.00 1.51 2.56 0.00 0.00 0.00 0.00 0.00 0.00 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 7.69 4.02 0.00 1.90 1.82 1.01 1.34 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 56 D 8.69 4.46 0.00 2.88 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 57 K 8.26 3.95 0.00 1.95 1.74 0.00 1.64 0.00 0.00 1.61 0.00 0.00 3.07 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.51 1.41 7.81 58 L 7.33 3.98 0.00 1.45 0.83 0.74 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 0.00 0.00 0.00 0.00 59 V 7.48 3.75 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 1.11 0.00 0.00 1.22 0.00 0.00 60 D 7.63 4.30 0.00 2.65 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 61 E 8.27 3.90 0.00 1.76 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 2.11 2.37 0.00 62 I 8.06 4.07 1.85 0.00 0.00 0.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.45 0.64 0.00 0.00 63 G 9.38 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 0.00 0.00 0.00 64 V 7.58 4.31 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 0.75 0.00 0.00 1.01 0.00 0.00 65 G 10.41 3.79 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 0.00 0.00 0.00 66 Y 7.36 4.88 0.00 3.11 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 8.55 4.91 2.18 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 0.92 0.00 0.00 1.14 0.00 0.00 68 R 9.17 4.85 0.00 2.01 2.21 0.00 2.89 0.00 0.00 3.14 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.58 0.00 69 D 8.71 5.15 0.00 2.73 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 70 R 8.29 4.73 0.00 1.92 1.90 0.00 3.13 0.00 0.00 3.23 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.71 0.00 71 G 7.91 4.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 S 8.80 4.05 0.00 4.03 4.14 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 73 V 7.38 4.94 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 0.97 0.00 0.00 0.93 0.00 0.00 74 S 9.17 5.29 0.00 3.77 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 75 D 8.95 5.25 0.00 2.54 2.41 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 76 Y 9.15 4.78 0.00 3.05 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 77 I 7.78 4.57 0.76 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.87 0.27 0.63 0.00 0.00 78 L 8.58 4.54 0.00 1.69 1.73 0.97 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 79 S 8.82 4.67 0.00 3.93 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 80 E 8.37 3.97 0.00 2.08 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 2.48 2.51 0.00 81 I 8.65 3.77 1.94 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.98 0.99 0.00 0.00 82 K 8.04 3.99 0.00 1.91 1.85 0.00 1.64 0.00 0.00 1.84 0.00 0.00 3.09 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.54 1.64 7.81 83 P 0.00 4.40 0.00 2.29 2.19 0.00 3.93 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 2.18 2.21 0.00 84 L 8.24 4.10 0.00 2.00 2.00 1.12 0.89 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 8.39 4.09 0.00 3.43 3.49 0.00 5.65 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 86 N 8.44 4.40 0.00 2.99 3.12 0.00 0.00 6.92 7.33 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 87 F 8.72 4.43 0.00 3.21 3.10 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 88 L 8.24 3.50 0.00 1.70 1.57 0.98 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 89 T 7.57 3.76 4.43 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 1.19 0.00 0.00 90 Q 7.43 4.14 0.00 2.30 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.11 6.97 0.00 0.00 0.00 0.00 0.00 2.47 2.55 0.00 91 L 7.83 3.96 0.00 0.82 1.00 0.82 0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 92 Q 8.11 3.72 0.00 2.06 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 6.57 0.00 0.00 0.00 0.00 0.00 2.25 2.45 0.00 93 P 0.00 4.09 0.00 1.49 1.80 0.00 3.48 0.00 0.00 3.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.77 1.55 0.00 94 F 7.39 4.84 0.00 3.04 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 95 L 7.52 4.34 0.00 1.74 1.63 0.91 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 96 K 9.43 4.52 0.00 1.72 1.79 0.00 1.66 0.00 0.00 1.70 0.00 0.00 3.00 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.36 1.37 7.81 97 L 8.38 4.55 0.00 1.73 1.66 0.88 0.79 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 98 K 7.94 5.05 0.00 1.83 1.77 0.00 1.68 0.00 0.00 1.68 0.00 0.00 2.96 0.00 0.00 3.28 0.00 0.00 0.00 0.00 1.33 1.27 7.81 99 Q 8.20 3.86 0.00 2.14 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.80 6.85 0.00 0.00 0.00 0.00 0.00 2.47 2.49 0.00 100 K 8.05 3.83 0.00 1.80 1.80 0.00 1.69 0.00 0.00 1.83 0.00 0.00 2.95 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.48 1.47 7.81 101 Q 8.05 3.98 0.00 2.25 2.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.91 0.00 0.00 0.00 0.00 0.00 2.57 2.38 0.00 102 A 7.87 3.97 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 0.00 103 N 8.44 4.20 0.00 2.84 2.78 0.00 0.00 7.08 6.33 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 0.00 104 L 7.93 3.83 0.00 1.81 1.66 0.87 0.36 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 0.00 105 V 8.03 3.61 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 1.18 0.00 0.00 1.06 0.00 0.00 106 L 8.04 3.97 0.00 1.82 1.82 0.72 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 107 K 7.88 3.94 0.00 1.73 1.81 0.00 1.52 0.00 0.00 1.38 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.40 1.42 7.81 108 I 8.19 4.10 2.14 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.11 0.99 0.00 0.00 109 I 8.13 3.79 2.16 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 1.61 1.24 1.00 0.00 0.00 110 E 8.19 4.15 0.00 2.16 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 2.38 2.52 0.00 111 Q 7.97 4.55 0.00 2.33 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.77 0.00 0.00 0.00 0.00 0.00 2.52 2.75 0.00 112 L 7.69 4.04 0.00 1.85 1.81 1.01 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 113 P 0.00 4.33 0.00 2.26 2.25 0.00 3.75 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.08 0.00 114 S 8.09 4.23 0.00 3.96 4.14 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 0.00 115 A 8.67 4.29 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 0.00 116 K 8.04 4.59 0.00 2.07 2.10 0.00 1.81 0.00 0.00 1.83 0.00 0.00 3.11 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.51 1.57 7.81 117 E 8.57 4.79 0.00 2.23 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 2.28 2.30 0.00 118 S 7.73 4.79 0.00 3.85 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 0.00 119 P 0.00 3.81 0.00 2.17 2.06 0.00 3.67 0.00 0.00 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 2.53 0.00 120 D 7.84 4.46 0.00 2.63 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 0.00 121 K 7.62 3.84 0.00 1.76 1.79 0.00 1.65 0.00 0.00 1.74 0.00 0.00 2.89 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.42 1.41 7.81 122 F 8.51 3.93 0.00 3.00 2.43 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 0.00 123 L 7.16 3.78 0.00 1.88 1.66 0.80 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 124 E 7.91 3.57 0.00 1.91 1.64 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 1.47 1.84 0.00 125 V 7.12 2.51 1.79 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 0.94 0.00 0.00 0.79 0.00 0.00 126 C 7.43 3.83 0.00 2.92 2.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 127 T 7.46 3.90 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 128 W 8.10 4.60 0.00 3.38 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 0.00 129 V 7.93 3.64 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 0.90 0.00 0.00 130 D 8.00 4.40 0.00 3.04 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 7.92 4.02 0.00 2.28 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.43 6.80 0.00 0.00 0.00 0.00 0.00 2.43 2.66 0.00 132 I 7.87 3.68 2.04 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 1.46 1.10 0.93 0.00 0.00 133 A 7.88 3.99 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 0.00 134 A 8.06 4.08 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 7.77 4.11 0.00 1.81 1.73 0.94 0.82 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 0.00 136 N 7.64 4.68 0.00 2.86 2.76 0.00 0.00 7.01 7.35 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 0.00 137 D 8.08 4.62 0.00 2.64 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 0.00 138 S 7.69 4.25 0.00 3.99 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 0.00 139 K 8.65 4.63 0.00 1.71 1.77 0.00 1.73 0.00 0.00 1.74 0.00 0.00 3.00 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.31 1.55 7.81 140 T 7.69 4.65 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 8.08 4.19 0.00 1.79 1.86 0.00 3.17 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 1.61 1.65 0.00 142 K 8.21 4.39 0.00 1.74 1.75 0.00 1.80 0.00 0.00 1.71 0.00 0.00 2.98 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.32 1.41 7.81 143 T 7.79 4.09 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 1.31 0.00 0.00 144 T 8.51 4.71 4.34 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 1.26 0.00 0.00 145 S 8.66 4.04 0.00 3.97 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 0.00 146 E 8.09 3.91 0.00 1.94 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 2.29 2.43 0.00 147 T 7.44 4.03 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 0.00 148 V 7.81 3.69 2.18 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 1.12 0.00 0.00 0.86 0.00 0.00 149 R 7.51 4.32 0.00 1.97 2.13 0.00 3.28 0.00 0.00 3.21 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.63 0.00 150 A 8.50 4.50 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 0.00 151 V 7.65 3.67 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 0.91 0.00 0.00 1.05 0.00 0.00 152 L 7.11 4.12 0.00 1.83 1.72 1.00 1.05 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 8.72 4.42 0.00 2.90 2.84 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