NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 0 M 4.4041 8.3044 120.3239 54.6697 33.3377 174.8782 1 E 3.8855 8.8162 124.6301 55.3328 30.2668 175.0262 2 T 4.5637 8.6601 116.1029 59.7514 73.5593 175.3932 3 V 3.6180 8.1570 119.9804 66.2503 31.3466 177.5563 4 Q 4.0348 8.1289 118.7177 59.3346 28.7083 177.9002 5 D 4.3523 7.8857 118.7737 57.5435 41.0400 177.6541 6 C 4.4474 8.2666 116.9597 60.2971 35.5189 176.2307 7 E 3.9218 8.3855 119.9117 59.5200 28.8669 179.0645 8 N 4.4026 8.2959 115.8189 55.3997 38.6231 176.4137 9 K 4.3960 7.2933 117.6021 55.4828 33.5723 176.6046 10 L 3.9994 7.0990 120.5152 54.5773 42.3499 175.5025 11 P 4.4436 0.0000 0.0000 61.8613 31.9783 175.3534 12 P 4.2142 0.0000 0.0000 66.2606 30.9284 178.9600 13 S 4.2205 8.0855 111.4210 60.8230 63.1549 175.5002 14 L 4.4245 8.3907 121.9041 55.9070 42.4558 178.6075 15 K 3.8703 8.0713 118.4310 59.4631 31.7794 178.5966 16 S 4.3659 7.6447 110.0414 59.7991 63.5767 174.8416 17 R 4.6572 7.8636 120.4139 56.0056 30.4436 177.5274 18 L 3.9351 7.7984 123.1333 58.7395 41.7950 178.5136 19 C 4.3130 8.1100 115.8291 59.7233 36.5770 175.7056 20 E 3.9113 8.1075 119.7944 59.5404 29.1429 178.9573 21 I 3.6821 7.7431 119.6709 64.7601 37.0736 178.3599 22 R 3.9112 8.0373 116.0403 57.6109 30.0684 177.9345 23 R 4.4140 7.3190 116.7718 55.3969 30.2564 175.6963 24 Y 3.7461 7.3114 114.4641 58.3192 35.9324 169.7805 25 E 4.2104 8.0012 119.3643 56.1427 30.1055 176.9772 26 I 4.1885 8.2933 124.5154 61.0828 37.8843 175.5477 27 I 4.5997 8.2820 125.1911 59.6308 40.2825 175.0275 28 E 4.4390 8.5649 124.7045 55.5634 31.1365 175.2309 29 G 4.0556 8.6433 106.6655 43.9300 0.0000 173.3226 30 P 4.5970 0.0000 0.0000 65.0134 31.2512 178.6100 31 E 4.0286 8.1166 118.3563 59.4787 29.3991 178.8477 32 M 4.0433 7.9875 118.3999 58.3185 31.8040 178.0273 33 D 4.4458 8.3178 119.1745 57.5350 41.0158 179.3971 34 K 4.0526 7.8097 118.4861 59.6844 32.1508 178.8805 35 H 4.1778 8.3548 118.6050 59.5188 29.7317 177.4056 36 I 3.4888 7.9257 121.7986 64.2410 36.7151 177.7820 37 H 4.0736 8.0185 119.1709 59.3837 29.6347 176.3289 38 C 4.2384 8.1597 120.0771 60.0471 43.5057 176.1103 39 V 3.5687 7.8845 113.8683 64.5799 31.1690 178.5901 40 M 4.4515 8.4394 118.7129 58.2930 31.7783 179.0697 41 R 3.8420 8.3230 118.4842 59.1909 30.0439 178.8589 42 A 3.9603 7.8702 119.3983 54.5348 18.4538 178.6922 43 L 3.9504 7.4946 114.2911 53.6507 42.2777 175.8691 44 D 4.3707 7.5487 117.2740 55.5227 39.6842 174.5259 45 F 5.0563 8.4845 117.3490 57.7625 40.1360 176.4677 46 V 4.7898 7.3582 111.8814 59.2438 35.3055 174.7189 47 Y 4.3327 8.7812 120.5596 57.4469 38.6742 177.0241 48 E 4.0758 8.8607 119.8798 59.4814 29.5533 178.1083 49 D 4.5228 8.1160 115.9122 53.8446 39.8057 176.9966 50 G 4.0743 8.4711 109.4772 44.7896 0.0000 173.3228 51 R 4.0321 8.5858 121.9826 55.9782 31.0088 176.1192 52 G 2.4909 8.0312 113.5660 46.3619 0.0000 172.1722 53 D 4.8912 8.8066 124.4197 52.6921 41.9119 176.0553 54 Y 4.1158 9.0398 128.5401 61.2035 38.7450 177.8921 55 H 4.6799 8.7679 114.6755 57.3583 29.1429 176.3915 56 K 4.3895 8.0167 117.5018 57.5881 32.4744 177.5743 57 L 4.6305 7.7549 117.2272 55.4434 44.6931 177.6944 58 Y 3.8272 8.1642 119.3103 60.9405 38.4449 178.3094 59 D 4.2403 8.1532 118.6998 56.9853 41.2968 176.6324 60 P 4.2109 0.0000 0.0000 65.6344 31.2657 178.4538 61 L 3.7879 8.0876 117.8655 58.0760 41.3353 179.5652 62 N 4.4116 7.5573 114.5526 56.1571 38.4196 177.3572 63 I 3.8590 7.7211 121.0422 64.2118 37.2146 178.1905 64 I 4.1641 7.4026 119.5755 62.9672 37.1857 176.1276 65 E 4.2995 7.9909 121.6904 54.7300 30.7962 174.0965 66 L 4.1548 8.3612 129.2069 55.1996 42.8701 175.9879 67 D 4.2817 8.8065 122.3995 52.0154 44.1535 176.3602 68 K 4.1268 8.5413 127.1916 59.7226 32.4928 179.0425 69 R 3.7018 8.5399 119.7184 58.8637 29.8002 178.4211 70 H 4.4667 7.8366 117.9634 58.2622 28.6758 176.7169 71 D 4.6186 8.2959 119.2850 57.8165 40.9877 178.4468 72 V 3.6534 7.4122 117.9617 66.2440 31.5055 177.8184 73 N 4.3480 8.6412 116.5304 56.1038 38.3031 177.2969 74 L 4.0563 8.2694 120.8176 58.0805 41.7517 179.5137 75 E 4.0856 8.3737 118.3327 59.2412 29.4144 179.3229 76 K 3.9391 8.1380 119.6560 59.9003 32.3248 178.1876 77 C 4.4532 8.4448 116.5184 59.4933 39.2001 176.2097 78 I 3.8838 8.4401 122.1245 64.4320 36.5423 178.3568 79 G 3.8335 8.0532 105.1609 48.1835 0.0000 175.1593 80 E 4.1943 8.3179 120.9713 59.2648 29.5344 179.2218 81 C 4.2513 8.3313 114.6760 61.2518 29.6059 176.0474 82 V 3.6775 7.7559 119.7845 65.4840 31.1283 177.3284 83 Q 4.2000 7.7464 116.1311 56.3285 29.0996 176.1726 84 V 4.3542 6.7915 113.4968 58.4293 33.5675 173.9929 85 P 4.3259 0.0000 0.0000 63.4510 31.5640 177.3380 86 T 3.8777 8.5522 114.6225 65.0633 67.4950 176.0810 87 S 4.2499 7.2048 112.2709 60.4276 63.1555 174.8292 88 E 4.6770 8.7303 119.1909 55.6500 32.5388 176.1418 89 R 4.1416 8.1785 118.3191 59.3326 30.3660 177.8488 90 A 4.3745 8.0108 121.6189 55.0565 18.4596 178.9829 91 H 4.3434 8.3112 116.3084 59.2835 30.0349 177.4861 92 V 3.6181 7.9226 119.9957 65.8375 31.3531 177.4866 93 F 4.1825 8.2281 120.1025 61.6564 38.8520 176.3022 94 Y 3.8847 8.2913 118.7119 60.7373 38.6216 178.2994 95 K 3.9980 8.6991 119.6271 59.5592 32.3182 178.4028 96 C 4.1098 8.5191 118.9844 59.7090 41.8025 175.5070 97 L 3.5736 7.6787 120.7502 57.8427 40.8669 179.7137 98 L 3.9687 7.4901 117.3668 57.3416 41.5514 179.1801 99 K 4.1620 7.7192 117.3922 57.1381 32.5227 177.4222 100 S 4.4697 7.1964 114.3269 57.1010 64.0545 175.2342 101 T 3.8148 8.2492 110.5073 64.8379 68.6728 176.1452 102 T 4.1799 7.7814 118.6236 65.0212 68.3738 176.5319 103 G 3.7993 7.9255 109.2315 48.1704 0.0000 175.8889 104 R 3.8123 7.8289 118.2981 58.9491 29.4206 178.7814 105 T 3.7249 7.6606 115.9338 65.9252 68.5829 176.3021 106 F 4.1363 8.3892 123.0951 61.4996 39.2522 177.4162 107 K 3.0145 7.5392 117.6713 58.9055 31.5502 179.5466 108 K 3.7982 7.2289 118.4005 59.3638 31.8170 179.6129 109 V 3.5742 7.6510 118.5564 65.7543 31.3345 177.9228 110 F 4.2758 8.3329 120.7770 61.4380 39.3459 176.8381 111 D 4.6894 8.5857 118.5922 57.5748 40.6681 178.7565 112 L 3.8573 8.3771 119.7253 58.0849 41.5992 179.3567 113 M 3.9528 8.3723 118.2464 58.3842 32.1092 177.7203 114 E 3.7993 8.3252 119.6805 59.4915 29.8029 178.9125 115 L 3.9778 7.9214 118.4463 57.2223 41.5712 179.5970 116 K 4.1553 8.2842 118.9950 59.4234 31.7607 179.5521 117 K 3.9935 8.0311 117.6474 58.9395 32.0602 178.4634 118 A 4.3607 7.6086 118.1884 51.8190 18.6109 177.9441 119 G 3.8935 7.4748 105.2917 46.0937 0.0000 175.3002 120 K 4.2602 8.1778 120.4076 57.7894 32.4856 177.5634 121 V 4.5979 7.3200 110.0926 58.4254 35.8322 173.1919 122 P 4.5265 0.0000 0.0000 62.5689 31.8329 177.5155 123 Q 4.0146 8.6733 118.4786 58.8675 28.6887 177.2684 124 H 4.6675 8.1348 110.8689 54.7825 29.1041 174.7971 125 Q 3.6558 7.5086 121.4856 57.2713 28.9964 176.7992 126 R 4.3884 8.0943 123.4502 54.7130 32.1320 176.4203 127 Y 3.9907 8.1382 121.1361 56.8053 37.2362 174.7067 128 T 4.5948 7.5889 116.0268 58.7879 73.2512 174.7729 129 A 3.9439 8.3711 122.0512 55.4111 18.1893 179.2686 130 E 3.8438 8.1474 117.1407 59.4047 29.6307 178.5779 131 F 3.9607 8.0531 120.6132 61.2419 39.4183 177.0544 132 V 3.2970 7.6010 117.7721 66.1133 31.1778 177.8439 133 Q 3.9004 7.8422 118.6652 59.0343 28.9077 177.9781 134 I 3.5820 7.8643 121.3283 64.6999 37.0554 178.1115 135 M 3.8821 7.7031 119.0685 58.2419 31.9916 178.3238 136 K 3.9250 7.9924 118.7398 59.7398 32.1678 179.0647 137 D 4.3819 8.2755 119.1179 57.3004 40.2875 178.2712 138 Y 3.9412 8.0060 120.2007 60.8739 38.8463 177.8492 139 D 4.6083 8.5752 120.1419 57.0045 40.8666 178.5113 140 K 3.8879 8.1961 120.1359 59.5216 31.9895 178.4710 141 A 4.0726 7.6062 118.8172 53.8052 18.3449 178.3613 142 L 4.2909 6.8353 116.3117 53.8445 41.9879 176.2077 143 N 4.3541 8.0350 116.3362 54.4270 37.8767 173.3838 144 C 4.6011 8.5344 119.7484 56.5850 41.7596 173.8390 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 0 M 8.30 4.40 0.00 1.99 2.05 0.00 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.47 2.50 0.00 1 E 8.82 3.89 0.00 2.00 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 0.00 2.31 2.37 0.00 2 T 8.66 4.56 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 1.26 0.00 0.00 3 V 8.16 3.62 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 1.21 0.00 0.00 0.92 0.00 0.00 4 Q 8.13 4.03 0.00 2.24 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.68 0.00 0.00 0.00 0.00 0.00 2.45 2.48 0.00 5 D 7.89 4.35 0.00 2.99 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 6 C 8.27 4.45 0.00 3.25 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 7 E 8.39 3.92 0.00 2.20 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 2.40 2.67 0.00 8 N 8.30 4.40 0.00 2.85 2.90 0.00 0.00 7.00 7.84 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 9 K 7.29 4.40 0.00 1.85 1.91 0.00 1.64 0.00 0.00 1.72 0.00 0.00 3.07 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.60 1.47 7.81 10 L 7.10 4.00 0.00 1.78 1.61 0.77 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 11 P 0.00 4.44 0.00 2.21 2.17 0.00 3.70 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 2.06 2.13 0.00 12 P 0.00 4.21 0.00 2.17 2.17 0.00 3.59 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.17 0.00 13 S 8.09 4.22 0.00 4.02 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 14 L 8.39 4.42 0.00 1.74 1.68 0.90 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 15 K 8.07 3.87 0.00 1.91 1.86 0.00 1.65 0.00 0.00 1.85 0.00 0.00 2.98 0.00 0.00 3.21 0.00 0.00 0.00 0.00 1.51 1.49 7.81 16 S 7.64 4.37 0.00 4.02 3.98 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 17 R 7.86 4.66 0.00 1.87 2.05 0.00 3.14 0.00 0.00 3.10 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.66 0.00 18 L 7.80 3.94 0.00 1.87 1.67 0.94 0.95 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 19 C 8.11 4.31 0.00 3.00 3.11 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 20 E 8.11 3.91 0.00 2.18 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 0.00 2.53 2.41 0.00 21 I 7.74 3.68 2.00 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.79 0.92 0.00 0.00 22 R 8.04 3.91 0.00 1.73 1.93 0.00 3.52 0.00 0.00 3.24 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.79 0.00 23 R 7.32 4.41 0.00 1.91 2.00 0.00 3.33 0.00 0.00 3.24 7.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 2.03 0.00 24 Y 7.31 3.75 0.00 3.04 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 25 E 8.00 4.21 0.00 2.12 1.92 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 2.38 2.32 0.00 26 I 8.29 4.19 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 1.47 0.78 1.03 0.00 0.00 27 I 8.28 4.60 1.92 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 1.45 0.82 0.94 0.00 0.00 28 E 8.56 4.44 0.00 1.98 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.26 0.00 29 G 8.64 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 0.00 0.00 0.00 30 P 0.00 4.60 0.00 2.29 2.34 0.00 3.88 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 2.08 1.92 0.00 31 E 8.12 4.03 0.00 2.01 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.40 2.34 0.00 32 M 7.99 4.04 0.00 2.03 2.30 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 2.85 2.58 0.00 33 D 8.32 4.45 0.00 2.94 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 34 K 7.81 4.05 0.00 1.99 1.87 0.00 1.68 0.00 0.00 1.58 0.00 0.00 2.92 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.46 1.63 7.81 35 H 8.35 4.18 0.00 3.20 3.26 0.00 5.78 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 36 I 7.93 3.49 1.61 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 1.22 0.01 0.42 0.00 0.00 37 H 8.02 4.07 0.00 3.34 3.50 0.00 5.79 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 C 8.16 4.24 0.00 3.21 3.27 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 39 V 7.88 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 0.72 0.00 0.00 1.09 0.00 0.00 40 M 8.44 4.45 0.00 2.30 2.31 0.00 0.00 0.00 0.00 0.00 2.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.94 3.09 0.00 41 R 8.32 3.84 0.00 1.97 1.93 0.00 3.35 0.00 0.00 3.34 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.69 0.00 42 A 7.87 3.96 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 43 L 7.49 3.95 0.00 1.01 0.68 -0.38 0.58 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 44 D 7.55 4.37 0.00 2.58 2.54 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 45 F 8.48 5.06 0.00 3.28 3.19 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 0.00 0.00 0.00 0.00 46 V 7.36 4.79 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 0.88 0.00 0.00 0.94 0.00 0.00 47 Y 8.78 4.33 0.00 3.07 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 48 E 8.86 4.08 0.00 2.03 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 2.37 2.41 0.00 49 D 8.12 4.52 0.00 2.81 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 50 G 8.47 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 0.00 0.00 0.00 51 R 8.59 4.03 0.00 1.96 1.91 0.00 3.06 0.00 0.00 3.09 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.55 0.00 52 G 8.03 2.49 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 53 D 8.81 4.89 0.00 2.47 2.64 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 54 Y 9.04 4.12 0.00 3.04 2.72 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 55 H 8.77 4.68 0.00 3.39 3.45 0.00 5.70 0.00 0.00 0.00 0.00 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 K 8.02 4.39 0.00 2.04 2.13 0.00 1.66 0.00 0.00 1.96 0.00 0.00 2.88 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.49 1.44 7.81 57 L 7.75 4.63 0.00 1.63 1.55 0.92 0.54 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 58 Y 8.16 3.83 0.00 2.54 2.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 D 8.15 4.24 0.00 2.82 2.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 60 P 0.00 4.21 0.00 2.17 2.15 0.00 3.67 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 2.45 2.24 0.00 61 L 8.09 3.79 0.00 1.53 1.08 0.69 0.41 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 62 N 7.56 4.41 0.00 2.61 2.71 0.00 0.00 7.16 7.48 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 63 I 7.72 3.86 1.96 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 1.51 0.53 0.89 0.00 0.00 64 I 7.40 4.16 1.89 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 1.57 0.65 0.80 0.00 0.00 65 E 7.99 4.30 0.00 1.83 1.80 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 2.19 2.21 0.00 66 L 8.36 4.15 0.00 1.59 1.54 0.95 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 67 D 8.81 4.28 0.00 2.51 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 68 K 8.54 4.13 0.00 2.04 2.06 0.00 1.56 0.00 0.00 1.81 0.00 0.00 2.99 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.47 1.53 7.81 69 R 8.54 3.70 0.00 1.84 1.96 0.00 3.08 0.00 0.00 3.13 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.70 0.00 70 H 7.84 4.47 0.00 3.05 3.16 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 71 D 8.30 4.62 0.00 3.21 3.05 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 72 V 7.41 3.65 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 0.99 0.00 0.00 1.01 0.00 0.00 73 N 8.64 4.35 0.00 2.87 2.76 0.00 0.00 7.04 6.31 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 74 L 8.27 4.06 0.00 1.89 1.85 0.46 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 75 E 8.37 4.09 0.00 2.23 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 2.73 2.54 0.00 76 K 8.14 3.94 0.00 1.93 2.00 0.00 1.61 0.00 0.00 1.62 0.00 0.00 2.94 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.45 1.49 7.81 77 C 8.44 4.45 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 78 I 8.44 3.88 2.05 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.09 0.94 0.00 0.00 79 G 8.05 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 0.00 0.00 0.00 80 E 8.32 4.19 0.00 2.24 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 2.35 2.47 0.00 81 C 8.33 4.25 0.00 3.50 3.47 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 82 V 7.76 3.68 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.85 0.00 0.00 0.98 0.00 0.00 83 Q 7.75 4.20 0.00 2.22 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.49 0.00 0.00 0.00 0.00 0.00 2.40 2.51 0.00 84 V 6.79 4.35 2.12 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 0.78 0.00 0.00 1.09 0.00 0.00 85 P 0.00 4.33 0.00 2.23 2.22 0.00 3.72 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 2.00 0.00 86 T 8.55 3.88 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 87 S 7.20 4.25 0.00 4.10 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 88 E 8.73 4.68 0.00 1.97 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 2.26 2.30 0.00 89 R 8.18 4.14 0.00 2.11 2.11 0.00 3.40 0.00 0.00 3.36 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.82 0.00 90 A 8.01 4.37 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 91 H 8.31 4.34 0.00 3.25 3.36 0.00 5.70 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 92 V 7.92 3.62 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 0.98 0.00 0.00 1.00 0.00 0.00 93 F 8.23 4.18 0.00 3.33 3.38 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 94 Y 8.29 3.88 0.00 3.35 3.31 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 95 K 8.70 4.00 0.00 2.04 1.86 0.00 1.71 0.00 0.00 1.52 0.00 0.00 2.34 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.58 1.76 7.81 96 C 8.52 4.11 0.00 2.97 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 97 L 7.68 3.57 0.00 1.07 0.87 -0.48 0.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.55 0.00 0.00 0.00 0.00 0.00 0.00 98 L 7.49 3.97 0.00 1.56 1.57 0.20 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 99 K 7.72 4.16 0.00 1.80 1.81 0.00 1.75 0.00 0.00 1.73 0.00 0.00 3.06 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.43 1.49 7.81 100 S 7.20 4.47 0.00 4.13 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 0.00 101 T 8.25 3.81 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 1.17 0.00 0.00 102 T 7.78 4.18 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 1.08 0.00 0.00 103 G 7.93 3.80 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 0.00 0.00 0.00 104 R 7.83 3.81 0.00 1.92 2.10 0.00 2.90 0.00 0.00 3.28 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.63 0.00 105 T 7.66 3.72 4.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 106 F 8.39 4.14 0.00 2.77 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 0.00 107 K 7.54 3.01 0.00 1.41 1.22 0.00 1.18 0.00 0.00 1.06 0.00 0.00 2.68 0.00 0.00 2.68 0.00 0.00 0.00 0.00 0.30 0.97 7.81 108 K 7.23 3.80 0.00 1.72 1.28 0.00 1.24 0.00 0.00 0.63 0.00 0.00 2.58 0.00 0.00 2.35 0.00 0.00 0.00 0.00 0.30 1.13 7.81 109 V 7.65 3.57 2.16 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 1.18 0.00 0.00 0.91 0.00 0.00 110 F 8.33 4.28 0.00 2.72 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 0.00 111 D 8.59 4.69 0.00 3.34 3.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 112 L 8.38 3.86 0.00 1.81 1.57 0.87 0.03 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 0.00 113 M 8.37 3.95 0.00 2.02 2.16 0.00 0.00 0.00 0.00 0.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.29 0.00 114 E 8.33 3.80 0.00 2.09 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 0.00 2.22 2.36 0.00 115 L 7.92 3.98 0.00 1.95 1.72 0.60 0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 116 K 8.28 4.16 0.00 1.95 1.83 0.00 1.62 0.00 0.00 1.62 0.00 0.00 3.05 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.58 1.63 7.81 117 K 8.03 3.99 0.00 1.73 1.82 0.00 1.53 0.00 0.00 1.60 0.00 0.00 2.80 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.39 1.47 7.81 118 A 7.61 4.36 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 0.00 119 G 7.47 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 0.00 120 K 8.18 4.26 0.00 1.75 1.91 0.00 1.85 0.00 0.00 1.79 0.00 0.00 3.01 0.00 0.00 3.27 0.00 0.00 0.00 0.00 1.67 1.58 7.81 121 V 7.32 4.60 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 0.95 0.00 0.00 1.00 0.00 0.00 122 P 0.00 4.53 0.00 2.28 2.23 0.00 3.85 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.97 0.00 123 Q 8.67 4.01 0.00 2.09 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 7.08 0.00 0.00 0.00 0.00 0.00 2.37 2.30 0.00 124 H 8.13 4.67 0.00 3.26 3.37 0.00 5.56 0.00 0.00 0.00 0.00 6.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 125 Q 7.51 3.66 0.00 2.03 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.74 6.78 0.00 0.00 0.00 0.00 0.00 2.29 2.11 0.00 126 R 8.09 4.39 0.00 1.80 1.83 0.00 3.25 0.00 0.00 3.15 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.67 0.00 127 Y 8.14 3.99 0.00 2.80 2.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 128 T 7.59 4.59 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 1.26 0.00 0.00 129 A 8.37 3.94 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 0.00 130 E 8.15 3.84 0.00 2.04 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 2.37 2.36 0.00 131 F 8.05 3.96 0.00 3.05 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 0.00 132 V 7.60 3.30 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 0.92 0.00 0.00 0.74 0.00 0.00 133 Q 7.84 3.90 0.00 2.19 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.55 0.00 0.00 0.00 0.00 0.00 2.32 2.40 0.00 134 I 7.86 3.58 1.69 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 1.36 0.79 0.78 0.00 0.00 135 M 7.70 3.88 0.00 1.84 1.44 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.64 0.00 136 K 7.99 3.92 0.00 2.05 1.82 0.00 1.69 0.00 0.00 1.63 0.00 0.00 2.94 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.45 1.47 7.81 137 D 8.28 4.38 0.00 2.82 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 0.00 138 Y 8.01 3.94 0.00 3.16 3.08 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 0.00 139 D 8.58 4.61 0.00 2.89 2.72 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 0.00 140 K 8.20 3.89 0.00 1.94 1.97 0.00 1.61 0.00 0.00 1.64 0.00 0.00 2.92 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.41 1.45 7.81 141 A 7.61 4.07 1.14 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 0.00 0.00 142 L 6.84 4.29 0.00 1.89 1.66 0.93 0.88 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 0.00 143 N 8.04 4.35 0.00 2.82 2.92 0.00 0.00 6.90 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 144 C 8.53 4.60 0.00 3.05 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